smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1cc(CN2CCN3CCCC[C@H]3C2)ccc1Br	ZINC000252703555	713673724	/nfs/dbraw/zinc/67/37/24/713673724.db2.gz	KJJJJELWVOTMOF-ZDUSSCGKSA-N	0	3	354.248	3.027	10	5		FGBEHN
O=[N+]([O-])c1ccc(-c2nc(CN3CCC(c4ccn[nH]4)CC3)co2)cc1	ZINC000089891962	494394901	/nfs/dbraw/zinc/39/49/01/494394901.db2.gz	KXEKPVFYRIGNLS-UHFFFAOYSA-N	0	3	353.382	3.353	10	5		FGBEHN
Cc1nccn1C[C@@H]1CCCN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000119331549	495143601	/nfs/dbraw/zinc/14/36/01/495143601.db2.gz	YBXNWQZOPZIQOS-SFHVURJKSA-N	0	3	367.409	3.419	10	5		FGBEHN
CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCN2CC(C)C)c1	ZINC000160389927	495951957	/nfs/dbraw/zinc/95/19/57/495951957.db2.gz	FCALYHIDQUMIRM-CYBMUJFWSA-N	0	3	351.472	3.167	10	5		FGBEHN
CCn1cc(C2CCN(CCC(=O)Nc3ccccc3[N+](=O)[O-])CC2)cn1	ZINC000160457824	495967836	/nfs/dbraw/zinc/96/78/36/495967836.db2.gz	ATWHIKQIQYFWJU-UHFFFAOYSA-N	0	3	371.441	3.019	10	5		FGBEHN
Cc1cccc(NC[C@@H]2CCN(CCOc3ccccc3[N+](=O)[O-])C2)n1	ZINC000171648756	495969310	/nfs/dbraw/zinc/96/93/10/495969310.db2.gz	KVTZWZZIOHHRBK-INIZCTEOSA-N	0	3	356.426	3.111	10	5		FGBEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000190465058	497489512	/nfs/dbraw/zinc/48/95/12/497489512.db2.gz	UIPXRBXXFFLQGK-INIZCTEOSA-N	0	3	360.483	3.314	10	5		FGBEHN
C[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1N1CCOCC1	ZINC000245724687	497517084	/nfs/dbraw/zinc/51/70/84/497517084.db2.gz	IOVULFYDTAXKFU-DNVCBOLYSA-N	0	3	371.437	3.007	10	5		FGBEHN
CN(Cc1cccnc1)C[C@H]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000434646240	500872594	/nfs/dbraw/zinc/87/25/94/500872594.db2.gz	PDGWHUKLZHKIGG-NVAPOSRTSA-N	0	3	366.465	3.457	10	5		FGBEHN
CN(Cc1cccnc1)C[C@@H]1CCN(c2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000190447117	257368394	/nfs/dbraw/zinc/36/83/94/257368394.db2.gz	MMVISQUSLICZLK-AWEZNQCLSA-N	0	3	362.380	3.226	10	5		FGBEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1	ZINC000080080700	494588930	/nfs/dbraw/zinc/58/89/30/494588930.db2.gz	ZIKCUUBIOOCBOG-HNNXBMFYSA-N	0	3	350.463	3.105	10	5		FGBEHN
CC(C)N1C[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@@H](C)C1	ZINC000131979404	494790391	/nfs/dbraw/zinc/79/03/91/494790391.db2.gz	NNDSMIOFPMRBQU-HZMBPMFUSA-N	0	3	359.348	3.072	10	5		FGBEHN
C[C@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1	ZINC000026712997	494834786	/nfs/dbraw/zinc/83/47/86/494834786.db2.gz	PXVCSVPMXZEDPV-BLLLJJGKSA-N	0	3	350.802	3.339	10	5		FGBEHN
CCc1nccn1[C@@H]1CCCN(CCOc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000173699159	495652965	/nfs/dbraw/zinc/65/29/65/495652965.db2.gz	UBTVNPIMDIPVMK-OAHLLOKOSA-N	0	3	374.441	3.078	10	5		FGBEHN
Cc1ncsc1CN(C)C[C@H]1CCN(Cc2cccc([N+](=O)[O-])c2)C1	ZINC000190465030	497490203	/nfs/dbraw/zinc/49/02/03/497490203.db2.gz	LETNHBQMSYCHCJ-MRXNPFEDSA-N	0	3	360.483	3.314	10	5		FGBEHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1cc(CO)ccc1[N+](=O)[O-]	ZINC000302059086	498389519	/nfs/dbraw/zinc/38/95/19/498389519.db2.gz	RIGZKHAQQUXISX-MAUKXSAKSA-N	0	3	355.438	3.410	10	5		FGBEHN
NC(=O)c1ccc(NC[C@H]2CCCCN2Cc2ccccc2)c([N+](=O)[O-])c1	ZINC000379670950	499542600	/nfs/dbraw/zinc/54/26/00/499542600.db2.gz	KDVGEWMSWZDUIC-QGZVFWFLSA-N	0	3	368.437	3.160	10	5		FGBEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000310993501	713801645	/nfs/dbraw/zinc/80/16/45/713801645.db2.gz	IFFLFDLICSLATI-ZDUSSCGKSA-N	0	3	361.829	3.499	10	5		FGBEHN
CCOc1ccc([C@@H](C)N[C@@H]2CCc3nc(C(C)C)nn3C2)cc1[N+](=O)[O-]	ZINC000180642021	496083179	/nfs/dbraw/zinc/08/31/79/496083179.db2.gz	KNWJFKIREUVTRU-UKRRQHHQSA-N	0	3	373.457	3.374	10	5		FGBEHN
CN(Cc1cccnc1)C[C@@H]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000190480580	497498325	/nfs/dbraw/zinc/49/83/25/497498325.db2.gz	PDGWHUKLZHKIGG-MEQKGCOVSA-N	0	3	366.465	3.457	10	5		FGBEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1	ZINC000246515608	497760021	/nfs/dbraw/zinc/76/00/21/497760021.db2.gz	TXSFATMBODWCPT-ZWNOBZJWSA-N	0	3	372.372	3.046	10	5		FGBEHN
COc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC[C@H]1c1ccco1	ZINC000116290307	494754082	/nfs/dbraw/zinc/75/40/82/494754082.db2.gz	HYUYHPLKRCPWLD-HNNXBMFYSA-N	0	3	359.382	3.362	10	5		FGBEHN
O=[N+]([O-])c1cnc(Nc2cnn(CCN3CCCCC3)c2)c(Cl)c1	ZINC000092978355	494800725	/nfs/dbraw/zinc/80/07/25/494800725.db2.gz	LHXDNYSEGUJRBW-UHFFFAOYSA-N	0	3	350.810	3.069	10	5		FGBEHN
O=[N+]([O-])c1ccc(-c2ccc(CN3CCC[C@@H](Cn4cncn4)C3)o2)cc1	ZINC000128622276	495125323	/nfs/dbraw/zinc/12/53/23/495125323.db2.gz	IOTXKRDICBYUPK-OAHLLOKOSA-N	0	3	367.409	3.359	10	5		FGBEHN
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N(C)[C@@H]1CCCN(c2cccnn2)C1	ZINC000182749257	495688128	/nfs/dbraw/zinc/68/81/28/495688128.db2.gz	FADARTIZQMPRDF-DOTOQJQBSA-N	0	3	355.442	3.355	10	5		FGBEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000177706674	496166147	/nfs/dbraw/zinc/16/61/47/496166147.db2.gz	CDBVQGXAECCDFV-BBRMVZONSA-N	0	3	359.430	3.122	10	5		FGBEHN
CC[C@H](NC[C@H](O)COCc1cccs1)c1cccc([N+](=O)[O-])c1	ZINC000181550637	496442149	/nfs/dbraw/zinc/44/21/49/496442149.db2.gz	VZJWPRUBTSBBEZ-RDJZCZTQSA-N	0	3	350.440	3.275	10	5		FGBEHN
C[C@@H]1CCN(c2cc(CO)ccc2[N+](=O)[O-])CCN1Cc1ccccc1	ZINC000302021818	498372171	/nfs/dbraw/zinc/37/21/71/498372171.db2.gz	FUBVYCWWQTZUFL-MRXNPFEDSA-N	0	3	355.438	3.188	10	5		FGBEHN
C[C@@H](NC[C@H]1CN(C)CCO1)c1ccc(-c2ccccc2[N+](=O)[O-])s1	ZINC000180500098	496022705	/nfs/dbraw/zinc/02/27/05/496022705.db2.gz	RRIQCGQCALITSB-KGLIPLIRSA-N	0	3	361.467	3.305	10	5		FGBEHN
CN(Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCCN(c2cccnn2)C1	ZINC000153792109	496582385	/nfs/dbraw/zinc/58/23/85/496582385.db2.gz	NYVIMPGLFMPFBH-CQSZACIVSA-N	0	3	361.833	3.139	10	5		FGBEHN
CC(C)c1nc2n(n1)C[C@@H](N[C@H]1CCCc3ccc([N+](=O)[O-])cc31)CC2	ZINC000192984729	497267385	/nfs/dbraw/zinc/26/73/85/497267385.db2.gz	HXIKZVKTYHRGJN-YOEHRIQHSA-N	0	3	355.442	3.292	10	5		FGBEHN
CC(C)c1nnc2n1C[C@H](N[C@H]1CCCc3ccc([N+](=O)[O-])cc31)CC2	ZINC000193089234	497299910	/nfs/dbraw/zinc/29/99/10/497299910.db2.gz	NHOHNCGNZQNTDU-PBHICJAKSA-N	0	3	355.442	3.292	10	5		FGBEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000182098834	705825714	/nfs/dbraw/zinc/82/57/14/705825714.db2.gz	ZBOVSUPFSBOPCF-ZDUSSCGKSA-N	0	3	361.829	3.499	10	5		FGBEHN
CCc1nccn1[C@@H]1CCCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000106217575	495435954	/nfs/dbraw/zinc/43/59/54/495435954.db2.gz	IBMQFOAYOJHYDW-QGZVFWFLSA-N	0	3	371.441	3.019	10	5		FGBEHN
CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1C[C@@H](OCC)C12CCOCC2	ZINC000185654960	495664400	/nfs/dbraw/zinc/66/44/00/495664400.db2.gz	LWCHCFVKNFTANP-QZTJIDSGSA-N	0	3	364.442	3.057	10	5		FGBEHN
Cc1cccc(NC[C@H]2CCN(CCOc3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000171648505	495969180	/nfs/dbraw/zinc/96/91/80/495969180.db2.gz	UQIFYAOUWSRKEL-MRXNPFEDSA-N	0	3	356.426	3.111	10	5		FGBEHN
CC[C@@H](NC[C@@H](O)COc1cccc(C(C)=O)c1)c1cccc([N+](=O)[O-])c1	ZINC000181541535	496438421	/nfs/dbraw/zinc/43/84/21/496438421.db2.gz	AYPNKCXSOLXWFS-UYAOXDASSA-N	0	3	372.421	3.278	10	5		FGBEHN
Cc1c(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)cccc1[N+](=O)[O-]	ZINC000195297329	496879521	/nfs/dbraw/zinc/87/95/21/496879521.db2.gz	VSOBBJBKEHEZTH-SFHVURJKSA-N	0	3	354.454	3.252	10	5		FGBEHN
C[C@@H](NC(=O)N[C@@H](C)CN(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000245855735	497550951	/nfs/dbraw/zinc/55/09/51/497550951.db2.gz	NNAFTDDWGYILNM-JKSUJKDBSA-N	0	3	370.453	3.476	10	5		FGBEHN
C[C@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccc(F)c(Cl)c1	ZINC000182405970	705839542	/nfs/dbraw/zinc/83/95/42/705839542.db2.gz	LIKMIHLMEAPKOZ-WCQYABFASA-N	0	3	368.792	3.478	10	5		FGBEHN
CN(C)C[C@@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000007817215	494045832	/nfs/dbraw/zinc/04/58/32/494045832.db2.gz	MHWLGHIOZOCSTQ-QGZVFWFLSA-N	0	3	359.451	3.106	10	5		FGBEHN
CC[C@@H](NC[C@H](O)CN1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1	ZINC000151792113	495949074	/nfs/dbraw/zinc/94/90/74/495949074.db2.gz	LAGRPFCNAWRBHM-LEWJYISDSA-N	0	3	369.465	3.055	10	5		FGBEHN
CCO[C@@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2Cl)C12CCOCC2	ZINC000186509355	496025288	/nfs/dbraw/zinc/02/52/88/496025288.db2.gz	CMWPSBBVBJGNSR-JKSUJKDBSA-N	0	3	354.834	3.312	10	5		FGBEHN
CN(Cc1cccnc1)C[C@H]1CCN(Cc2c(F)cccc2[N+](=O)[O-])C1	ZINC000195296310	496879670	/nfs/dbraw/zinc/87/96/70/496879670.db2.gz	OJLLNXQUUSORSA-MRXNPFEDSA-N	0	3	358.417	3.083	10	5		FGBEHN
O=[N+]([O-])c1nccn1CCCNc1c2ccccc2nc2c1CCCC2	ZINC000008464947	204332740	/nfs/dbraw/zinc/33/27/40/204332740.db2.gz	MVJAYDNDKKEHSU-UHFFFAOYSA-N	0	3	351.410	3.142	10	5		FGBEHN
COc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC[C@@H]1c1ccco1	ZINC000116290304	494753260	/nfs/dbraw/zinc/75/32/60/494753260.db2.gz	HYUYHPLKRCPWLD-OAHLLOKOSA-N	0	3	359.382	3.362	10	5		FGBEHN
Cc1cnn([C@@H]2CCCN(CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)c1	ZINC000106225587	495438907	/nfs/dbraw/zinc/43/89/07/495438907.db2.gz	PBRCXLHLJVZPIN-QGZVFWFLSA-N	0	3	371.441	3.074	10	5		FGBEHN
CN(C)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1	ZINC000170866006	495632666	/nfs/dbraw/zinc/63/26/66/495632666.db2.gz	JQFSINZAAPXRES-HNNXBMFYSA-N	0	3	355.394	3.163	10	5		FGBEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000179708225	495699559	/nfs/dbraw/zinc/69/95/59/495699559.db2.gz	PMROAQSHPBHBPE-ZDUSSCGKSA-N	0	3	361.829	3.499	10	5		FGBEHN
CCO[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)C12CCOCC2	ZINC000186418810	495990943	/nfs/dbraw/zinc/99/09/43/495990943.db2.gz	RYLBTQBFIQMRRH-CVEARBPZSA-N	0	3	354.834	3.312	10	5		FGBEHN
Nc1ccc([N+](=O)[O-])c(NCC2CCN(C[C@@H](O)c3ccccc3)CC2)c1	ZINC000193411321	497374284	/nfs/dbraw/zinc/37/42/84/497374284.db2.gz	ADJVUCHGKVVQOY-HXUWFJFHSA-N	0	3	370.453	3.035	10	5		FGBEHN
CN(C)[C@@H](CNc1ccc([N+](=O)[O-])cc1C(N)=O)c1ccc(Cl)cc1	ZINC000301485328	498131359	/nfs/dbraw/zinc/13/13/59/498131359.db2.gz	WLIHZMRLKZKUSR-INIZCTEOSA-N	0	3	362.817	3.062	10	5		FGBEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000182082982	705824996	/nfs/dbraw/zinc/82/49/96/705824996.db2.gz	VKZRFOVEPREHMW-ZDUSSCGKSA-N	0	3	361.829	3.499	10	5		FGBEHN
C[C@@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccc(Cl)s1	ZINC000183022832	705874461	/nfs/dbraw/zinc/87/44/61/705874461.db2.gz	NQHIIAAMATXGQL-MNOVXSKESA-N	0	3	356.831	3.400	10	5		FGBEHN
O=C1C[C@@H](c2cc(F)c(F)cc2F)C([N+](=O)[O-])CN1Cc1ccccc1	ZINC000098091260	209206521	/nfs/dbraw/zinc/20/65/21/209206521.db2.gz	XMGMJEQNEFDSGJ-SUMWQHHRSA-N	0	3	364.323	3.265	10	5		FGBEHN
CC(C)(C)OC(=O)N1CC([N+](=O)[O-])[C@@H](c2ccccc2Cl)CC1=O	ZINC000098091264	209206527	/nfs/dbraw/zinc/20/65/27/209206527.db2.gz	SDECXKQTRYKVCF-DGCLKSJQSA-N	0	3	354.790	3.236	10	5		FGBEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1	ZINC000068223138	493781376	/nfs/dbraw/zinc/78/13/76/493781376.db2.gz	XHTQDZCIFUPUFN-KBPBESRZSA-N	0	3	353.488	3.168	10	5		FGBEHN
CN(C)C[C@H]1CN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CCO1	ZINC000108951683	494809622	/nfs/dbraw/zinc/80/96/22/494809622.db2.gz	MCJOKBSNUOVUCY-VIFPVBQESA-N	0	3	367.755	3.034	10	5		FGBEHN
CN(C)C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1	ZINC000117583916	494933620	/nfs/dbraw/zinc/93/36/20/494933620.db2.gz	MTNGQTAFIXHSHZ-KRWDZBQOSA-N	0	3	361.829	3.210	10	5		FGBEHN
C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC(c2ccn[nH]2)CC1	ZINC000195505782	496944847	/nfs/dbraw/zinc/94/48/47/496944847.db2.gz	LZLUMTONYFFGNE-LBPRGKRZSA-N	0	3	368.397	3.309	10	5		FGBEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1	ZINC000245429402	497400730	/nfs/dbraw/zinc/40/07/30/497400730.db2.gz	KJGQQQMUGNREBJ-ZFWWWQNUSA-N	0	3	351.472	3.018	10	5		FGBEHN
Cc1cccc(NC[C@@H]2CCN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)n1	ZINC000193855402	497503213	/nfs/dbraw/zinc/50/32/13/497503213.db2.gz	IPXROLHHKIASHW-AWEZNQCLSA-N	0	3	371.397	3.140	10	5		FGBEHN
C[C@@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(F)c(Cl)c1	ZINC000180730818	705755162	/nfs/dbraw/zinc/75/51/62/705755162.db2.gz	JZVSUFMLQIMEAH-RISCZKNCSA-N	0	3	368.792	3.478	10	5		FGBEHN
O=C1C[C@@H](c2cc(F)c(F)cc2F)C([N+](=O)[O-])CN1Cc1ccccc1	ZINC000098091259	209205345	/nfs/dbraw/zinc/20/53/45/209205345.db2.gz	XMGMJEQNEFDSGJ-GUYCJALGSA-N	0	3	364.323	3.265	10	5		FGBEHN
O=[N+]([O-])c1ccc(-c2ccc(CN3CCC[C@H](Cn4cncn4)C3)o2)cc1	ZINC000128622025	495125513	/nfs/dbraw/zinc/12/55/13/495125513.db2.gz	IOTXKRDICBYUPK-HNNXBMFYSA-N	0	3	367.409	3.359	10	5		FGBEHN
Cc1cnn([C@H]2CCCN(CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)c1	ZINC000106225585	495438686	/nfs/dbraw/zinc/43/86/86/495438686.db2.gz	PBRCXLHLJVZPIN-KRWDZBQOSA-N	0	3	371.441	3.074	10	5		FGBEHN
Cc1cccc(NC[C@H]2CCN(CCOc3cccc([N+](=O)[O-])c3)C2)n1	ZINC000171649436	495968616	/nfs/dbraw/zinc/96/86/16/495968616.db2.gz	WDMQVMONJJEMQK-MRXNPFEDSA-N	0	3	356.426	3.111	10	5		FGBEHN
C[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2	ZINC000181758455	496531917	/nfs/dbraw/zinc/53/19/17/496531917.db2.gz	FNCRKKCOFCGNIG-CYBMUJFWSA-N	0	3	371.393	3.045	10	5		FGBEHN
CN(Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCCN(c2cccnn2)C1	ZINC000153792215	496582143	/nfs/dbraw/zinc/58/21/43/496582143.db2.gz	NYVIMPGLFMPFBH-AWEZNQCLSA-N	0	3	361.833	3.139	10	5		FGBEHN
Cc1cccc(NC[C@H]2CCN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)n1	ZINC000193855416	497502628	/nfs/dbraw/zinc/50/26/28/497502628.db2.gz	IPXROLHHKIASHW-CQSZACIVSA-N	0	3	371.397	3.140	10	5		FGBEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1	ZINC000068223137	493781317	/nfs/dbraw/zinc/78/13/17/493781317.db2.gz	XHTQDZCIFUPUFN-ZIAGYGMSSA-N	0	3	353.488	3.168	10	5		FGBEHN
C[C@@H]1CN(CC2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)C[C@@H](C)O1	ZINC000091478911	494607124	/nfs/dbraw/zinc/60/71/24/494607124.db2.gz	QIMILONIXKSLET-ZIAGYGMSSA-N	0	3	351.422	3.060	10	5		FGBEHN
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1	ZINC000026713006	494834881	/nfs/dbraw/zinc/83/48/81/494834881.db2.gz	PXVCSVPMXZEDPV-LRDDRELGSA-N	0	3	350.802	3.339	10	5		FGBEHN
Cc1cccc(NC[C@H]2CCN(Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)n1	ZINC000177034860	495894616	/nfs/dbraw/zinc/89/46/16/495894616.db2.gz	LQDCMKYYDPTLOL-CQSZACIVSA-N	0	3	367.409	3.373	10	5		FGBEHN
C[C@H](NC[C@H]1CN(C)CCO1)c1ccc(-c2ccccc2[N+](=O)[O-])s1	ZINC000180500074	496022503	/nfs/dbraw/zinc/02/25/03/496022503.db2.gz	RRIQCGQCALITSB-KBPBESRZSA-N	0	3	361.467	3.305	10	5		FGBEHN
CC[C@@H](NC[C@@H]1CCCN1c1cc(NC)ncn1)c1cccc([N+](=O)[O-])c1	ZINC000180576820	496051915	/nfs/dbraw/zinc/05/19/15/496051915.db2.gz	PCTOIKOWSNXNGM-DLBZAZTESA-N	0	3	370.457	3.136	10	5		FGBEHN
COc1ccc([C@H]2[C@@H](CNc3ncccc3[N+](=O)[O-])CCCN2C)cc1	ZINC000301246630	498019284	/nfs/dbraw/zinc/01/92/84/498019284.db2.gz	AWTWMMKQCIGLLR-QAPCUYQASA-N	0	3	356.426	3.493	10	5		FGBEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000182096614	705825481	/nfs/dbraw/zinc/82/54/81/705825481.db2.gz	QFIAPWKIBLMBPJ-ZDUSSCGKSA-N	0	3	361.829	3.499	10	5		FGBEHN
CCC[C@H](N[C@H]1CCCN(c2cccnn2)C1)c1cccc([N+](=O)[O-])c1	ZINC000089732082	494350782	/nfs/dbraw/zinc/35/07/82/494350782.db2.gz	ZVUNUXOZHXUYJZ-WMZOPIPTSA-N	0	3	355.442	3.485	10	5		FGBEHN
CCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCCN1CC	ZINC000160011879	495863657	/nfs/dbraw/zinc/86/36/57/495863657.db2.gz	TYXFPYDTBWXFKQ-AWEZNQCLSA-N	0	3	351.472	3.263	10	5		FGBEHN
CN(Cc1cccnc1)C[C@@H]1CCN(Cc2c(F)cccc2[N+](=O)[O-])C1	ZINC000195296303	496880030	/nfs/dbraw/zinc/88/00/30/496880030.db2.gz	OJLLNXQUUSORSA-INIZCTEOSA-N	0	3	358.417	3.083	10	5		FGBEHN
CN(Cc1cccnc1)C[C@@H]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000434646241	500872710	/nfs/dbraw/zinc/87/27/10/500872710.db2.gz	PDGWHUKLZHKIGG-ZXYDQQDNSA-N	0	3	366.465	3.457	10	5		FGBEHN
NC(=O)c1ccc(NC[C@@H]2CCCCN2Cc2ccccc2)c([N+](=O)[O-])c1	ZINC000065201977	494179352	/nfs/dbraw/zinc/17/93/52/494179352.db2.gz	KDVGEWMSWZDUIC-KRWDZBQOSA-N	0	3	368.437	3.160	10	5		FGBEHN
CN(C)C[C@@H]1CN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CCO1	ZINC000108951681	494809434	/nfs/dbraw/zinc/80/94/34/494809434.db2.gz	MCJOKBSNUOVUCY-SECBINFHSA-N	0	3	367.755	3.034	10	5		FGBEHN
O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCc4ncnn4C3)s2)cc1	ZINC000109072071	494827104	/nfs/dbraw/zinc/82/71/04/494827104.db2.gz	SPYNUXGRBVCNKX-ZDUSSCGKSA-N	0	3	355.423	3.019	10	5		FGBEHN
CC(C)N1C[C@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000183091490	495830234	/nfs/dbraw/zinc/83/02/34/495830234.db2.gz	WONCKJHGPIPVGQ-AAEUAGOBSA-N	0	3	371.890	3.185	10	5		FGBEHN
CNc1cc(N2CCC[C@H]2CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)ncn1	ZINC000180567665	496047166	/nfs/dbraw/zinc/04/71/66/496047166.db2.gz	QNKKQUGXHDLBQK-GJZGRUSLSA-N	0	3	370.457	3.055	10	5		FGBEHN
Nc1ccc([N+](=O)[O-])c(NCC2CCN(C[C@H](O)c3ccccc3)CC2)c1	ZINC000193411335	497374313	/nfs/dbraw/zinc/37/43/13/497374313.db2.gz	ADJVUCHGKVVQOY-FQEVSTJZSA-N	0	3	370.453	3.035	10	5		FGBEHN
Cc1ccc(N(C)C2CCN(CCc3ccccn3)CC2)c([N+](=O)[O-])c1	ZINC000301802712	498270753	/nfs/dbraw/zinc/27/07/53/498270753.db2.gz	CXPSSBJZQGQNJI-UHFFFAOYSA-N	0	3	354.454	3.442	10	5		FGBEHN
O=[N+]([O-])c1cc(F)c(Nc2cnn(CCN3CCCCC3)c2)c(F)c1	ZINC000092978372	494800557	/nfs/dbraw/zinc/80/05/57/494800557.db2.gz	UFJLMKLZRRUNSK-UHFFFAOYSA-N	0	3	351.357	3.299	10	5		FGBEHN
CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1C[C@H](OCC)C12CCOCC2	ZINC000185654942	495664114	/nfs/dbraw/zinc/66/41/14/495664114.db2.gz	LWCHCFVKNFTANP-ROUUACIJSA-N	0	3	364.442	3.057	10	5		FGBEHN
C[C@@H](NC[C@@H]1CN(C)CCO1)c1ccc(-c2ccccc2[N+](=O)[O-])s1	ZINC000180500055	496022562	/nfs/dbraw/zinc/02/25/62/496022562.db2.gz	RRIQCGQCALITSB-ZIAGYGMSSA-N	0	3	361.467	3.305	10	5		FGBEHN
CCO[C@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2Cl)C12CCOCC2	ZINC000186509376	496026025	/nfs/dbraw/zinc/02/60/25/496026025.db2.gz	CMWPSBBVBJGNSR-HOTGVXAUSA-N	0	3	354.834	3.312	10	5		FGBEHN
CC[C@@H](NC[C@H]1CCCN1c1cc(NC)ncn1)c1cccc([N+](=O)[O-])c1	ZINC000180576856	496051974	/nfs/dbraw/zinc/05/19/74/496051974.db2.gz	PCTOIKOWSNXNGM-IAGOWNOFSA-N	0	3	370.457	3.136	10	5		FGBEHN
COc1cc(CN2CC[C@@H](CNc3cccc(C)n3)C2)c([N+](=O)[O-])cc1F	ZINC000184219651	496291156	/nfs/dbraw/zinc/29/11/56/496291156.db2.gz	GQSDHOCLTFETAU-AWEZNQCLSA-N	0	3	374.416	3.380	10	5		FGBEHN
CC(C)c1nnc2n1C[C@@H](N[C@H]1CCCc3ccc([N+](=O)[O-])cc31)CC2	ZINC000193089247	497299855	/nfs/dbraw/zinc/29/98/55/497299855.db2.gz	NHOHNCGNZQNTDU-YOEHRIQHSA-N	0	3	355.442	3.292	10	5		FGBEHN
Cn1cc(CN2CC[C@@]3(O)CCCC[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000245767341	497534333	/nfs/dbraw/zinc/53/43/33/497534333.db2.gz	RBJHHWXXLADBAO-PXNSSMCTSA-N	0	3	370.453	3.122	10	5		FGBEHN
O=[N+]([O-])c1cnc(NC[C@H]2NCCc3ccccc32)c(Br)c1	ZINC000262403495	497550360	/nfs/dbraw/zinc/55/03/60/497550360.db2.gz	CNAQUQLPQDBSRW-CQSZACIVSA-N	0	3	363.215	3.051	10	5		FGBEHN
CCOCCN1CCN(c2ccc([N+](=O)[O-])c3cccnc32)C[C@@H]1CC	ZINC000116871250	494864321	/nfs/dbraw/zinc/86/43/21/494864321.db2.gz	STFONTWHCBMJNW-HNNXBMFYSA-N	0	3	358.442	3.080	10	5		FGBEHN
CC(C)C[C@H](CN(C)C)NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000133277247	494993724	/nfs/dbraw/zinc/99/37/24/494993724.db2.gz	ZMLGEQKVNNOYFC-MRXNPFEDSA-N	0	3	362.474	3.245	10	5		FGBEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1ccc(Br)cc1[N+](=O)[O-]	ZINC000137105949	495423612	/nfs/dbraw/zinc/42/36/12/495423612.db2.gz	MJPUOEXQXNCMPV-GFCCVEGCSA-N	0	3	372.263	3.063	10	5		FGBEHN
COc1cc(CN2CC[C@H](CNc3cccc(C)n3)C2)c([N+](=O)[O-])cc1F	ZINC000184219666	496291981	/nfs/dbraw/zinc/29/19/81/496291981.db2.gz	GQSDHOCLTFETAU-CQSZACIVSA-N	0	3	374.416	3.380	10	5		FGBEHN
O=[N+]([O-])c1ccc(Cn2nc(-c3ccc(F)cc3)c3c2CCNC3)cc1	ZINC000167737905	496705426	/nfs/dbraw/zinc/70/54/26/496705426.db2.gz	HOTZEPNWHMLULE-UHFFFAOYSA-N	0	3	352.369	3.291	10	5		FGBEHN
O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CCc3ncnn3C2)s1	ZINC000109072511	494826615	/nfs/dbraw/zinc/82/66/15/494826615.db2.gz	WXWZJBOKFSPIMT-LBPRGKRZSA-N	0	3	355.423	3.019	10	5		FGBEHN
COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000123075921	495077060	/nfs/dbraw/zinc/07/70/60/495077060.db2.gz	QYUOJNGACYKPGI-MRXNPFEDSA-N	0	3	358.398	3.028	10	5		FGBEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000177013558	495883864	/nfs/dbraw/zinc/88/38/64/495883864.db2.gz	BGRRRFIIPXQYMW-OAHLLOKOSA-N	0	3	374.466	3.275	10	5		FGBEHN
CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000160783119	496040939	/nfs/dbraw/zinc/04/09/39/496040939.db2.gz	JDUFGGVGSHSMRP-WFASDCNBSA-N	0	3	351.472	3.165	10	5		FGBEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000246996385	496747242	/nfs/dbraw/zinc/74/72/42/496747242.db2.gz	GRLZMXFWUPARQB-IUODEOHRSA-N	0	3	374.466	3.177	10	5		FGBEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000248375351	496987231	/nfs/dbraw/zinc/98/72/31/496987231.db2.gz	WONCKJHGPIPVGQ-WCQYABFASA-N	0	3	371.890	3.185	10	5		FGBEHN
O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000246371783	497711030	/nfs/dbraw/zinc/71/10/30/497711030.db2.gz	YOQZZVSJJHGSDZ-YSIASYRMSA-N	0	3	356.422	3.216	10	5		FGBEHN
NC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000301116514	497957889	/nfs/dbraw/zinc/95/78/89/497957889.db2.gz	UROUUEWBTMWSKI-KRWDZBQOSA-N	0	3	368.437	3.160	10	5		FGBEHN
Cc1cc(N2CCCN(C3CCOCC3)CC2)c(Cl)cc1[N+](=O)[O-]	ZINC000080645855	494754800	/nfs/dbraw/zinc/75/48/00/494754800.db2.gz	DHAHCFRYUJKXSO-UHFFFAOYSA-N	0	3	353.850	3.248	10	5		FGBEHN
Cc1nccn1C[C@H]1CCCN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000119331667	495143361	/nfs/dbraw/zinc/14/33/61/495143361.db2.gz	YBXNWQZOPZIQOS-GOSISDBHSA-N	0	3	367.409	3.419	10	5		FGBEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1ccc([N+](=O)[O-])cc1Br	ZINC000119826435	495249411	/nfs/dbraw/zinc/24/94/11/495249411.db2.gz	OOCBBLNKEBSBOY-LLVKDONJSA-N	0	3	372.263	3.063	10	5		FGBEHN
CNc1cc(N2CCC[C@H]2CN[C@H](C)c2cccc([N+](=O)[O-])c2C)ncn1	ZINC000180567644	496047701	/nfs/dbraw/zinc/04/77/01/496047701.db2.gz	QNKKQUGXHDLBQK-CABCVRRESA-N	0	3	370.457	3.055	10	5		FGBEHN
Cc1nc(C)n(C[C@H]2CCCN(C/C=C\c3ccccc3[N+](=O)[O-])C2)n1	ZINC000255841484	497376294	/nfs/dbraw/zinc/37/62/94/497376294.db2.gz	DTANYTCLKBFFFP-SKHCZCESSA-N	0	3	355.442	3.229	10	5		FGBEHN
CN(c1cc(F)ccc1[N+](=O)[O-])C1CCN(CCc2ccccn2)CC1	ZINC000302823459	498589367	/nfs/dbraw/zinc/58/93/67/498589367.db2.gz	UTZKESMBHXORJV-UHFFFAOYSA-N	0	3	358.417	3.272	10	5		FGBEHN
O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCc4ncnn4C3)s2)cc1	ZINC000109072069	494826662	/nfs/dbraw/zinc/82/66/62/494826662.db2.gz	SPYNUXGRBVCNKX-CYBMUJFWSA-N	0	3	355.423	3.019	10	5		FGBEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000177013521	495883901	/nfs/dbraw/zinc/88/39/01/495883901.db2.gz	ZTRDNDHCLVMKGG-OAHLLOKOSA-N	0	3	374.466	3.275	10	5		FGBEHN
C[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1N1CCOCC1	ZINC000180227948	495915335	/nfs/dbraw/zinc/91/53/35/495915335.db2.gz	IOVULFYDTAXKFU-BEFAXECRSA-N	0	3	371.437	3.007	10	5		FGBEHN
C[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1N1CCOCC1	ZINC000180229522	495916048	/nfs/dbraw/zinc/91/60/48/495916048.db2.gz	FQMVPXFQHKUHRA-BEFAXECRSA-N	0	3	371.437	3.007	10	5		FGBEHN
Cc1cc(N(C)C[C@H]2CCCN(C)C2)nc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000301261455	498026556	/nfs/dbraw/zinc/02/65/56/498026556.db2.gz	FJYNFDIRVVAHQJ-HNNXBMFYSA-N	0	3	355.442	3.138	10	5		FGBEHN
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000052555828	494040206	/nfs/dbraw/zinc/04/02/06/494040206.db2.gz	RFIOADHEGPBLHZ-KBXCAEBGSA-N	0	3	373.478	3.495	10	5		FGBEHN
CN(C)CCN1C(=O)c2cccc3cc4ccc([N+](=O)[O-])cc4c(c32)C1=O	ZINC000027554897	494873047	/nfs/dbraw/zinc/87/30/47/494873047.db2.gz	FZHDOFLWEMLXDK-UHFFFAOYSA-N	0	3	363.373	3.059	10	5		FGBEHN
Cc1nn(C)c(C)c1[C@@H]1CCCN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000106211853	495433451	/nfs/dbraw/zinc/43/34/51/495433451.db2.gz	HPHBCODOYPXTSF-KRWDZBQOSA-N	0	3	371.441	3.111	10	5		FGBEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000176311345	495593766	/nfs/dbraw/zinc/59/37/66/495593766.db2.gz	MECJSWYCOQCZRF-LBPRGKRZSA-N	0	3	372.372	3.144	10	5		FGBEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000176311329	495593967	/nfs/dbraw/zinc/59/39/67/495593967.db2.gz	MECJSWYCOQCZRF-GFCCVEGCSA-N	0	3	372.372	3.144	10	5		FGBEHN
CCO[C@H]1C[C@H](NCc2ccc(Cl)c([N+](=O)[O-])c2)C12CCOCC2	ZINC000185658759	495666899	/nfs/dbraw/zinc/66/68/99/495666899.db2.gz	OBYFRPRZEAKSIG-HOTGVXAUSA-N	0	3	354.834	3.312	10	5		FGBEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1	ZINC000176975921	495865549	/nfs/dbraw/zinc/86/55/49/495865549.db2.gz	KJGQQQMUGNREBJ-HIFRSBDPSA-N	0	3	351.472	3.018	10	5		FGBEHN
CC[C@@H](NCCn1cnc2ccccc2c1=O)c1cccc([N+](=O)[O-])c1	ZINC000181535081	496436064	/nfs/dbraw/zinc/43/60/64/496436064.db2.gz	VBHHGHFAMZDFBS-QGZVFWFLSA-N	0	3	352.394	3.046	10	5		FGBEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000247480624	496868712	/nfs/dbraw/zinc/86/87/12/496868712.db2.gz	SPUISWUEWIDYBK-DOMZBBRYSA-N	0	3	372.450	3.027	10	5		FGBEHN
CC(C)c1nc2n(n1)C[C@@H](N[C@@H]1CCCc3ccc([N+](=O)[O-])cc31)CC2	ZINC000192984701	497267211	/nfs/dbraw/zinc/26/72/11/497267211.db2.gz	HXIKZVKTYHRGJN-WMLDXEAASA-N	0	3	355.442	3.292	10	5		FGBEHN
CCOc1ccc([C@@H](C)N[C@@H]2CCCN(c3cccnn3)C2)cc1[N+](=O)[O-]	ZINC000089732602	494350652	/nfs/dbraw/zinc/35/06/52/494350652.db2.gz	KWBSBYDZIZEXFI-GDBMZVCRSA-N	0	3	371.441	3.103	10	5		FGBEHN
CCOCCN1CCN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@H]1CC	ZINC000110560697	494988451	/nfs/dbraw/zinc/98/84/51/494988451.db2.gz	BIBOVDOQFZEQTM-OAHLLOKOSA-N	0	3	358.442	3.080	10	5		FGBEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000183091472	495830602	/nfs/dbraw/zinc/83/06/02/495830602.db2.gz	WONCKJHGPIPVGQ-YPMHNXCESA-N	0	3	371.890	3.185	10	5		FGBEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000155375700	495938286	/nfs/dbraw/zinc/93/82/86/495938286.db2.gz	GRLZMXFWUPARQB-DOMZBBRYSA-N	0	3	374.466	3.177	10	5		FGBEHN
CCO[C@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2Cl)C12CCOCC2	ZINC000186509408	496026034	/nfs/dbraw/zinc/02/60/34/496026034.db2.gz	CMWPSBBVBJGNSR-CVEARBPZSA-N	0	3	354.834	3.312	10	5		FGBEHN
CC[C@H](NC[C@@H](O)COc1cccc(C(C)=O)c1)c1cccc([N+](=O)[O-])c1	ZINC000181541517	496438564	/nfs/dbraw/zinc/43/85/64/496438564.db2.gz	AYPNKCXSOLXWFS-QUCCMNQESA-N	0	3	372.421	3.278	10	5		FGBEHN
COc1ccc([C@@H]2[C@H](CNc3ccc([N+](=O)[O-])cn3)CCCN2C)cc1	ZINC000301298624	498045614	/nfs/dbraw/zinc/04/56/14/498045614.db2.gz	QDMMLHFOGQDMFY-HNAYVOBHSA-N	0	3	356.426	3.493	10	5		FGBEHN
C[C@H]1CN(CCC2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)C[C@H](C)O1	ZINC000301565692	498165523	/nfs/dbraw/zinc/16/55/23/498165523.db2.gz	PXJNCEUBPIIDCG-GJZGRUSLSA-N	0	3	365.449	3.450	10	5		FGBEHN
C[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccc(F)c(Cl)c1	ZINC000182405991	705839195	/nfs/dbraw/zinc/83/91/95/705839195.db2.gz	LIKMIHLMEAPKOZ-DGCLKSJQSA-N	0	3	368.792	3.478	10	5		FGBEHN
CN(Cc1cccnc1)C[C@H]1CCN(c2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000190447137	257368130	/nfs/dbraw/zinc/36/81/30/257368130.db2.gz	MMVISQUSLICZLK-CQSZACIVSA-N	0	3	362.380	3.226	10	5		FGBEHN
C[C@@H]1CN(CC2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)C[C@H](C)O1	ZINC000091478904	494606413	/nfs/dbraw/zinc/60/64/13/494606413.db2.gz	QIMILONIXKSLET-OKILXGFUSA-N	0	3	351.422	3.060	10	5		FGBEHN
CN(C)C[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1	ZINC000128082459	495041538	/nfs/dbraw/zinc/04/15/38/495041538.db2.gz	OFPOOJOIXFYIMT-AWEZNQCLSA-N	0	3	361.467	3.086	10	5		FGBEHN
CCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCCN1CC	ZINC000160011732	495863536	/nfs/dbraw/zinc/86/35/36/495863536.db2.gz	TYXFPYDTBWXFKQ-CQSZACIVSA-N	0	3	351.472	3.263	10	5		FGBEHN
C[C@@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccc(-c2ccccc2)cc1	ZINC000174660477	496050115	/nfs/dbraw/zinc/05/01/15/496050115.db2.gz	MESOWHPCXRDZIQ-FOIQADDNSA-N	0	3	366.421	3.170	10	5		FGBEHN
C[C@@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1N1CCOCC1	ZINC000245773650	497534849	/nfs/dbraw/zinc/53/48/49/497534849.db2.gz	SIHMCSGYKNNGHN-DNVCBOLYSA-N	0	3	371.437	3.007	10	5		FGBEHN
O=[N+]([O-])c1ccc(CO)cc1NCC1(N2CCSCC2)CCCCC1	ZINC000302031921	498377524	/nfs/dbraw/zinc/37/75/24/498377524.db2.gz	KIIZRPMQEGDLPE-UHFFFAOYSA-N	0	3	365.499	3.251	10	5		FGBEHN
C[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(Cl)s1	ZINC000193114494	712882498	/nfs/dbraw/zinc/88/24/98/712882498.db2.gz	YNEMSHMMZSPLLH-ZYHUDNBSSA-N	0	3	356.831	3.400	10	5		FGBEHN
Cc1nc(C)n(C[C@H]2CCCN(C/C=C/c3ccccc3[N+](=O)[O-])C2)n1	ZINC000121926324	494892071	/nfs/dbraw/zinc/89/20/71/494892071.db2.gz	DTANYTCLKBFFFP-NADMHLTPSA-N	0	3	355.442	3.229	10	5		FGBEHN
CC(C)N1C[C@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)[C@@H](C)C1	ZINC000120706239	495439682	/nfs/dbraw/zinc/43/96/82/495439682.db2.gz	TXSFATMBODWCPT-GWCFXTLKSA-N	0	3	372.372	3.046	10	5		FGBEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1	ZINC000176975907	495866246	/nfs/dbraw/zinc/86/62/46/495866246.db2.gz	KJGQQQMUGNREBJ-UKRRQHHQSA-N	0	3	351.472	3.018	10	5		FGBEHN
C[C@@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1N1CCOCC1	ZINC000180231256	495917012	/nfs/dbraw/zinc/91/70/12/495917012.db2.gz	SIHMCSGYKNNGHN-BEFAXECRSA-N	0	3	371.437	3.007	10	5		FGBEHN
CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000152912848	496294654	/nfs/dbraw/zinc/29/46/54/496294654.db2.gz	KLWCVZHAUMRBKR-CYBMUJFWSA-N	0	3	353.488	3.413	10	5		FGBEHN
CC(C)c1nc2n(n1)C[C@H](N[C@H]1CCCc3ccc([N+](=O)[O-])cc31)CC2	ZINC000192984716	497267312	/nfs/dbraw/zinc/26/73/12/497267312.db2.gz	HXIKZVKTYHRGJN-PBHICJAKSA-N	0	3	355.442	3.292	10	5		FGBEHN
Cc1ccc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)cc1[N+](=O)[O-]	ZINC000190474206	497493921	/nfs/dbraw/zinc/49/39/21/497493921.db2.gz	VRRSGKBKWFJCSE-LJQANCHMSA-N	0	3	354.454	3.252	10	5		FGBEHN
CN(Cc1cccnc1)C[C@H]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000190480598	497498215	/nfs/dbraw/zinc/49/82/15/497498215.db2.gz	PDGWHUKLZHKIGG-MTCRFPMVSA-N	0	3	366.465	3.457	10	5		FGBEHN
Cn1cc(CN2CC[C@]3(O)CCCC[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000245767340	497533178	/nfs/dbraw/zinc/53/31/78/497533178.db2.gz	RBJHHWXXLADBAO-FXAWDEMLSA-N	0	3	370.453	3.122	10	5		FGBEHN
CCOc1ccc(C(=O)N[C@H](CN(C)C)c2ccccc2)cc1[N+](=O)[O-]	ZINC000007818147	494045598	/nfs/dbraw/zinc/04/55/98/494045598.db2.gz	SLNHTDYYQFOBAP-MRXNPFEDSA-N	0	3	357.410	3.026	10	5		FGBEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1	ZINC000131979203	494790542	/nfs/dbraw/zinc/79/05/42/494790542.db2.gz	NNDSMIOFPMRBQU-YGRLFVJLSA-N	0	3	359.348	3.072	10	5		FGBEHN
CC[C@@H](N[C@@H](C)c1ccc(-n2cnnn2)cc1)c1cccc([N+](=O)[O-])c1	ZINC000161628553	496210306	/nfs/dbraw/zinc/21/03/06/496210306.db2.gz	HSNFLGWDBCJCIN-SCLBCKFNSA-N	0	3	352.398	3.372	10	5		FGBEHN
CC(=O)N[C@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1	ZINC000153835489	496595730	/nfs/dbraw/zinc/59/57/30/496595730.db2.gz	XYYMFXGYTOUHEO-HNNXBMFYSA-N	0	3	359.451	3.424	10	5		FGBEHN
Cc1ncsc1CN(C)C[C@H]1CCN(Cc2ccccc2[N+](=O)[O-])C1	ZINC000190468293	497491759	/nfs/dbraw/zinc/49/17/59/497491759.db2.gz	GUYRGIOYIAQVGU-OAHLLOKOSA-N	0	3	360.483	3.314	10	5		FGBEHN
C[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1N1CCOCC1	ZINC000245708803	497510637	/nfs/dbraw/zinc/51/06/37/497510637.db2.gz	FQMVPXFQHKUHRA-DNVCBOLYSA-N	0	3	371.437	3.007	10	5		FGBEHN
CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000245764816	497532729	/nfs/dbraw/zinc/53/27/29/497532729.db2.gz	JDUFGGVGSHSMRP-IUODEOHRSA-N	0	3	351.472	3.165	10	5		FGBEHN
COc1ccc([C@H]2[C@@H](CNc3c([N+](=O)[O-])c(C)nn3C)CCCN2C)cc1	ZINC000301308556	498050275	/nfs/dbraw/zinc/05/02/75/498050275.db2.gz	WQZSQOYAGZSQBM-QAPCUYQASA-N	0	3	373.457	3.140	10	5		FGBEHN
CCC[C@@H](N[C@@H]1CCCN(c2cccnn2)C1)c1cccc([N+](=O)[O-])c1	ZINC000089732081	494350822	/nfs/dbraw/zinc/35/08/22/494350822.db2.gz	ZVUNUXOZHXUYJZ-SJLPKXTDSA-N	0	3	355.442	3.485	10	5		FGBEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000113228634	495285840	/nfs/dbraw/zinc/28/58/40/495285840.db2.gz	SPUISWUEWIDYBK-SWLSCSKDSA-N	0	3	372.450	3.027	10	5		FGBEHN
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCCC[C@H]1c1cn[nH]c1	ZINC000114201621	495354239	/nfs/dbraw/zinc/35/42/39/495354239.db2.gz	WJQRVPPRFMKLSF-KRWDZBQOSA-N	0	3	357.414	3.182	10	5		FGBEHN
Cc1cnn([C@H]2CCCN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)c1	ZINC000106225596	495438740	/nfs/dbraw/zinc/43/87/40/495438740.db2.gz	BAEMELKQTMTQFY-KRWDZBQOSA-N	0	3	371.441	3.074	10	5		FGBEHN
C[C@@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccc(-c2ccccc2)cc1	ZINC000174660454	496049895	/nfs/dbraw/zinc/04/98/95/496049895.db2.gz	MESOWHPCXRDZIQ-QRWLVFNGSA-N	0	3	366.421	3.170	10	5		FGBEHN
CCOc1ccc([C@H](C)N[C@H]2CCc3nc(C(C)C)nn3C2)cc1[N+](=O)[O-]	ZINC000180642073	496083159	/nfs/dbraw/zinc/08/31/59/496083159.db2.gz	KNWJFKIREUVTRU-ZFWWWQNUSA-N	0	3	373.457	3.374	10	5		FGBEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000246996403	496747320	/nfs/dbraw/zinc/74/73/20/496747320.db2.gz	GRLZMXFWUPARQB-SWLSCSKDSA-N	0	3	374.466	3.177	10	5		FGBEHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1cc(CO)ccc1[N+](=O)[O-]	ZINC000302059087	498389783	/nfs/dbraw/zinc/38/97/83/498389783.db2.gz	RIGZKHAQQUXISX-QAPCUYQASA-N	0	3	355.438	3.410	10	5		FGBEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1	ZINC000170856031	495629226	/nfs/dbraw/zinc/62/92/26/495629226.db2.gz	UMBLXNKXAYROIX-INIZCTEOSA-N	0	3	354.410	3.115	10	5		FGBEHN
CCO[C@@H]1C[C@@H](NCc2ccc(Cl)c([N+](=O)[O-])c2)C12CCOCC2	ZINC000185658776	495666670	/nfs/dbraw/zinc/66/66/70/495666670.db2.gz	OBYFRPRZEAKSIG-HZPDHXFCSA-N	0	3	354.834	3.312	10	5		FGBEHN
Cc1cccc(NC[C@@H]2CCN(CCOc3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000171648499	495969112	/nfs/dbraw/zinc/96/91/12/495969112.db2.gz	UQIFYAOUWSRKEL-INIZCTEOSA-N	0	3	356.426	3.111	10	5		FGBEHN
COc1ccc([C@H](C)NCCC(=O)Nc2ccccc2[N+](=O)[O-])cc1OC	ZINC000180891432	496188163	/nfs/dbraw/zinc/18/81/63/496188163.db2.gz	IIVAPDVTFINSDR-ZDUSSCGKSA-N	0	3	373.409	3.291	10	5		FGBEHN
Cc1ccc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)cc1[N+](=O)[O-]	ZINC000190474226	497494659	/nfs/dbraw/zinc/49/46/59/497494659.db2.gz	VRRSGKBKWFJCSE-IBGZPJMESA-N	0	3	354.454	3.252	10	5		FGBEHN
C[C@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1N1CCOCC1	ZINC000245774307	497535664	/nfs/dbraw/zinc/53/56/64/497535664.db2.gz	SIHMCSGYKNNGHN-HNAYVOBHSA-N	0	3	371.437	3.007	10	5		FGBEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1	ZINC000246515603	497759568	/nfs/dbraw/zinc/75/95/68/497759568.db2.gz	TXSFATMBODWCPT-GXFFZTMASA-N	0	3	372.372	3.046	10	5		FGBEHN
COC(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1Cl	ZINC000301655460	498208777	/nfs/dbraw/zinc/20/87/77/498208777.db2.gz	HQOAVVFTFCFLHB-IINYFYTJSA-N	0	3	355.822	3.175	10	5		FGBEHN
CCc1cc(N2CCN(c3ccc([N+](=O)[O-])cn3)CC2)c2ccccc2n1	ZINC000301808484	498272874	/nfs/dbraw/zinc/27/28/74/498272874.db2.gz	WPCBMCHGWIZGCF-UHFFFAOYSA-N	0	3	363.421	3.427	10	5		FGBEHN
CN(C)C[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1	ZINC000007257768	494010843	/nfs/dbraw/zinc/01/08/43/494010843.db2.gz	CDULFELZRKFVCY-GOSISDBHSA-N	0	3	368.437	3.202	10	5		FGBEHN
CN(C)C[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1	ZINC000128252197	495068099	/nfs/dbraw/zinc/06/80/99/495068099.db2.gz	HHMZHCIAPWSKDL-MRXNPFEDSA-N	0	3	361.467	3.086	10	5		FGBEHN
CCO[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)C12CCOCC2	ZINC000186418755	495990630	/nfs/dbraw/zinc/99/06/30/495990630.db2.gz	RYLBTQBFIQMRRH-JKSUJKDBSA-N	0	3	354.834	3.312	10	5		FGBEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000247480629	496868909	/nfs/dbraw/zinc/86/89/09/496868909.db2.gz	SPUISWUEWIDYBK-WFASDCNBSA-N	0	3	372.450	3.027	10	5		FGBEHN
Cc1c(CN2CC[C@H](CN(C)Cc3cccnc3)C2)cccc1[N+](=O)[O-]	ZINC000195297311	496879640	/nfs/dbraw/zinc/87/96/40/496879640.db2.gz	VSOBBJBKEHEZTH-GOSISDBHSA-N	0	3	354.454	3.252	10	5		FGBEHN
CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)COCc1ccccc1	ZINC000066483805	494343343	/nfs/dbraw/zinc/34/33/43/494343343.db2.gz	DUDSJENHKGFDRR-FQEVSTJZSA-N	0	3	358.438	3.383	10	5		FGBEHN
CN(C)C[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1	ZINC000128082260	495041686	/nfs/dbraw/zinc/04/16/86/495041686.db2.gz	OFPOOJOIXFYIMT-CQSZACIVSA-N	0	3	361.467	3.086	10	5		FGBEHN
CN(C)C[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1	ZINC000128252448	495067845	/nfs/dbraw/zinc/06/78/45/495067845.db2.gz	HHMZHCIAPWSKDL-INIZCTEOSA-N	0	3	361.467	3.086	10	5		FGBEHN
COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000123075722	495076776	/nfs/dbraw/zinc/07/67/76/495076776.db2.gz	QYUOJNGACYKPGI-INIZCTEOSA-N	0	3	358.398	3.028	10	5		FGBEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc(Br)cc1[N+](=O)[O-]	ZINC000137105909	495423236	/nfs/dbraw/zinc/42/32/36/495423236.db2.gz	MJPUOEXQXNCMPV-LBPRGKRZSA-N	0	3	372.263	3.063	10	5		FGBEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000137107868	495423526	/nfs/dbraw/zinc/42/35/26/495423526.db2.gz	CPJOEQRMUDLXNU-LBPRGKRZSA-N	0	3	361.364	3.320	10	5		FGBEHN
CCc1nccn1[C@@H]1CCCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000106217731	495436982	/nfs/dbraw/zinc/43/69/82/495436982.db2.gz	GSCGERWIIYTGMI-OAHLLOKOSA-N	0	3	371.441	3.019	10	5		FGBEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1	ZINC000120706134	495439675	/nfs/dbraw/zinc/43/96/75/495439675.db2.gz	TXSFATMBODWCPT-MFKMUULPSA-N	0	3	372.372	3.046	10	5		FGBEHN
Cc1cccc(NC[C@@H]2CCN(CCOc3cccc([N+](=O)[O-])c3)C2)n1	ZINC000171649430	495968418	/nfs/dbraw/zinc/96/84/18/495968418.db2.gz	WDMQVMONJJEMQK-INIZCTEOSA-N	0	3	356.426	3.111	10	5		FGBEHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1cc(CO)ccc1[N+](=O)[O-]	ZINC000302059085	498389678	/nfs/dbraw/zinc/38/96/78/498389678.db2.gz	RIGZKHAQQUXISX-CRAIPNDOSA-N	0	3	355.438	3.410	10	5		FGBEHN
CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1cccc([N+](=O)[O-])c1	ZINC000088608296	494253076	/nfs/dbraw/zinc/25/30/76/494253076.db2.gz	UBDJLJCMSPPLEF-GOSISDBHSA-N	0	3	374.441	3.412	10	5		FGBEHN
CC[C@H](N[C@H](C)c1ccc(-n2cnnn2)cc1)c1cccc([N+](=O)[O-])c1	ZINC000090918496	494505118	/nfs/dbraw/zinc/50/51/18/494505118.db2.gz	HSNFLGWDBCJCIN-ACJLOTCBSA-N	0	3	352.398	3.372	10	5		FGBEHN
CNc1cc(N2CCC[C@H]2CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ncn1	ZINC000180566073	496046094	/nfs/dbraw/zinc/04/60/94/496046094.db2.gz	KYRGDDJKLSWDRT-ZBFHGGJFSA-N	0	3	370.457	3.055	10	5		FGBEHN
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000172897770	496481539	/nfs/dbraw/zinc/48/15/39/496481539.db2.gz	NOBHWPIAEVNKDR-FQEVSTJZSA-N	0	3	367.449	3.308	10	5		FGBEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000245457619	497416576	/nfs/dbraw/zinc/41/65/76/497416576.db2.gz	CDBVQGXAECCDFV-CZUORRHYSA-N	0	3	359.430	3.122	10	5		FGBEHN
COc1ccc([C@H]2[C@H](CNc3ncccc3[N+](=O)[O-])CCCN2C)cc1	ZINC000301246632	498019392	/nfs/dbraw/zinc/01/93/92/498019392.db2.gz	AWTWMMKQCIGLLR-YJBOKZPZSA-N	0	3	356.426	3.493	10	5		FGBEHN
Cc1cc(N[C@H]2C[C@H](C)N(C3CC3)C2)nc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000133499611	495021394	/nfs/dbraw/zinc/02/13/94/495021394.db2.gz	AKIMYVCIGZELQJ-ZFWWWQNUSA-N	0	3	353.426	3.397	10	5		FGBEHN
CN(C)C[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1	ZINC000125389758	495437123	/nfs/dbraw/zinc/43/71/23/495437123.db2.gz	MKTCOZTUNDCHCO-LJQANCHMSA-N	0	3	366.421	3.038	10	5		FGBEHN
CCOc1ccc([C@H](C)N[C@@H]2CCc3nnc(C(C)C)n3C2)cc1[N+](=O)[O-]	ZINC000180509733	496026082	/nfs/dbraw/zinc/02/60/82/496026082.db2.gz	PYBNSFDFXXNBSK-DZGCQCFKSA-N	0	3	373.457	3.374	10	5		FGBEHN
CSc1ccc(C(=O)N[C@@H](CN(C)C)c2ccccc2)cc1[N+](=O)[O-]	ZINC000171887962	496076676	/nfs/dbraw/zinc/07/66/76/496076676.db2.gz	WPWDYNKIJJRUEI-HNNXBMFYSA-N	0	3	359.451	3.349	10	5		FGBEHN
CCOc1ccc([C@@H](C)N[C@H]2CCc3nc(C(C)C)nn3C2)cc1[N+](=O)[O-]	ZINC000180642056	496083023	/nfs/dbraw/zinc/08/30/23/496083023.db2.gz	KNWJFKIREUVTRU-HIFRSBDPSA-N	0	3	373.457	3.374	10	5		FGBEHN
COc1ccc([C@@H](C)NCCC(=O)Nc2ccccc2[N+](=O)[O-])cc1OC	ZINC000180891451	496188037	/nfs/dbraw/zinc/18/80/37/496188037.db2.gz	IIVAPDVTFINSDR-CYBMUJFWSA-N	0	3	373.409	3.291	10	5		FGBEHN
CC[C@H](NC[C@@H](O)COCc1cccs1)c1cccc([N+](=O)[O-])c1	ZINC000181550675	496442319	/nfs/dbraw/zinc/44/23/19/496442319.db2.gz	VZJWPRUBTSBBEZ-WBVHZDCISA-N	0	3	350.440	3.275	10	5		FGBEHN
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000052555825	494039995	/nfs/dbraw/zinc/03/99/95/494039995.db2.gz	RFIOADHEGPBLHZ-KDOFPFPSSA-N	0	3	373.478	3.495	10	5		FGBEHN
CCOc1ccc([C@H](C)N[C@H]2CCCN(c3cccnn3)C2)cc1[N+](=O)[O-]	ZINC000089732605	494350296	/nfs/dbraw/zinc/35/02/96/494350296.db2.gz	KWBSBYDZIZEXFI-HOCLYGCPSA-N	0	3	371.441	3.103	10	5		FGBEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1	ZINC000080080704	494588406	/nfs/dbraw/zinc/58/84/06/494588406.db2.gz	ZIKCUUBIOOCBOG-OAHLLOKOSA-N	0	3	350.463	3.105	10	5		FGBEHN
CN(C)C[C@@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000024276811	494617862	/nfs/dbraw/zinc/61/78/62/494617862.db2.gz	XUSWNQZFEHXJSP-LJQANCHMSA-N	0	3	370.453	3.206	10	5		FGBEHN
O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCc4ncnn4C3)o2)c(Cl)c1	ZINC000109072318	494827016	/nfs/dbraw/zinc/82/70/16/494827016.db2.gz	QMXGWCBRZRQEER-LLVKDONJSA-N	0	3	373.800	3.204	10	5		FGBEHN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCCC[C@H]1c1cn[nH]c1	ZINC000114202626	495353687	/nfs/dbraw/zinc/35/36/87/495353687.db2.gz	RTXHIXIVDQMCHC-KRWDZBQOSA-N	0	3	357.414	3.182	10	5		FGBEHN
CC[C@H](NC[C@H]1CCCN1c1cc(NC)ncn1)c1cccc([N+](=O)[O-])c1	ZINC000180576839	496052422	/nfs/dbraw/zinc/05/24/22/496052422.db2.gz	PCTOIKOWSNXNGM-SJORKVTESA-N	0	3	370.457	3.136	10	5		FGBEHN
CC[C@@H](NC[C@H](O)COc1cccc(C(C)=O)c1)c1cccc([N+](=O)[O-])c1	ZINC000181541501	496438524	/nfs/dbraw/zinc/43/85/24/496438524.db2.gz	AYPNKCXSOLXWFS-AZUAARDMSA-N	0	3	372.421	3.278	10	5		FGBEHN
O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCN2CCC[C@H]2C1	ZINC000195333004	496893508	/nfs/dbraw/zinc/89/35/08/496893508.db2.gz	PHILOOVOADZHCC-INIZCTEOSA-N	0	3	367.405	3.307	10	5		FGBEHN
COC(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CN(C(C)C)C[C@H]2C)cc1Cl	ZINC000301655462	498208671	/nfs/dbraw/zinc/20/86/71/498208671.db2.gz	HQOAVVFTFCFLHB-QMTHXVAHSA-N	0	3	355.822	3.175	10	5		FGBEHN
O=c1[n-]ccc(N[C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)c1[N+](=O)[O-]	ZINC000596194570	506303625	/nfs/dbraw/zinc/30/36/25/506303625.db2.gz	OXHPVUQYQQBYQS-BZUAXINKSA-N	0	3	354.410	3.018	10	5		FGBEHN
O=c1[n-]ccc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)c1[N+](=O)[O-]	ZINC000596194570	506303632	/nfs/dbraw/zinc/30/36/32/506303632.db2.gz	OXHPVUQYQQBYQS-BZUAXINKSA-N	0	3	354.410	3.018	10	5		FGBEHN
COc1ccc(NC(=O)CCN2CCC[C@H]2c2ccco2)c([N+](=O)[O-])c1	ZINC000116294802	494752348	/nfs/dbraw/zinc/75/23/48/494752348.db2.gz	SNAMRVRHSACKGW-HNNXBMFYSA-N	0	3	359.382	3.362	10	5		FGBEHN
CN(C)C[C@@H](NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1	ZINC000129891256	495311602	/nfs/dbraw/zinc/31/16/02/495311602.db2.gz	ZDGHUYHHMJCABZ-GOSISDBHSA-N	0	3	352.394	3.109	10	5		FGBEHN
Cc1nn(C)c(C)c1[C@H]1CCCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000106211679	495433401	/nfs/dbraw/zinc/43/34/01/495433401.db2.gz	WLMPRAZXAKKTLU-QGZVFWFLSA-N	0	3	371.441	3.111	10	5		FGBEHN
O=[N+]([O-])c1ccc(CN(C[C@@H](O)COCc2ccccc2)C2CC2)cc1	ZINC000130897691	495463394	/nfs/dbraw/zinc/46/33/94/495463394.db2.gz	WSKWCQABWHBRAS-HXUWFJFHSA-N	0	3	356.422	3.137	10	5		FGBEHN
CC(C)N1C[C@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)C1	ZINC000155574566	495999768	/nfs/dbraw/zinc/99/97/68/495999768.db2.gz	CIIZEGXOOQGNAK-WFASDCNBSA-N	0	3	374.466	3.177	10	5		FGBEHN
CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000152912778	496294343	/nfs/dbraw/zinc/29/43/43/496294343.db2.gz	KLWCVZHAUMRBKR-ZDUSSCGKSA-N	0	3	353.488	3.413	10	5		FGBEHN
CCN(c1ccccc1)c1ncnc(N(C)C2CCN(C)CC2)c1[N+](=O)[O-]	ZINC000040573581	220911550	/nfs/dbraw/zinc/91/15/50/220911550.db2.gz	ABTHOJSGMVMJFJ-UHFFFAOYSA-N	0	3	370.457	3.073	10	5		FGBEHN
Cc1nn(C)c(C)c1[C@H]1CCCN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000106211858	495432488	/nfs/dbraw/zinc/43/24/88/495432488.db2.gz	HPHBCODOYPXTSF-QGZVFWFLSA-N	0	3	371.441	3.111	10	5		FGBEHN
Cc1cnn([C@H]2CCCN(CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1	ZINC000106225645	495439252	/nfs/dbraw/zinc/43/92/52/495439252.db2.gz	OFFZKQMMZUIOPB-INIZCTEOSA-N	0	3	371.441	3.074	10	5		FGBEHN
O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@@H](N3CCOCC3)C2)s1	ZINC000121010795	495503202	/nfs/dbraw/zinc/50/32/02/495503202.db2.gz	CUAXYQSICSCJIR-OAHLLOKOSA-N	0	3	373.478	3.230	10	5		FGBEHN
CCOc1ccc([C@@H](C)N[C@H]2CCc3nnc(C(C)C)n3C2)cc1[N+](=O)[O-]	ZINC000180509753	496025849	/nfs/dbraw/zinc/02/58/49/496025849.db2.gz	PYBNSFDFXXNBSK-HIFRSBDPSA-N	0	3	373.457	3.374	10	5		FGBEHN
Cc1ccc([C@@H](C)NC(=O)N[C@H](CC(C)C)CN(C)C)cc1[N+](=O)[O-]	ZINC000175863948	496578775	/nfs/dbraw/zinc/57/87/75/496578775.db2.gz	RUVVFJDBFYBYLX-GDBMZVCRSA-N	0	3	350.463	3.240	10	5		FGBEHN
COc1ccc([C@@H]2[C@H](CNc3c([N+](=O)[O-])c(C)nn3C)CCCN2C)cc1	ZINC000301308555	498050088	/nfs/dbraw/zinc/05/00/88/498050088.db2.gz	WQZSQOYAGZSQBM-MAUKXSAKSA-N	0	3	373.457	3.140	10	5		FGBEHN
C[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(F)c(Cl)c1	ZINC000180730854	705755290	/nfs/dbraw/zinc/75/52/90/705755290.db2.gz	JZVSUFMLQIMEAH-BXUZGUMPSA-N	0	3	368.792	3.478	10	5		FGBEHN
CN(C)C[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1	ZINC000007257767	494010968	/nfs/dbraw/zinc/01/09/68/494010968.db2.gz	CDULFELZRKFVCY-SFHVURJKSA-N	0	3	368.437	3.202	10	5		FGBEHN
COc1ccc(OCCN2CCC[C@@H]2c2c(C)nn(C)c2C)c([N+](=O)[O-])c1	ZINC000173698276	495653056	/nfs/dbraw/zinc/65/30/56/495653056.db2.gz	QVKFGTMPPOFUSX-MRXNPFEDSA-N	0	3	374.441	3.170	10	5		FGBEHN
CCN1CCC[C@H]1CN(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000177013538	495884179	/nfs/dbraw/zinc/88/41/79/495884179.db2.gz	ZTRDNDHCLVMKGG-HNNXBMFYSA-N	0	3	374.466	3.275	10	5		FGBEHN
CCn1cc(C2CCN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)cn1	ZINC000160457971	495967704	/nfs/dbraw/zinc/96/77/04/495967704.db2.gz	SEBUJSATDAJKAL-UHFFFAOYSA-N	0	3	371.441	3.019	10	5		FGBEHN
C[C@H](NC[C@@H]1CN(C)CCO1)c1ccc(-c2ccccc2[N+](=O)[O-])s1	ZINC000180500034	496022124	/nfs/dbraw/zinc/02/21/24/496022124.db2.gz	RRIQCGQCALITSB-UONOGXRCSA-N	0	3	361.467	3.305	10	5		FGBEHN
C[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccc(-c2ccccc2)cc1	ZINC000174660443	496050660	/nfs/dbraw/zinc/05/06/60/496050660.db2.gz	MESOWHPCXRDZIQ-YWZLYKJASA-N	0	3	366.421	3.170	10	5		FGBEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000177546975	496107520	/nfs/dbraw/zinc/10/75/20/496107520.db2.gz	PPUQZHZYYXZLSD-SFHVURJKSA-N	0	3	362.474	3.043	10	5		FGBEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000247502077	496874104	/nfs/dbraw/zinc/87/41/04/496874104.db2.gz	VCOZNISCRFBPFB-DOMZBBRYSA-N	0	3	372.450	3.027	10	5		FGBEHN
CCN1CCc2c(cccc2Nc2ccc(C(=O)NC)cc2[N+](=O)[O-])C1	ZINC000301715686	498236073	/nfs/dbraw/zinc/23/60/73/498236073.db2.gz	XAKQXHXEHWEPBX-UHFFFAOYSA-N	0	3	354.410	3.076	10	5		FGBEHN
CN(C)C[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000007817213	494045523	/nfs/dbraw/zinc/04/55/23/494045523.db2.gz	MHWLGHIOZOCSTQ-KRWDZBQOSA-N	0	3	359.451	3.106	10	5		FGBEHN
CC[C@H](NC(=O)N(CCN(C)C)CC(C)C)c1cccc([N+](=O)[O-])c1	ZINC000090686965	494493630	/nfs/dbraw/zinc/49/36/30/494493630.db2.gz	ORAFZYJKGXNEIQ-KRWDZBQOSA-N	0	3	350.463	3.275	10	5		FGBEHN
O=[N+]([O-])c1ccccc1-c1ccc(CN2CCC[C@@H](Cn3cncn3)C2)o1	ZINC000128554617	495115382	/nfs/dbraw/zinc/11/53/82/495115382.db2.gz	OESFEWTWTVXJRY-OAHLLOKOSA-N	0	3	367.409	3.359	10	5		FGBEHN
O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@H](N4CCOCC4)C3)s2)cc1	ZINC000120972585	495495185	/nfs/dbraw/zinc/49/51/85/495495185.db2.gz	QUBSPXLNIIFACE-KRWDZBQOSA-N	0	3	373.478	3.230	10	5		FGBEHN
CCO[C@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)C12CCOCC2	ZINC000186418775	495991291	/nfs/dbraw/zinc/99/12/91/495991291.db2.gz	RYLBTQBFIQMRRH-HOTGVXAUSA-N	0	3	354.834	3.312	10	5		FGBEHN
Cc1nc(C)n(C[C@@H]2CCCN(C/C=C\c3ccccc3[N+](=O)[O-])C2)n1	ZINC000255841538	497375706	/nfs/dbraw/zinc/37/57/06/497375706.db2.gz	DTANYTCLKBFFFP-UXHZXRBQSA-N	0	3	355.442	3.229	10	5		FGBEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2cccc([N+](=O)[O-])c2)C1	ZINC000190465007	497490146	/nfs/dbraw/zinc/49/01/46/497490146.db2.gz	LETNHBQMSYCHCJ-INIZCTEOSA-N	0	3	360.483	3.314	10	5		FGBEHN
CN(C)[C@H](CNc1ccc([N+](=O)[O-])cc1C(N)=O)c1ccc(Cl)cc1	ZINC000301485329	498131535	/nfs/dbraw/zinc/13/15/35/498131535.db2.gz	WLIHZMRLKZKUSR-MRXNPFEDSA-N	0	3	362.817	3.062	10	5		FGBEHN
Cc1ccc(Nc2ncnc(N(C)C3CCN(C)CC3)c2[N+](=O)[O-])cc1C	ZINC000040590271	205074138	/nfs/dbraw/zinc/07/41/38/205074138.db2.gz	KWGRJSLGUIOXAN-UHFFFAOYSA-N	0	3	370.457	3.276	10	5		FGBEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1	ZINC000068223140	493781583	/nfs/dbraw/zinc/78/15/83/493781583.db2.gz	XHTQDZCIFUPUFN-UONOGXRCSA-N	0	3	353.488	3.168	10	5		FGBEHN
COc1cc(F)c([N+](=O)[O-])c(Nc2cnn(CCN3CCCCC3)c2)c1	ZINC000092978356	494800410	/nfs/dbraw/zinc/80/04/10/494800410.db2.gz	KKTWNVCZEFPYMX-UHFFFAOYSA-N	0	3	363.393	3.169	10	5		FGBEHN
Cc1nc(C[C@H]2CCCN(CCCOc3ccc([N+](=O)[O-])cc3)C2)no1	ZINC000171403024	495857481	/nfs/dbraw/zinc/85/74/81/495857481.db2.gz	TTXOGMZXFAXDQJ-OAHLLOKOSA-N	0	3	360.414	3.010	10	5		FGBEHN
CC(C)N1C[C@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H](C)C1	ZINC000155375816	495938323	/nfs/dbraw/zinc/93/83/23/495938323.db2.gz	GRLZMXFWUPARQB-WFASDCNBSA-N	0	3	374.466	3.177	10	5		FGBEHN
CCOc1cc(N2CC[C@H](CN(C)Cc3cccnc3)C2)ccc1[N+](=O)[O-]	ZINC000190446584	497482336	/nfs/dbraw/zinc/48/23/36/497482336.db2.gz	NGMOONLGHQPOPW-QGZVFWFLSA-N	0	3	370.453	3.347	10	5		FGBEHN
C[C@@H]1CN(CCC2CCN(c3ccc([N+](=O)[O-])cc3F)CC2)C[C@@H](C)O1	ZINC000301522940	498146923	/nfs/dbraw/zinc/14/69/23/498146923.db2.gz	DXIPVRITWFNVKH-HUUCEWRRSA-N	0	3	365.449	3.450	10	5		FGBEHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1cc(CO)ccc1[N+](=O)[O-]	ZINC000302059088	498389222	/nfs/dbraw/zinc/38/92/22/498389222.db2.gz	RIGZKHAQQUXISX-YJBOKZPZSA-N	0	3	355.438	3.410	10	5		FGBEHN
O=c1[n-]ccc(N[C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)c1[N+](=O)[O-]	ZINC000596194572	506303312	/nfs/dbraw/zinc/30/33/12/506303312.db2.gz	OXHPVUQYQQBYQS-OWCLPIDISA-N	0	3	354.410	3.018	10	5		FGBEHN
O=c1[n-]ccc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)c1[N+](=O)[O-]	ZINC000596194572	506303321	/nfs/dbraw/zinc/30/33/21/506303321.db2.gz	OXHPVUQYQQBYQS-OWCLPIDISA-N	0	3	354.410	3.018	10	5		FGBEHN
COc1ccc(C(=O)Nc2ccccc2CN2CCCC2)cc1[N+](=O)[O-]	ZINC000041970324	205093058	/nfs/dbraw/zinc/09/30/58/205093058.db2.gz	YEGZXQLPNBELRF-UHFFFAOYSA-N	0	3	355.394	3.452	10	5		FGBEHN
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000052555831	494039687	/nfs/dbraw/zinc/03/96/87/494039687.db2.gz	RFIOADHEGPBLHZ-RDTXWAMCSA-N	0	3	373.478	3.495	10	5		FGBEHN
O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCC(c3ccn[nH]3)CC2)c1	ZINC000092811029	494755533	/nfs/dbraw/zinc/75/55/33/494755533.db2.gz	JWADBMKGSJBXQD-UHFFFAOYSA-N	0	3	352.341	3.299	10	5		FGBEHN
CC[C@@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1	ZINC000121540434	494797153	/nfs/dbraw/zinc/79/71/53/494797153.db2.gz	ZNZQASUTSXSILC-YVEFUNNKSA-N	0	3	363.439	3.044	10	5		FGBEHN
NC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1CCCCN1Cc1ccccc1	ZINC000301116519	497957974	/nfs/dbraw/zinc/95/79/74/497957974.db2.gz	UROUUEWBTMWSKI-QGZVFWFLSA-N	0	3	368.437	3.160	10	5		FGBEHN
CCOc1ccc([C@H](C)N[C@@H]2CCCN(c3cccnn3)C2)cc1[N+](=O)[O-]	ZINC000089732603	494350789	/nfs/dbraw/zinc/35/07/89/494350789.db2.gz	KWBSBYDZIZEXFI-GOEBONIOSA-N	0	3	371.441	3.103	10	5		FGBEHN
CCc1nccn1[C@H]1CCCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000106217577	495436037	/nfs/dbraw/zinc/43/60/37/495436037.db2.gz	IBMQFOAYOJHYDW-KRWDZBQOSA-N	0	3	371.441	3.019	10	5		FGBEHN
CCN1CCC[C@H]1CN(C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000177013574	495883598	/nfs/dbraw/zinc/88/35/98/495883598.db2.gz	BGRRRFIIPXQYMW-HNNXBMFYSA-N	0	3	374.466	3.275	10	5		FGBEHN
O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCN2CCC[C@H]2C1	ZINC000195318513	496886806	/nfs/dbraw/zinc/88/68/06/496886806.db2.gz	SSJFNCYABIUBJR-KRWDZBQOSA-N	0	3	366.421	3.259	10	5		FGBEHN
C[C@@H](C(=O)N[C@@H](C)CN(C)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1F	ZINC000248543527	497034606	/nfs/dbraw/zinc/03/46/06/497034606.db2.gz	CMMIXDFDKAFAGZ-LSDHHAIUSA-N	0	3	373.428	3.474	10	5		FGBEHN
O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H]1CCCN(c3cccnn3)C1)CCC2	ZINC000192999296	497270684	/nfs/dbraw/zinc/27/06/84/497270684.db2.gz	KFBLUPMJVGPBJE-MAUKXSAKSA-N	0	3	353.426	3.021	10	5		FGBEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1	ZINC000245429400	497400911	/nfs/dbraw/zinc/40/09/11/497400911.db2.gz	KJGQQQMUGNREBJ-DZGCQCFKSA-N	0	3	351.472	3.018	10	5		FGBEHN
C[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1N1CCOCC1	ZINC000245708810	497510849	/nfs/dbraw/zinc/51/08/49/497510849.db2.gz	FQMVPXFQHKUHRA-HNAYVOBHSA-N	0	3	371.437	3.007	10	5		FGBEHN
C[C@H]1CN(CCC2CCN(c3ccc([N+](=O)[O-])cc3F)CC2)C[C@H](C)O1	ZINC000301522938	498146457	/nfs/dbraw/zinc/14/64/57/498146457.db2.gz	DXIPVRITWFNVKH-GJZGRUSLSA-N	0	3	365.449	3.450	10	5		FGBEHN
C[C@@H]1CN(CCC2CCN(c3ccc([N+](=O)[O-])cc3F)CC2)C[C@H](C)O1	ZINC000301522936	498146881	/nfs/dbraw/zinc/14/68/81/498146881.db2.gz	DXIPVRITWFNVKH-GASCZTMLSA-N	0	3	365.449	3.450	10	5		FGBEHN
O=[N+]([O-])c1cc(CN2CCN3CCCC[C@@H]3C2)ccc1Br	ZINC000123021709	700699101	/nfs/dbraw/zinc/69/91/01/700699101.db2.gz	KJJJJELWVOTMOF-CYBMUJFWSA-N	0	3	354.248	3.027	10	5		FGBEHN
C[C@@H](CN(C)Cc1ccccc1)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000180344020	495959569	/nfs/dbraw/zinc/95/95/69/495959569.db2.gz	NEUATHZKDWZBPO-AWEZNQCLSA-N	0	3	368.437	3.412	10	5		FGBEHN
CNc1cc(N2CCC[C@@H]2CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)ncn1	ZINC000180566130	496047873	/nfs/dbraw/zinc/04/78/73/496047873.db2.gz	KYRGDDJKLSWDRT-GOEBONIOSA-N	0	3	370.457	3.055	10	5		FGBEHN
O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCN2CCC[C@@H]2C1	ZINC000195318505	496886924	/nfs/dbraw/zinc/88/69/24/496886924.db2.gz	SSJFNCYABIUBJR-QGZVFWFLSA-N	0	3	366.421	3.259	10	5		FGBEHN
Cc1ncsc1CN(C)C[C@H]1CCN(Cc2csc([N+](=O)[O-])c2)C1	ZINC000190467545	497491184	/nfs/dbraw/zinc/49/11/84/497491184.db2.gz	DOMBCRRTCWDBSG-CYBMUJFWSA-N	0	3	366.512	3.375	10	5		FGBEHN
COc1ccc([C@@H]2[C@@H](CNc3ccc([N+](=O)[O-])cn3)CCCN2C)cc1	ZINC000301298623	498046528	/nfs/dbraw/zinc/04/65/28/498046528.db2.gz	QDMMLHFOGQDMFY-DNVCBOLYSA-N	0	3	356.426	3.493	10	5		FGBEHN
CN(c1cc(CO)ccc1[N+](=O)[O-])[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000302055001	498387270	/nfs/dbraw/zinc/38/72/70/498387270.db2.gz	QGOGNHQSEYTHJA-GOSISDBHSA-N	0	3	355.438	3.188	10	5		FGBEHN
Cc1cccc(Nc2ncnc(N(C)C3CCN(C)CC3)c2[N+](=O)[O-])c1C	ZINC000040620830	205074696	/nfs/dbraw/zinc/07/46/96/205074696.db2.gz	VMSTXWHKWNRGFK-UHFFFAOYSA-N	0	3	370.457	3.276	10	5		FGBEHN
Cc1ccc(C)c(Nc2ncnc(N(C)C3CCN(C)CC3)c2[N+](=O)[O-])c1	ZINC000040592335	205075090	/nfs/dbraw/zinc/07/50/90/205075090.db2.gz	YANQODKSCDNVIO-UHFFFAOYSA-N	0	3	370.457	3.276	10	5		FGBEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2ccccc2[N+](=O)[O-])C1	ZINC000190468270	497491592	/nfs/dbraw/zinc/49/15/92/497491592.db2.gz	GUYRGIOYIAQVGU-HNNXBMFYSA-N	0	3	360.483	3.314	10	5		FGBEHN
COc1ccc([C@@H]2[C@H](CNc3ncccc3[N+](=O)[O-])CCCN2C)cc1	ZINC000301246628	498019304	/nfs/dbraw/zinc/01/93/04/498019304.db2.gz	AWTWMMKQCIGLLR-MAUKXSAKSA-N	0	3	356.426	3.493	10	5		FGBEHN
COc1ccc([C@H]2[C@@H](CNc3ccc([N+](=O)[O-])cn3)CCCN2C)cc1	ZINC000301298622	498046644	/nfs/dbraw/zinc/04/66/44/498046644.db2.gz	QDMMLHFOGQDMFY-BEFAXECRSA-N	0	3	356.426	3.493	10	5		FGBEHN
COc1ccc([C@@H]2[C@@H](CNc3c([N+](=O)[O-])c(C)nn3C)CCCN2C)cc1	ZINC000301308554	498050396	/nfs/dbraw/zinc/05/03/96/498050396.db2.gz	WQZSQOYAGZSQBM-CRAIPNDOSA-N	0	3	373.457	3.140	10	5		FGBEHN
CCc1nn(C)c(NC[C@@H]2CCCCN2Cc2ccccc2)c1[N+](=O)[O-]	ZINC000301923530	498330590	/nfs/dbraw/zinc/33/05/90/498330590.db2.gz	FUWCZWWKNATIMR-INIZCTEOSA-N	0	3	357.458	3.357	10	5		FGBEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cccc([N+](=O)[O-])c1Cl	ZINC000311059594	713801524	/nfs/dbraw/zinc/80/15/24/713801524.db2.gz	WQFCEHFEFQQMPW-ZDUSSCGKSA-N	0	3	361.829	3.499	10	5		FGBEHN
CCc1nccn1[C@H]1CCCN(CCOc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000173699167	495652836	/nfs/dbraw/zinc/65/28/36/495652836.db2.gz	UBTVNPIMDIPVMK-HNNXBMFYSA-N	0	3	374.441	3.078	10	5		FGBEHN
O=C(NC[C@@H]1CCCCN1Cc1ccccc1)Nc1ccncc1[N+](=O)[O-]	ZINC000183591079	496040306	/nfs/dbraw/zinc/04/03/06/496040306.db2.gz	GAJDFUHEOGAHPW-INIZCTEOSA-N	0	3	369.425	3.166	10	5		FGBEHN
CC[C@H](NC[C@@H]1CCCN1c1cc(NC)ncn1)c1cccc([N+](=O)[O-])c1	ZINC000180576801	496052392	/nfs/dbraw/zinc/05/23/92/496052392.db2.gz	PCTOIKOWSNXNGM-IRXDYDNUSA-N	0	3	370.457	3.136	10	5		FGBEHN
CC[C@@H](N[C@H](C)c1ccc(-n2cnnn2)cc1)c1cccc([N+](=O)[O-])c1	ZINC000161628703	496209526	/nfs/dbraw/zinc/20/95/26/496209526.db2.gz	HSNFLGWDBCJCIN-FZKQIMNGSA-N	0	3	352.398	3.372	10	5		FGBEHN
O=c1[n-]ccc(N[C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1[N+](=O)[O-]	ZINC000596194571	506303963	/nfs/dbraw/zinc/30/39/63/506303963.db2.gz	OXHPVUQYQQBYQS-HRCADAONSA-N	0	3	354.410	3.018	10	5		FGBEHN
O=c1[n-]ccc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1[N+](=O)[O-]	ZINC000596194571	506303970	/nfs/dbraw/zinc/30/39/70/506303970.db2.gz	OXHPVUQYQQBYQS-HRCADAONSA-N	0	3	354.410	3.018	10	5		FGBEHN
O=[N+]([O-])c1ccc(CN(C[C@H](O)COCc2ccccc2)C2CC2)cc1	ZINC000130897900	495463294	/nfs/dbraw/zinc/46/32/94/495463294.db2.gz	WSKWCQABWHBRAS-FQEVSTJZSA-N	0	3	356.422	3.137	10	5		FGBEHN
COc1ccc(OCCN2CCC[C@H]2c2c(C)nn(C)c2C)c([N+](=O)[O-])c1	ZINC000173698262	495653376	/nfs/dbraw/zinc/65/33/76/495653376.db2.gz	QVKFGTMPPOFUSX-INIZCTEOSA-N	0	3	374.441	3.170	10	5		FGBEHN
COc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000171652544	495972040	/nfs/dbraw/zinc/97/20/40/495972040.db2.gz	URVFJFUOGYXLQD-HNNXBMFYSA-N	0	3	356.426	3.241	10	5		FGBEHN
CC[C@H](NC[C@H](O)COc1cccc(C(C)=O)c1)c1cccc([N+](=O)[O-])c1	ZINC000181541485	496438056	/nfs/dbraw/zinc/43/80/56/496438056.db2.gz	AYPNKCXSOLXWFS-ICSRJNTNSA-N	0	3	372.421	3.278	10	5		FGBEHN
O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000246371771	497710802	/nfs/dbraw/zinc/71/08/02/497710802.db2.gz	YOQZZVSJJHGSDZ-MISYRCLQSA-N	0	3	356.422	3.216	10	5		FGBEHN
Cc1cc(C)cc(Nc2ncnc(N(C)C3CCN(C)CC3)c2[N+](=O)[O-])c1	ZINC000040583103	208257500	/nfs/dbraw/zinc/25/75/00/208257500.db2.gz	CSVRHMDIMVTOSR-UHFFFAOYSA-N	0	3	370.457	3.276	10	5		FGBEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1	ZINC000068223135	493781626	/nfs/dbraw/zinc/78/16/26/493781626.db2.gz	XHTQDZCIFUPUFN-KGLIPLIRSA-N	0	3	353.488	3.168	10	5		FGBEHN
CC[C@H](N[C@@H](C)c1ccc(-n2cnnn2)cc1)c1cccc([N+](=O)[O-])c1	ZINC000090918495	494504268	/nfs/dbraw/zinc/50/42/68/494504268.db2.gz	HSNFLGWDBCJCIN-UGSOOPFHSA-N	0	3	352.398	3.372	10	5		FGBEHN
COc1ccc(NC(=O)CCN2CCC[C@@H]2c2ccco2)c([N+](=O)[O-])c1	ZINC000116294801	494753609	/nfs/dbraw/zinc/75/36/09/494753609.db2.gz	SNAMRVRHSACKGW-OAHLLOKOSA-N	0	3	359.382	3.362	10	5		FGBEHN
O=[N+]([O-])c1cc(Cl)cnc1Nc1cnn(CCN2CCCCC2)c1	ZINC000092978338	494800446	/nfs/dbraw/zinc/80/04/46/494800446.db2.gz	HBBPQYJZAFDPRC-UHFFFAOYSA-N	0	3	350.810	3.069	10	5		FGBEHN
CCc1nccn1[C@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000106212158	495432649	/nfs/dbraw/zinc/43/26/49/495432649.db2.gz	APELAJDVJYCVHV-KRWDZBQOSA-N	0	3	358.442	3.460	10	5		FGBEHN
CNc1cc(N2CCC[C@H]2CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)ncn1	ZINC000180566096	496045931	/nfs/dbraw/zinc/04/59/31/496045931.db2.gz	KYRGDDJKLSWDRT-HOCLYGCPSA-N	0	3	370.457	3.055	10	5		FGBEHN
O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCN2CCC[C@@H]2C1	ZINC000195332995	496892667	/nfs/dbraw/zinc/89/26/67/496892667.db2.gz	PHILOOVOADZHCC-MRXNPFEDSA-N	0	3	367.405	3.307	10	5		FGBEHN
O=[N+]([O-])c1cc(Br)cnc1NC[C@@H]1NCCc2ccccc21	ZINC000262583205	497578270	/nfs/dbraw/zinc/57/82/70/497578270.db2.gz	ZICGRTAPWZMHOG-ZDUSSCGKSA-N	0	3	363.215	3.051	10	5		FGBEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1	ZINC000246112294	497625194	/nfs/dbraw/zinc/62/51/94/497625194.db2.gz	NNDSMIOFPMRBQU-IINYFYTJSA-N	0	3	359.348	3.072	10	5		FGBEHN
CCNc1ccc(C(=O)N[C@@H](C)CN(C)Cc2ccccc2)cc1[N+](=O)[O-]	ZINC000383604931	499546712	/nfs/dbraw/zinc/54/67/12/499546712.db2.gz	WFZBNVDELPZKDS-HNNXBMFYSA-N	0	3	370.453	3.277	10	5		FGBEHN
C[C@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(F)c(Cl)c1	ZINC000180730836	705755494	/nfs/dbraw/zinc/75/54/94/705755494.db2.gz	JZVSUFMLQIMEAH-SMDDNHRTSA-N	0	3	368.792	3.478	10	5		FGBEHN
CCOc1ccc([C@@H](C)N[C@H]2CCCN(c3cccnn3)C2)cc1[N+](=O)[O-]	ZINC000089732604	494350308	/nfs/dbraw/zinc/35/03/08/494350308.db2.gz	KWBSBYDZIZEXFI-ZBFHGGJFSA-N	0	3	371.441	3.103	10	5		FGBEHN
CCC[C@H](N[C@@H]1CCCN(c2cccnn2)C1)c1cccc([N+](=O)[O-])c1	ZINC000089732080	494350662	/nfs/dbraw/zinc/35/06/62/494350662.db2.gz	ZVUNUXOZHXUYJZ-AEFFLSMTSA-N	0	3	355.442	3.485	10	5		FGBEHN
CC[C@@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1	ZINC000121540622	494797394	/nfs/dbraw/zinc/79/73/94/494797394.db2.gz	ZNZQASUTSXSILC-SJKOYZFVSA-N	0	3	363.439	3.044	10	5		FGBEHN
CC(=O)c1ccc(Nc2cnn(CCN3CCCCC3)c2)c([N+](=O)[O-])c1	ZINC000092978349	494800598	/nfs/dbraw/zinc/80/05/98/494800598.db2.gz	JFPAMYDSPBKFCP-UHFFFAOYSA-N	0	3	357.414	3.223	10	5		FGBEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000120758431	495451956	/nfs/dbraw/zinc/45/19/56/495451956.db2.gz	WFWCJMNCUSUZNO-INIZCTEOSA-N	0	3	362.474	3.245	10	5		FGBEHN
CC[C@@H](NC[C@H](O)COCc1cccs1)c1cccc([N+](=O)[O-])c1	ZINC000181550657	496442173	/nfs/dbraw/zinc/44/21/73/496442173.db2.gz	VZJWPRUBTSBBEZ-DOTOQJQBSA-N	0	3	350.440	3.275	10	5		FGBEHN
O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H]1CCCN(c3cccnn3)C1)CCC2	ZINC000192999313	497270697	/nfs/dbraw/zinc/27/06/97/497270697.db2.gz	KFBLUPMJVGPBJE-CRAIPNDOSA-N	0	3	353.426	3.021	10	5		FGBEHN
CCOc1cc(N2CC[C@@H](CN(C)Cc3cccnc3)C2)ccc1[N+](=O)[O-]	ZINC000190446604	497482252	/nfs/dbraw/zinc/48/22/52/497482252.db2.gz	NGMOONLGHQPOPW-KRWDZBQOSA-N	0	3	370.453	3.347	10	5		FGBEHN
O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000246371751	497710854	/nfs/dbraw/zinc/71/08/54/497710854.db2.gz	YOQZZVSJJHGSDZ-DFQSSKMNSA-N	0	3	356.422	3.216	10	5		FGBEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000246778879	497810286	/nfs/dbraw/zinc/81/02/86/497810286.db2.gz	CIIZEGXOOQGNAK-IUODEOHRSA-N	0	3	374.466	3.177	10	5		FGBEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1	ZINC000131488229	494636086	/nfs/dbraw/zinc/63/60/86/494636086.db2.gz	FOUVGJFDECRQME-CYBMUJFWSA-N	0	3	359.348	3.170	10	5		FGBEHN
Cc1cc(N[C@H]2C[C@@H](C)N(C3CC3)C2)nc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000133500048	495021298	/nfs/dbraw/zinc/02/12/98/495021298.db2.gz	AKIMYVCIGZELQJ-HIFRSBDPSA-N	0	3	353.426	3.397	10	5		FGBEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000179715039	495702135	/nfs/dbraw/zinc/70/21/35/495702135.db2.gz	LTSYTJUMIBSGQO-ZDUSSCGKSA-N	0	3	361.829	3.499	10	5		FGBEHN
CSc1cccc(C(=O)NC[C@H]2CCCN2CC(C)C)c1[N+](=O)[O-]	ZINC000186883436	496194481	/nfs/dbraw/zinc/19/44/81/496194481.db2.gz	QRNDXALWFSKNST-CYBMUJFWSA-N	0	3	351.472	3.167	10	5		FGBEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2csc([N+](=O)[O-])c2)C1	ZINC000190467528	497491699	/nfs/dbraw/zinc/49/16/99/497491699.db2.gz	DOMBCRRTCWDBSG-ZDUSSCGKSA-N	0	3	366.512	3.375	10	5		FGBEHN
COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@@H]1c1ccco1	ZINC000116293178	494752817	/nfs/dbraw/zinc/75/28/17/494752817.db2.gz	ZPFMJKZDLAWRAJ-OAHLLOKOSA-N	0	3	359.382	3.362	10	5		FGBEHN
O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@H](N3CCOCC3)C2)s1	ZINC000121010657	495502993	/nfs/dbraw/zinc/50/29/93/495502993.db2.gz	CUAXYQSICSCJIR-HNNXBMFYSA-N	0	3	373.478	3.230	10	5		FGBEHN
CN(C)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1	ZINC000170866005	495633556	/nfs/dbraw/zinc/63/35/56/495633556.db2.gz	JQFSINZAAPXRES-OAHLLOKOSA-N	0	3	355.394	3.163	10	5		FGBEHN
CCOc1ccc([C@@H](C)N[C@@H]2CCc3nnc(C(C)C)n3C2)cc1[N+](=O)[O-]	ZINC000180509716	496026077	/nfs/dbraw/zinc/02/60/77/496026077.db2.gz	PYBNSFDFXXNBSK-UKRRQHHQSA-N	0	3	373.457	3.374	10	5		FGBEHN
Cc1cc([N+](=O)[O-])ccc1CN1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190492286	497503088	/nfs/dbraw/zinc/50/30/88/497503088.db2.gz	YGBSMXVKFLGXFD-GOSISDBHSA-N	0	3	354.454	3.252	10	5		FGBEHN
CCC[C@@H](N[C@H]1CCCN(c2cccnn2)C1)c1cccc([N+](=O)[O-])c1	ZINC000089732083	494350202	/nfs/dbraw/zinc/35/02/02/494350202.db2.gz	ZVUNUXOZHXUYJZ-FUHWJXTLSA-N	0	3	355.442	3.485	10	5		FGBEHN
O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCc4ncnn4C3)o2)c(Cl)c1	ZINC000109072320	494827182	/nfs/dbraw/zinc/82/71/82/494827182.db2.gz	QMXGWCBRZRQEER-NSHDSACASA-N	0	3	373.800	3.204	10	5		FGBEHN
O=[N+]([O-])c1cccc(-c2ccc(CN3CCC[C@@H](Cn4cncn4)C3)o2)c1	ZINC000128598872	495121976	/nfs/dbraw/zinc/12/19/76/495121976.db2.gz	VNPFEELZZXFABB-OAHLLOKOSA-N	0	3	367.409	3.359	10	5		FGBEHN
CN(C)C[C@H](NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1	ZINC000129891001	495311745	/nfs/dbraw/zinc/31/17/45/495311745.db2.gz	ZDGHUYHHMJCABZ-SFHVURJKSA-N	0	3	352.394	3.109	10	5		FGBEHN
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCCC[C@@H]1c1cn[nH]c1	ZINC000114201618	495354062	/nfs/dbraw/zinc/35/40/62/495354062.db2.gz	WJQRVPPRFMKLSF-QGZVFWFLSA-N	0	3	357.414	3.182	10	5		FGBEHN
Cc1nc(C[C@@H]2CCCN(CCCOc3ccc([N+](=O)[O-])cc3)C2)no1	ZINC000171403021	495857553	/nfs/dbraw/zinc/85/75/53/495857553.db2.gz	TTXOGMZXFAXDQJ-HNNXBMFYSA-N	0	3	360.414	3.010	10	5		FGBEHN
CCO[C@@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)C12CCOCC2	ZINC000186418794	495990711	/nfs/dbraw/zinc/99/07/11/495990711.db2.gz	RYLBTQBFIQMRRH-HZPDHXFCSA-N	0	3	354.834	3.312	10	5		FGBEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000177546955	496107336	/nfs/dbraw/zinc/10/73/36/496107336.db2.gz	PPUQZHZYYXZLSD-GOSISDBHSA-N	0	3	362.474	3.043	10	5		FGBEHN
O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@@H]1CCCN(c3cccnn3)C1)CCC2	ZINC000248879204	497123697	/nfs/dbraw/zinc/12/36/97/497123697.db2.gz	KFBLUPMJVGPBJE-QAPCUYQASA-N	0	3	353.426	3.021	10	5		FGBEHN
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N(C)[C@H]1CCCN(c2cccnn2)C1	ZINC000245515874	497437423	/nfs/dbraw/zinc/43/74/23/497437423.db2.gz	FADARTIZQMPRDF-WBVHZDCISA-N	0	3	355.442	3.355	10	5		FGBEHN
C[C@@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccc(F)c(Cl)c1	ZINC000182405951	705839519	/nfs/dbraw/zinc/83/95/19/705839519.db2.gz	LIKMIHLMEAPKOZ-YPMHNXCESA-N	0	3	368.792	3.478	10	5		FGBEHN
CN(C)CCN1C(=O)c2cccc3cc4c(cccc4[N+](=O)[O-])c(c32)C1=O	ZINC000003805650	493857747	/nfs/dbraw/zinc/85/77/47/493857747.db2.gz	MTZHISSFBWKEQT-UHFFFAOYSA-N	0	3	363.373	3.059	10	5		FGBEHN
CN(C)C[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1	ZINC000125389532	495436823	/nfs/dbraw/zinc/43/68/23/495436823.db2.gz	MKTCOZTUNDCHCO-IBGZPJMESA-N	0	3	366.421	3.038	10	5		FGBEHN
CNc1cc(N2CCC[C@@H]2CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)ncn1	ZINC000180567693	496047080	/nfs/dbraw/zinc/04/70/80/496047080.db2.gz	QNKKQUGXHDLBQK-LSDHHAIUSA-N	0	3	370.457	3.055	10	5		FGBEHN
CC[C@@H](NC[C@@H](O)COCc1cccs1)c1cccc([N+](=O)[O-])c1	ZINC000181550687	496441476	/nfs/dbraw/zinc/44/14/76/496441476.db2.gz	VZJWPRUBTSBBEZ-NVXWUHKLSA-N	0	3	350.440	3.275	10	5		FGBEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000247502085	496873668	/nfs/dbraw/zinc/87/36/68/496873668.db2.gz	VCOZNISCRFBPFB-WFASDCNBSA-N	0	3	372.450	3.027	10	5		FGBEHN
CC(C)c1nnc2n1C[C@@H](N[C@@H]1CCCc3ccc([N+](=O)[O-])cc31)CC2	ZINC000193089219	497299939	/nfs/dbraw/zinc/29/99/39/497299939.db2.gz	NHOHNCGNZQNTDU-WMLDXEAASA-N	0	3	355.442	3.292	10	5		FGBEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1	ZINC000246112303	497625617	/nfs/dbraw/zinc/62/56/17/497625617.db2.gz	NNDSMIOFPMRBQU-QMTHXVAHSA-N	0	3	359.348	3.072	10	5		FGBEHN
COc1ccc([C@H]2[C@H](CNc3ccc([N+](=O)[O-])cn3)CCCN2C)cc1	ZINC000301298625	498045808	/nfs/dbraw/zinc/04/58/08/498045808.db2.gz	QDMMLHFOGQDMFY-KXBFYZLASA-N	0	3	356.426	3.493	10	5		FGBEHN
CCN(C)[C@H]1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1	ZINC000302759039	498561920	/nfs/dbraw/zinc/56/19/20/498561920.db2.gz	JNDSPKLWNJDHQM-KRWDZBQOSA-N	0	3	353.422	3.356	10	5		FGBEHN
O=[N+]([O-])c1ccc(F)cc1NC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000302789658	498575411	/nfs/dbraw/zinc/57/54/11/498575411.db2.gz	FLDFOXZYFQCNLH-KRWDZBQOSA-N	0	3	359.401	3.437	10	5		FGBEHN
O=c1[n-]ccc(N[C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1[N+](=O)[O-]	ZINC000596194569	506303499	/nfs/dbraw/zinc/30/34/99/506303499.db2.gz	OXHPVUQYQQBYQS-ARFHVFGLSA-N	0	3	354.410	3.018	10	5		FGBEHN
O=c1[n-]ccc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1[N+](=O)[O-]	ZINC000596194569	506303501	/nfs/dbraw/zinc/30/35/01/506303501.db2.gz	OXHPVUQYQQBYQS-ARFHVFGLSA-N	0	3	354.410	3.018	10	5		FGBEHN
O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CCc3ncnn3C2)s1	ZINC000109072508	494826733	/nfs/dbraw/zinc/82/67/33/494826733.db2.gz	WXWZJBOKFSPIMT-GFCCVEGCSA-N	0	3	355.423	3.019	10	5		FGBEHN
CCOCCN1CCN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@@H]1CC	ZINC000110560700	494988709	/nfs/dbraw/zinc/98/87/09/494988709.db2.gz	BIBOVDOQFZEQTM-HNNXBMFYSA-N	0	3	358.442	3.080	10	5		FGBEHN
Cc1ccc(N2CCCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)nn1	ZINC000182749090	495687496	/nfs/dbraw/zinc/68/74/96/495687496.db2.gz	JQCVUEXRGKFICI-MRXNPFEDSA-N	0	3	355.442	3.275	10	5		FGBEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000179721292	495704618	/nfs/dbraw/zinc/70/46/18/495704618.db2.gz	KYTGWKURPLTVFT-AWEZNQCLSA-N	0	3	366.421	3.326	10	5		FGBEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1	ZINC000131488438	494636388	/nfs/dbraw/zinc/63/63/88/494636388.db2.gz	FOUVGJFDECRQME-ZDUSSCGKSA-N	0	3	359.348	3.170	10	5		FGBEHN
Cn1cc(CN2CC[C@@]3(O)CCCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000093585049	494901173	/nfs/dbraw/zinc/90/11/73/494901173.db2.gz	RBJHHWXXLADBAO-XLIONFOSSA-N	0	3	370.453	3.122	10	5		FGBEHN
Cc1c(NC(=O)CCN2CCCC[C@@H]2c2cn[nH]c2)cccc1[N+](=O)[O-]	ZINC000114201630	495353496	/nfs/dbraw/zinc/35/34/96/495353496.db2.gz	SDYPKWGBKNJKTF-QGZVFWFLSA-N	0	3	357.414	3.182	10	5		FGBEHN
Cc1c(NC(=O)CCN2CCCC[C@H]2c2cn[nH]c2)cccc1[N+](=O)[O-]	ZINC000114201633	495353703	/nfs/dbraw/zinc/35/37/03/495353703.db2.gz	SDYPKWGBKNJKTF-KRWDZBQOSA-N	0	3	357.414	3.182	10	5		FGBEHN
CNc1cc(N2CCC[C@@H]2CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ncn1	ZINC000180566112	496046156	/nfs/dbraw/zinc/04/61/56/496046156.db2.gz	KYRGDDJKLSWDRT-GDBMZVCRSA-N	0	3	370.457	3.055	10	5		FGBEHN
CCOc1ccc([C@H](C)N[C@@H]2CCc3nc(C(C)C)nn3C2)cc1[N+](=O)[O-]	ZINC000180642036	496082811	/nfs/dbraw/zinc/08/28/11/496082811.db2.gz	KNWJFKIREUVTRU-DZGCQCFKSA-N	0	3	373.457	3.374	10	5		FGBEHN
C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC(c2ccn[nH]2)CC1	ZINC000195505784	496944563	/nfs/dbraw/zinc/94/45/63/496944563.db2.gz	LZLUMTONYFFGNE-GFCCVEGCSA-N	0	3	368.397	3.309	10	5		FGBEHN
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N(C)[C@H]1CCCN(c2cccnn2)C1	ZINC000245515871	497437690	/nfs/dbraw/zinc/43/76/90/497437690.db2.gz	FADARTIZQMPRDF-RDJZCZTQSA-N	0	3	355.442	3.355	10	5		FGBEHN
COc1ccc([C@H]2[C@H](CNc3c([N+](=O)[O-])c(C)nn3C)CCCN2C)cc1	ZINC000301308557	498049674	/nfs/dbraw/zinc/04/96/74/498049674.db2.gz	WQZSQOYAGZSQBM-YJBOKZPZSA-N	0	3	373.457	3.140	10	5		FGBEHN
C[C@@H]1CN(CCC2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)C[C@@H](C)O1	ZINC000301565693	498165790	/nfs/dbraw/zinc/16/57/90/498165790.db2.gz	PXJNCEUBPIIDCG-HUUCEWRRSA-N	0	3	365.449	3.450	10	5		FGBEHN
C[C@H]1CN(CC2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)C[C@H](C)O1	ZINC000091478908	494607393	/nfs/dbraw/zinc/60/73/93/494607393.db2.gz	QIMILONIXKSLET-KBPBESRZSA-N	0	3	351.422	3.060	10	5		FGBEHN
CN(C)C[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000024276816	494618188	/nfs/dbraw/zinc/61/81/88/494618188.db2.gz	XUSWNQZFEHXJSP-IBGZPJMESA-N	0	3	370.453	3.206	10	5		FGBEHN
CCn1cc(-c2ccc([N+](=O)[O-])cc2)cc1C(=O)NCCN1CCCCC1	ZINC000114747773	495421265	/nfs/dbraw/zinc/42/12/65/495421265.db2.gz	BQNUDDUPDSENDB-UHFFFAOYSA-N	0	3	370.453	3.299	10	5		FGBEHN
CCO[C@@H]1C[C@H](NCc2ccc(Cl)c([N+](=O)[O-])c2)C12CCOCC2	ZINC000185658744	495667134	/nfs/dbraw/zinc/66/71/34/495667134.db2.gz	OBYFRPRZEAKSIG-JKSUJKDBSA-N	0	3	354.834	3.312	10	5		FGBEHN
CC(C)c1nnc2n1C[C@H](N[C@@H]1CCCc3ccc([N+](=O)[O-])cc31)CC2	ZINC000193089203	497299820	/nfs/dbraw/zinc/29/98/20/497299820.db2.gz	NHOHNCGNZQNTDU-RHSMWYFYSA-N	0	3	355.442	3.292	10	5		FGBEHN
C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccc(F)c(Cl)c1	ZINC000182405932	705839582	/nfs/dbraw/zinc/83/95/82/705839582.db2.gz	LIKMIHLMEAPKOZ-AAEUAGOBSA-N	0	3	368.792	3.478	10	5		FGBEHN
Cc1cc(N[C@@H]2C[C@@H](C)N(C3CC3)C2)nc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000133499836	495021064	/nfs/dbraw/zinc/02/10/64/495021064.db2.gz	AKIMYVCIGZELQJ-UKRRQHHQSA-N	0	3	353.426	3.397	10	5		FGBEHN
CCn1cc(C2CCN(CCOc3ccc(OC)cc3[N+](=O)[O-])CC2)cn1	ZINC000173605016	495610009	/nfs/dbraw/zinc/61/00/09/495610009.db2.gz	PBNZWDBTKYGVJF-UHFFFAOYSA-N	0	3	374.441	3.078	10	5		FGBEHN
CNc1cc(N2CCC[C@@H]2CN[C@H](C)c2cccc([N+](=O)[O-])c2C)ncn1	ZINC000180567678	496047381	/nfs/dbraw/zinc/04/73/81/496047381.db2.gz	QNKKQUGXHDLBQK-HUUCEWRRSA-N	0	3	370.457	3.055	10	5		FGBEHN
C[C@@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(Cl)s1	ZINC000193114462	712882409	/nfs/dbraw/zinc/88/24/09/712882409.db2.gz	YNEMSHMMZSPLLH-PWSUYJOCSA-N	0	3	356.831	3.400	10	5		FGBEHN
Cc1nc(C)n(C[C@@H]2CCCN(C/C=C/c3ccccc3[N+](=O)[O-])C2)n1	ZINC000121926173	494891916	/nfs/dbraw/zinc/89/19/16/494891916.db2.gz	DTANYTCLKBFFFP-RCMYXZNBSA-N	0	3	355.442	3.229	10	5		FGBEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000137107894	495423552	/nfs/dbraw/zinc/42/35/52/495423552.db2.gz	CPJOEQRMUDLXNU-GFCCVEGCSA-N	0	3	361.364	3.320	10	5		FGBEHN
CC(C)C[C@H](CN(C)C)NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000120758554	495452105	/nfs/dbraw/zinc/45/21/05/495452105.db2.gz	WFWCJMNCUSUZNO-MRXNPFEDSA-N	0	3	362.474	3.245	10	5		FGBEHN
CCO[C@@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2Cl)C12CCOCC2	ZINC000186509393	496025223	/nfs/dbraw/zinc/02/52/23/496025223.db2.gz	CMWPSBBVBJGNSR-HZPDHXFCSA-N	0	3	354.834	3.312	10	5		FGBEHN
C[C@@H](CN(C)Cc1ccccc1)Nc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-]	ZINC000301987808	498358025	/nfs/dbraw/zinc/35/80/25/498358025.db2.gz	DPWPPWYIQRUQIH-ZDUSSCGKSA-N	0	3	367.409	3.176	10	5		FGBEHN
CCN(C)[C@@H]1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1	ZINC000302759042	498562170	/nfs/dbraw/zinc/56/21/70/498562170.db2.gz	JNDSPKLWNJDHQM-QGZVFWFLSA-N	0	3	353.422	3.356	10	5		FGBEHN
C[C@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(Cl)s1	ZINC000193114478	712882461	/nfs/dbraw/zinc/88/24/61/712882461.db2.gz	YNEMSHMMZSPLLH-CMPLNLGQSA-N	0	3	356.831	3.400	10	5		FGBEHN
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(Cl)s1	ZINC000193114447	712882467	/nfs/dbraw/zinc/88/24/67/712882467.db2.gz	YNEMSHMMZSPLLH-JQWIXIFHSA-N	0	3	356.831	3.400	10	5		FGBEHN
Cn1cc(CN2CCC(c3cc[nH]n3)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000092810660	494756075	/nfs/dbraw/zinc/75/60/75/494756075.db2.gz	SPHPSVYXLKWECM-UHFFFAOYSA-N	0	3	366.425	3.098	10	5		FGBEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000113227405	495285578	/nfs/dbraw/zinc/28/55/78/495285578.db2.gz	VCOZNISCRFBPFB-SWLSCSKDSA-N	0	3	372.450	3.027	10	5		FGBEHN
CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000160782990	496040872	/nfs/dbraw/zinc/04/08/72/496040872.db2.gz	JDUFGGVGSHSMRP-SWLSCSKDSA-N	0	3	351.472	3.165	10	5		FGBEHN
COc1ccc([C@@H]2[C@@H](CNc3ncccc3[N+](=O)[O-])CCCN2C)cc1	ZINC000301246626	498019326	/nfs/dbraw/zinc/01/93/26/498019326.db2.gz	AWTWMMKQCIGLLR-CRAIPNDOSA-N	0	3	356.426	3.493	10	5		FGBEHN
CC[C@@H](NC(=O)N(CCN(C)C)CC(C)C)c1cccc([N+](=O)[O-])c1	ZINC000176681603	495744886	/nfs/dbraw/zinc/74/48/86/495744886.db2.gz	ORAFZYJKGXNEIQ-QGZVFWFLSA-N	0	3	350.463	3.275	10	5		FGBEHN
CCOc1ccc([C@H](C)N[C@H]2CCc3nnc(C(C)C)n3C2)cc1[N+](=O)[O-]	ZINC000180509769	496026111	/nfs/dbraw/zinc/02/61/11/496026111.db2.gz	PYBNSFDFXXNBSK-ZFWWWQNUSA-N	0	3	373.457	3.374	10	5		FGBEHN
CSc1ccc(C(=O)N[C@H](CN(C)C)c2ccccc2)cc1[N+](=O)[O-]	ZINC000171887963	496076983	/nfs/dbraw/zinc/07/69/83/496076983.db2.gz	WPWDYNKIJJRUEI-OAHLLOKOSA-N	0	3	359.451	3.349	10	5		FGBEHN
CCN1CCC[C@H]1CN(C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000245457618	497416527	/nfs/dbraw/zinc/41/65/27/497416527.db2.gz	CDBVQGXAECCDFV-CJNGLKHVSA-N	0	3	359.430	3.122	10	5		FGBEHN
CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000245764814	497532640	/nfs/dbraw/zinc/53/26/40/497532640.db2.gz	JDUFGGVGSHSMRP-DOMZBBRYSA-N	0	3	351.472	3.165	10	5		FGBEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000246778900	497810063	/nfs/dbraw/zinc/81/00/63/497810063.db2.gz	CIIZEGXOOQGNAK-SWLSCSKDSA-N	0	3	374.466	3.177	10	5		FGBEHN
Cc1cc(NCC2CCN(C[C@@H](O)c3ccccc3)CC2)ncc1[N+](=O)[O-]	ZINC000301425714	498105274	/nfs/dbraw/zinc/10/52/74/498105274.db2.gz	HDEMRGLHBXUUEK-LJQANCHMSA-N	0	3	370.453	3.156	10	5		FGBEHN
Cc1cc(NCC2CCN(C[C@H](O)c3ccccc3)CC2)ncc1[N+](=O)[O-]	ZINC000301425713	498105358	/nfs/dbraw/zinc/10/53/58/498105358.db2.gz	HDEMRGLHBXUUEK-IBGZPJMESA-N	0	3	370.453	3.156	10	5		FGBEHN
C[C@@H]1CN(CCC2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)C[C@H](C)O1	ZINC000301565691	498165233	/nfs/dbraw/zinc/16/52/33/498165233.db2.gz	PXJNCEUBPIIDCG-GASCZTMLSA-N	0	3	365.449	3.450	10	5		FGBEHN
O=[N+]([O-])c1ccc(F)cc1NC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000302789659	498576435	/nfs/dbraw/zinc/57/64/35/498576435.db2.gz	FLDFOXZYFQCNLH-QGZVFWFLSA-N	0	3	359.401	3.437	10	5		FGBEHN
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(F)c(Cl)c1	ZINC000180730800	705755324	/nfs/dbraw/zinc/75/53/24/705755324.db2.gz	JZVSUFMLQIMEAH-FZMZJTMJSA-N	0	3	368.792	3.478	10	5		FGBEHN
Cc1ccc(Nc2ncnc(N(C)C3CCN(C)CC3)c2[N+](=O)[O-])c(C)c1	ZINC000040621333	211750961	/nfs/dbraw/zinc/75/09/61/211750961.db2.gz	IQJLQHGXMMRTJS-UHFFFAOYSA-N	0	3	370.457	3.276	10	5		FGBEHN
CC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1	ZINC000091408403	494592592	/nfs/dbraw/zinc/59/25/92/494592592.db2.gz	ZNZQASUTSXSILC-PXAZEXFGSA-N	0	3	363.439	3.044	10	5		FGBEHN
Cc1cc(N[C@@H]2C[C@H](C)N(C3CC3)C2)nc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000133499405	495021134	/nfs/dbraw/zinc/02/11/34/495021134.db2.gz	AKIMYVCIGZELQJ-DZGCQCFKSA-N	0	3	353.426	3.397	10	5		FGBEHN
COc1cc([N+](=O)[O-])c(C(=O)N[C@H](CC(C)C)CN(C)C)cc1SC	ZINC000137105758	495423287	/nfs/dbraw/zinc/42/32/87/495423287.db2.gz	GADVETMYKONCAY-GFCCVEGCSA-N	0	3	369.487	3.031	10	5		FGBEHN
CCc1nccn1[C@H]1CCCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000106217735	495436466	/nfs/dbraw/zinc/43/64/66/495436466.db2.gz	GSCGERWIIYTGMI-HNNXBMFYSA-N	0	3	371.441	3.019	10	5		FGBEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1	ZINC000170856027	495629351	/nfs/dbraw/zinc/62/93/51/495629351.db2.gz	UMBLXNKXAYROIX-MRXNPFEDSA-N	0	3	354.410	3.115	10	5		FGBEHN
CC[C@H](NC[C@H](O)CN1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1	ZINC000151792035	495949298	/nfs/dbraw/zinc/94/92/98/495949298.db2.gz	LAGRPFCNAWRBHM-SFTDATJTSA-N	0	3	369.465	3.055	10	5		FGBEHN
Cc1ccc([C@H](C)NC(=O)N[C@@H](CC(C)C)CN(C)C)cc1[N+](=O)[O-]	ZINC000175863930	496578583	/nfs/dbraw/zinc/57/85/83/496578583.db2.gz	RUVVFJDBFYBYLX-HOCLYGCPSA-N	0	3	350.463	3.240	10	5		FGBEHN
C[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1N1CCOCC1	ZINC000245724694	497517275	/nfs/dbraw/zinc/51/72/75/497517275.db2.gz	IOVULFYDTAXKFU-HNAYVOBHSA-N	0	3	371.437	3.007	10	5		FGBEHN
Cc1cc(N(C)C[C@@H]2CCCN(C)C2)nc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000301261456	498025873	/nfs/dbraw/zinc/02/58/73/498025873.db2.gz	FJYNFDIRVVAHQJ-OAHLLOKOSA-N	0	3	355.442	3.138	10	5		FGBEHN
CN(C)CCN1C(=O)c2cccc3cc4cccc([N+](=O)[O-])c4c(c32)C1=O	ZINC000003805649	493858140	/nfs/dbraw/zinc/85/81/40/493858140.db2.gz	QKANXVQSRQMWOM-UHFFFAOYSA-N	0	3	363.373	3.059	10	5		FGBEHN
CC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1	ZINC000091408402	494591444	/nfs/dbraw/zinc/59/14/44/494591444.db2.gz	ZNZQASUTSXSILC-SJCJKPOMSA-N	0	3	363.439	3.044	10	5		FGBEHN
O=[N+]([O-])c1ccccc1-c1ccc(CN2CCC[C@H](Cn3cncn3)C2)o1	ZINC000128554385	495115343	/nfs/dbraw/zinc/11/53/43/495115343.db2.gz	OESFEWTWTVXJRY-HNNXBMFYSA-N	0	3	367.409	3.359	10	5		FGBEHN
CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1C[C@@H](OCC)C12CCOCC2	ZINC000185654978	495664299	/nfs/dbraw/zinc/66/42/99/495664299.db2.gz	LWCHCFVKNFTANP-ZWKOTPCHSA-N	0	3	364.442	3.057	10	5		FGBEHN
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000172897765	496482065	/nfs/dbraw/zinc/48/20/65/496482065.db2.gz	NOBHWPIAEVNKDR-HXUWFJFHSA-N	0	3	367.449	3.308	10	5		FGBEHN
CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)COCc1ccccc1	ZINC000065512421	494206642	/nfs/dbraw/zinc/20/66/42/494206642.db2.gz	DUDSJENHKGFDRR-HXUWFJFHSA-N	0	3	358.438	3.383	10	5		FGBEHN
CCOc1cc(Nc2cnn(CCN3CCCCC3)c2)ccc1[N+](=O)[O-]	ZINC000092978333	494800877	/nfs/dbraw/zinc/80/08/77/494800877.db2.gz	WVUCSNYIADRPMM-UHFFFAOYSA-N	0	3	359.430	3.420	10	5		FGBEHN
O=[N+]([O-])c1cccc(-c2ccc(CN3CCC[C@H](Cn4cncn4)C3)o2)c1	ZINC000128598610	495122152	/nfs/dbraw/zinc/12/21/52/495122152.db2.gz	VNPFEELZZXFABB-HNNXBMFYSA-N	0	3	367.409	3.359	10	5		FGBEHN
Cc1cnn([C@@H]2CCCN(CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1	ZINC000106225643	495438999	/nfs/dbraw/zinc/43/89/99/495438999.db2.gz	OFFZKQMMZUIOPB-MRXNPFEDSA-N	0	3	371.441	3.074	10	5		FGBEHN
Cc1cnn([C@@H]2CCCN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)c1	ZINC000106225599	495439085	/nfs/dbraw/zinc/43/90/85/495439085.db2.gz	BAEMELKQTMTQFY-QGZVFWFLSA-N	0	3	371.441	3.074	10	5		FGBEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000155574463	496000044	/nfs/dbraw/zinc/00/00/44/496000044.db2.gz	CIIZEGXOOQGNAK-DOMZBBRYSA-N	0	3	374.466	3.177	10	5		FGBEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000248375350	496987570	/nfs/dbraw/zinc/98/75/70/496987570.db2.gz	WONCKJHGPIPVGQ-DGCLKSJQSA-N	0	3	371.890	3.185	10	5		FGBEHN
Cc1cc(C)cc(Oc2ncnc(N(C)C3CCN(C)CC3)c2[N+](=O)[O-])c1	ZINC000040582859	220911508	/nfs/dbraw/zinc/91/15/08/220911508.db2.gz	DOJMYKXTTCGMGA-UHFFFAOYSA-N	0	3	371.441	3.324	10	5		FGBEHN
CN(C)C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1	ZINC000117583919	494933293	/nfs/dbraw/zinc/93/32/93/494933293.db2.gz	MTNGQTAFIXHSHZ-QGZVFWFLSA-N	0	3	361.829	3.210	10	5		FGBEHN
O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@@H](N4CCOCC4)C3)s2)cc1	ZINC000120972763	495495318	/nfs/dbraw/zinc/49/53/18/495495318.db2.gz	QUBSPXLNIIFACE-QGZVFWFLSA-N	0	3	373.478	3.230	10	5		FGBEHN
O=C(NC[C@H]1CCCCN1Cc1ccccc1)Nc1ccncc1[N+](=O)[O-]	ZINC000183591060	496041079	/nfs/dbraw/zinc/04/10/79/496041079.db2.gz	GAJDFUHEOGAHPW-MRXNPFEDSA-N	0	3	369.425	3.166	10	5		FGBEHN
CC[C@H](NCCn1cnc2ccccc2c1=O)c1cccc([N+](=O)[O-])c1	ZINC000181535062	496435924	/nfs/dbraw/zinc/43/59/24/496435924.db2.gz	VBHHGHFAMZDFBS-KRWDZBQOSA-N	0	3	352.394	3.046	10	5		FGBEHN
CC(=O)N[C@@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1	ZINC000153835363	496595768	/nfs/dbraw/zinc/59/57/68/496595768.db2.gz	XYYMFXGYTOUHEO-OAHLLOKOSA-N	0	3	359.451	3.424	10	5		FGBEHN
CC(C)(C)OC(=O)N1CC([N+](=O)[O-])[C@H](c2ccccc2Cl)CC1=O	ZINC000098091263	222229608	/nfs/dbraw/zinc/22/96/08/222229608.db2.gz	SDECXKQTRYKVCF-WCQYABFASA-N	0	3	354.790	3.236	10	5		FGBEHN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCCC[C@@H]1c1cn[nH]c1	ZINC000114202622	495353595	/nfs/dbraw/zinc/35/35/95/495353595.db2.gz	RTXHIXIVDQMCHC-QGZVFWFLSA-N	0	3	357.414	3.182	10	5		FGBEHN
CCc1nccn1[C@@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000106212154	495433322	/nfs/dbraw/zinc/43/33/22/495433322.db2.gz	APELAJDVJYCVHV-QGZVFWFLSA-N	0	3	358.442	3.460	10	5		FGBEHN
CCO[C@H]1C[C@@H](NCc2ccc(Cl)c([N+](=O)[O-])c2)C12CCOCC2	ZINC000185658789	495667208	/nfs/dbraw/zinc/66/72/08/495667208.db2.gz	OBYFRPRZEAKSIG-CVEARBPZSA-N	0	3	354.834	3.312	10	5		FGBEHN
COc1ccc([N+](=O)[O-])cc1CN1CC[C@H](CNc2cccc(C)n2)C1	ZINC000171652548	495972548	/nfs/dbraw/zinc/97/25/48/495972548.db2.gz	URVFJFUOGYXLQD-OAHLLOKOSA-N	0	3	356.426	3.241	10	5		FGBEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000177706660	496165807	/nfs/dbraw/zinc/16/58/07/496165807.db2.gz	CDBVQGXAECCDFV-XJKSGUPXSA-N	0	3	359.430	3.122	10	5		FGBEHN
O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000246371803	497710880	/nfs/dbraw/zinc/71/08/80/497710880.db2.gz	YOQZZVSJJHGSDZ-YZGWKJHDSA-N	0	3	356.422	3.216	10	5		FGBEHN
Cc1cc(N2CCN(C)C[C@@H]2C(C)C)nc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000301390853	498089460	/nfs/dbraw/zinc/08/94/60/498089460.db2.gz	ZLSSENKCTDYMIF-QGZVFWFLSA-N	0	3	355.442	3.137	10	5		FGBEHN
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000052555824	494039724	/nfs/dbraw/zinc/03/97/24/494039724.db2.gz	RFIOADHEGPBLHZ-KSSFIOAISA-N	0	3	373.478	3.495	10	5		FGBEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc([N+](=O)[O-])cc1Br	ZINC000119826297	495249791	/nfs/dbraw/zinc/24/97/91/495249791.db2.gz	OOCBBLNKEBSBOY-NSHDSACASA-N	0	3	372.263	3.063	10	5		FGBEHN
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N(C)[C@@H]1CCCN(c2cccnn2)C1	ZINC000182749239	495687205	/nfs/dbraw/zinc/68/72/05/495687205.db2.gz	FADARTIZQMPRDF-NVXWUHKLSA-N	0	3	355.442	3.355	10	5		FGBEHN
Cc1cccc(NC[C@H]2CCN(CCOc3ccccc3[N+](=O)[O-])C2)n1	ZINC000171648762	495968243	/nfs/dbraw/zinc/96/82/43/495968243.db2.gz	KVTZWZZIOHHRBK-MRXNPFEDSA-N	0	3	356.426	3.111	10	5		FGBEHN
C[C@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2	ZINC000181758436	496531667	/nfs/dbraw/zinc/53/16/67/496531667.db2.gz	FNCRKKCOFCGNIG-ZDUSSCGKSA-N	0	3	371.393	3.045	10	5		FGBEHN
CC1(C)CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CCN1	ZINC000262356875	497544567	/nfs/dbraw/zinc/54/45/67/497544567.db2.gz	VYWNZBIDBCWGBP-UHFFFAOYSA-N	0	3	365.231	3.094	10	5		FGBEHN
O=[N+]([O-])c1cnc(NC[C@@H]2NCCc3ccccc32)c(Br)c1	ZINC000262403489	497550385	/nfs/dbraw/zinc/55/03/85/497550385.db2.gz	CNAQUQLPQDBSRW-AWEZNQCLSA-N	0	3	363.215	3.051	10	5		FGBEHN
COC(=O)c1cc(N2CCN(C3CCC(C)CC3)CC2)ccc1[N+](=O)[O-]	ZINC000301256166	498023970	/nfs/dbraw/zinc/02/39/70/498023970.db2.gz	DJYRODOFHSFXMA-UHFFFAOYSA-N	0	3	361.442	3.082	10	5		FGBEHN
CCOc1ccc(C(=O)N[C@@H](CN(C)C)c2ccccc2)cc1[N+](=O)[O-]	ZINC000007818144	494045806	/nfs/dbraw/zinc/04/58/06/494045806.db2.gz	SLNHTDYYQFOBAP-INIZCTEOSA-N	0	3	357.410	3.026	10	5		FGBEHN
CC[C@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1cccc([N+](=O)[O-])c1	ZINC000088608295	494253265	/nfs/dbraw/zinc/25/32/65/494253265.db2.gz	UBDJLJCMSPPLEF-SFHVURJKSA-N	0	3	374.441	3.412	10	5		FGBEHN
Cn1cc(CN2CC[C@]3(O)CCCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000093585045	494901998	/nfs/dbraw/zinc/90/19/98/494901998.db2.gz	RBJHHWXXLADBAO-YLJYHZDGSA-N	0	3	370.453	3.122	10	5		FGBEHN
Cc1cccc(NC[C@@H]2CCN(Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)n1	ZINC000177034845	495893204	/nfs/dbraw/zinc/89/32/04/495893204.db2.gz	LQDCMKYYDPTLOL-AWEZNQCLSA-N	0	3	367.409	3.373	10	5		FGBEHN
C[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1N1CCOCC1	ZINC000180229535	495916546	/nfs/dbraw/zinc/91/65/46/495916546.db2.gz	FQMVPXFQHKUHRA-KXBFYZLASA-N	0	3	371.437	3.007	10	5		FGBEHN
Cc1ccc([C@@H](C)NC(=O)N[C@@H](CC(C)C)CN(C)C)cc1[N+](=O)[O-]	ZINC000175863912	496578389	/nfs/dbraw/zinc/57/83/89/496578389.db2.gz	RUVVFJDBFYBYLX-ZBFHGGJFSA-N	0	3	350.463	3.240	10	5		FGBEHN
O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@H]1CCCN(c3cccnn3)C1)CCC2	ZINC000248879207	497123777	/nfs/dbraw/zinc/12/37/77/497123777.db2.gz	KFBLUPMJVGPBJE-YJBOKZPZSA-N	0	3	353.426	3.021	10	5		FGBEHN
O=[N+]([O-])c1cc(Br)cnc1NC[C@H]1NCCc2ccccc21	ZINC000262583201	497578632	/nfs/dbraw/zinc/57/86/32/497578632.db2.gz	ZICGRTAPWZMHOG-CYBMUJFWSA-N	0	3	363.215	3.051	10	5		FGBEHN
CN(c1cc(CO)ccc1[N+](=O)[O-])[C@H]1CCCN(Cc2ccccc2)C1	ZINC000302055002	498386355	/nfs/dbraw/zinc/38/63/55/498386355.db2.gz	QGOGNHQSEYTHJA-SFHVURJKSA-N	0	3	355.438	3.188	10	5		FGBEHN
Cc1ccc(N2CCCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)nn1	ZINC000182749109	495687687	/nfs/dbraw/zinc/68/76/87/495687687.db2.gz	JQCVUEXRGKFICI-INIZCTEOSA-N	0	3	355.442	3.275	10	5		FGBEHN
C[C@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1N1CCOCC1	ZINC000180231272	495916211	/nfs/dbraw/zinc/91/62/11/495916211.db2.gz	SIHMCSGYKNNGHN-KXBFYZLASA-N	0	3	371.437	3.007	10	5		FGBEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000133277020	494993905	/nfs/dbraw/zinc/99/39/05/494993905.db2.gz	ZMLGEQKVNNOYFC-INIZCTEOSA-N	0	3	362.474	3.245	10	5		FGBEHN
CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1C[C@H](OCC)C12CCOCC2	ZINC000185654920	495664551	/nfs/dbraw/zinc/66/45/51/495664551.db2.gz	LWCHCFVKNFTANP-MSOLQXFVSA-N	0	3	364.442	3.057	10	5		FGBEHN
Cc1ccc([C@H](C)NC(=O)N[C@H](CC(C)C)CN(C)C)cc1[N+](=O)[O-]	ZINC000175863966	496578279	/nfs/dbraw/zinc/57/82/79/496578279.db2.gz	RUVVFJDBFYBYLX-GOEBONIOSA-N	0	3	350.463	3.240	10	5		FGBEHN
CC(C)c1nc2n(n1)C[C@H](N[C@@H]1CCCc3ccc([N+](=O)[O-])cc31)CC2	ZINC000192984687	497267219	/nfs/dbraw/zinc/26/72/19/497267219.db2.gz	HXIKZVKTYHRGJN-RHSMWYFYSA-N	0	3	355.442	3.292	10	5		FGBEHN
Cc1cc(N2CCN(C)C[C@H]2C(C)C)nc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000301390850	498089544	/nfs/dbraw/zinc/08/95/44/498089544.db2.gz	ZLSSENKCTDYMIF-KRWDZBQOSA-N	0	3	355.442	3.137	10	5		FGBEHN
COC(=O)c1cc([N+](=O)[O-])c(N[C@H]2CN(C(C)C)C[C@H]2C)cc1Cl	ZINC000301655464	498208847	/nfs/dbraw/zinc/20/88/47/498208847.db2.gz	HQOAVVFTFCFLHB-YGRLFVJLSA-N	0	3	355.822	3.175	10	5		FGBEHN
C[C@H]1CCN(c2cc(CO)ccc2[N+](=O)[O-])CCN1Cc1ccccc1	ZINC000302021817	498372332	/nfs/dbraw/zinc/37/23/32/498372332.db2.gz	FUBVYCWWQTZUFL-INIZCTEOSA-N	0	3	355.438	3.188	10	5		FGBEHN
C[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccc(Cl)s1	ZINC000183022871	705874669	/nfs/dbraw/zinc/87/46/69/705874669.db2.gz	NQHIIAAMATXGQL-GHMZBOCLSA-N	0	3	356.831	3.400	10	5		FGBEHN
O=C1C[C@H](c2cc(F)c(F)cc2F)C([N+](=O)[O-])CN1Cc1ccccc1	ZINC000060246438	493920510	/nfs/dbraw/zinc/92/05/10/493920510.db2.gz	XMGMJEQNEFDSGJ-DYVFJYSZSA-N	0	3	364.323	3.265	10	5		FGBEHN
CC(C)(C)OC(=O)N1CC([N+](=O)[O-])[C@@H](c2ccccc2Cl)CC1=O	ZINC000072232752	494145411	/nfs/dbraw/zinc/14/54/11/494145411.db2.gz	SDECXKQTRYKVCF-YPMHNXCESA-N	0	3	354.790	3.236	10	5		FGBEHN
COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@H]1c1ccco1	ZINC000116293182	494753866	/nfs/dbraw/zinc/75/38/66/494753866.db2.gz	ZPFMJKZDLAWRAJ-HNNXBMFYSA-N	0	3	359.382	3.362	10	5		FGBEHN
CCOCCN1CCN(c2ccc([N+](=O)[O-])c3cccnc32)C[C@H]1CC	ZINC000116871247	494864301	/nfs/dbraw/zinc/86/43/01/494864301.db2.gz	STFONTWHCBMJNW-OAHLLOKOSA-N	0	3	358.442	3.080	10	5		FGBEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000113228631	495285927	/nfs/dbraw/zinc/28/59/27/495285927.db2.gz	SPUISWUEWIDYBK-IUODEOHRSA-N	0	3	372.450	3.027	10	5		FGBEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000113227402	495286382	/nfs/dbraw/zinc/28/63/82/495286382.db2.gz	VCOZNISCRFBPFB-IUODEOHRSA-N	0	3	372.450	3.027	10	5		FGBEHN
Cc1nn(C)c(C)c1[C@@H]1CCCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000106211676	495432662	/nfs/dbraw/zinc/43/26/62/495432662.db2.gz	WLMPRAZXAKKTLU-KRWDZBQOSA-N	0	3	371.441	3.111	10	5		FGBEHN
C[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1N1CCOCC1	ZINC000180227964	495914749	/nfs/dbraw/zinc/91/47/49/495914749.db2.gz	IOVULFYDTAXKFU-KXBFYZLASA-N	0	3	371.437	3.007	10	5		FGBEHN
C[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccc(-c2ccccc2)cc1	ZINC000174660464	496050552	/nfs/dbraw/zinc/05/05/52/496050552.db2.gz	MESOWHPCXRDZIQ-MGPUTAFESA-N	0	3	366.421	3.170	10	5		FGBEHN
Cc1ncsc1CN(C)C[C@H]1CCN(Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000190465084	497490287	/nfs/dbraw/zinc/49/02/87/497490287.db2.gz	UIPXRBXXFFLQGK-MRXNPFEDSA-N	0	3	360.483	3.314	10	5		FGBEHN
Cc1cc([N+](=O)[O-])ccc1CN1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190492313	497502471	/nfs/dbraw/zinc/50/24/71/497502471.db2.gz	YGBSMXVKFLGXFD-SFHVURJKSA-N	0	3	354.454	3.252	10	5		FGBEHN
Cc1c(Br)c(NCc2ccc3c(c2)CNC3)ncc1[N+](=O)[O-]	ZINC000262433899	497556214	/nfs/dbraw/zinc/55/62/14/497556214.db2.gz	GCMVIJLRDASBSK-UHFFFAOYSA-N	0	3	363.215	3.276	10	5		FGBEHN
COC(=O)c1cc([N+](=O)[O-])c(N[C@H]2CN(C(C)C)C[C@@H]2C)cc1Cl	ZINC000301655458	498208926	/nfs/dbraw/zinc/20/89/26/498208926.db2.gz	HQOAVVFTFCFLHB-HZMBPMFUSA-N	0	3	355.822	3.175	10	5		FGBEHN