smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(C[C@@H]1CCC[N@H+]1C)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000422016489 240101528 /nfs/dbraw/zinc/10/15/28/240101528.db2.gz GTJMGOJMYFMFAE-INIZCTEOSA-N 1 1 334.420 2.340 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H](CO)[C@H]3CCCO3)cs2)c1 ZINC000447985379 242349152 /nfs/dbraw/zinc/34/91/52/242349152.db2.gz FMQCYWJVKSIWQX-LSDHHAIUSA-N 1 1 349.412 2.348 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451418788 243107613 /nfs/dbraw/zinc/10/76/13/243107613.db2.gz NBIGSGRACXRZHK-DJIMGWMZSA-N 1 1 347.415 2.467 20 5 EEBDMO CC[C@@H]1C[N@@H+](CC)CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000451740047 243237749 /nfs/dbraw/zinc/23/77/49/243237749.db2.gz KXGXJRHJDLTCFE-CQSZACIVSA-N 1 1 334.420 2.340 20 5 EEBDMO CC[C@@H]1CN(CC)CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000451740047 243237755 /nfs/dbraw/zinc/23/77/55/243237755.db2.gz KXGXJRHJDLTCFE-CQSZACIVSA-N 1 1 334.420 2.340 20 5 EEBDMO CC[C@@H]1CN(CC)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000451740047 243237759 /nfs/dbraw/zinc/23/77/59/243237759.db2.gz KXGXJRHJDLTCFE-CQSZACIVSA-N 1 1 334.420 2.340 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000266456188 284341619 /nfs/dbraw/zinc/34/16/19/284341619.db2.gz YNQHMCWARDSVHL-ZDUSSCGKSA-N 1 1 337.445 2.487 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000246116734 205177615 /nfs/dbraw/zinc/17/76/15/205177615.db2.gz ACASPIGHRVNSFW-BBRMVZONSA-N 1 1 332.404 2.092 20 5 EEBDMO Cn1ccnc1C(=O)c1ccc(NC[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC000112076670 220238756 /nfs/dbraw/zinc/23/87/56/220238756.db2.gz NLKFEQRBIPNOTC-CYBMUJFWSA-N 1 1 343.387 2.065 20 5 EEBDMO C[C@@H]1CCC[C@H](CO)[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000162381069 206399158 /nfs/dbraw/zinc/39/91/58/206399158.db2.gz XTGNMKHQJDIJAR-BXUZGUMPSA-N 1 1 332.360 2.380 20 5 EEBDMO C[C@@H]1CCC[C@H](CO)[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000162381069 206399161 /nfs/dbraw/zinc/39/91/61/206399161.db2.gz XTGNMKHQJDIJAR-BXUZGUMPSA-N 1 1 332.360 2.380 20 5 EEBDMO CC[N@H+](Cc1cccc(Cl)c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266480918 248323160 /nfs/dbraw/zinc/32/31/60/248323160.db2.gz TUIIDWHVZWHONG-OAHLLOKOSA-N 1 1 338.795 2.328 20 5 EEBDMO CN(CCn1ccc([N+](=O)[O-])n1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000176286152 207211131 /nfs/dbraw/zinc/21/11/31/207211131.db2.gz KODNZWASTWBWFR-KRWDZBQOSA-N 1 1 343.431 2.245 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C[N@H+]1C1CC1 ZINC000267988851 256102543 /nfs/dbraw/zinc/10/25/43/256102543.db2.gz PRJVPOXGPUWMIL-OCCSQVGLSA-N 1 1 342.399 2.291 20 5 EEBDMO CCC1(CO)CC[NH+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000270927139 256188475 /nfs/dbraw/zinc/18/84/75/256188475.db2.gz SWIHJIRESBSMGM-ZDUSSCGKSA-N 1 1 335.404 2.406 20 5 EEBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CC[N@@H+]3CCCC[C@H]23)s1 ZINC000272819357 256242033 /nfs/dbraw/zinc/24/20/33/256242033.db2.gz IOXYRAFBDFFBCN-NXEZZACHSA-N 1 1 345.446 2.099 20 5 EEBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CC[N@H+]3CCCC[C@H]23)s1 ZINC000272819357 256242035 /nfs/dbraw/zinc/24/20/35/256242035.db2.gz IOXYRAFBDFFBCN-NXEZZACHSA-N 1 1 345.446 2.099 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000276258342 256415999 /nfs/dbraw/zinc/41/59/99/256415999.db2.gz ARUFRDFXKZWKKZ-NWDGAFQWSA-N 1 1 327.812 2.135 20 5 EEBDMO CC(C)CCNC(=O)[C@@H](C)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072665138 292168133 /nfs/dbraw/zinc/16/81/33/292168133.db2.gz FNZDERGQUYHRSW-KGLIPLIRSA-N 1 1 349.435 2.027 20 5 EEBDMO CC(C)CCNC(=O)[C@@H](C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072665138 292168135 /nfs/dbraw/zinc/16/81/35/292168135.db2.gz FNZDERGQUYHRSW-KGLIPLIRSA-N 1 1 349.435 2.027 20 5 EEBDMO COc1cccc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1 ZINC000173463534 152167333 /nfs/dbraw/zinc/16/73/33/152167333.db2.gz KDRPDYQCBCQHHM-ZDUSSCGKSA-N 1 1 329.360 2.080 20 5 EEBDMO COc1cccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1 ZINC000173463534 152167335 /nfs/dbraw/zinc/16/73/35/152167335.db2.gz KDRPDYQCBCQHHM-ZDUSSCGKSA-N 1 1 329.360 2.080 20 5 EEBDMO O=[N+]([O-])c1cnc(N[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2CO)s1 ZINC000249295311 160377498 /nfs/dbraw/zinc/37/74/98/160377498.db2.gz QXICHXSCVDZZCK-KGLIPLIRSA-N 1 1 348.428 2.346 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000081362921 159151346 /nfs/dbraw/zinc/15/13/46/159151346.db2.gz YCTRDVFVPPLWOM-ZDUSSCGKSA-N 1 1 335.404 2.407 20 5 EEBDMO O=[N+]([O-])c1ccc(Br)cc1NCCC[NH+]1CCOCC1 ZINC000087834148 159174170 /nfs/dbraw/zinc/17/41/70/159174170.db2.gz POACZBJSNMXMRI-UHFFFAOYSA-N 1 1 344.209 2.492 20 5 EEBDMO CC[N@H+]1CCC[C@@H](CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000105177100 159297877 /nfs/dbraw/zinc/29/78/77/159297877.db2.gz KXVVUGVPUPMWLV-HNNXBMFYSA-N 1 1 334.420 2.168 20 5 EEBDMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])o1 ZINC000193794232 160186753 /nfs/dbraw/zinc/18/67/53/160186753.db2.gz WDIJYQMIAGJOHG-AWEZNQCLSA-N 1 1 329.356 2.440 20 5 EEBDMO O=C(CC[N@H+]1CC[C@H]2OCCC[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000246511341 160283199 /nfs/dbraw/zinc/28/31/99/160283199.db2.gz FIXDXNRVZSXDEN-XJKSGUPXSA-N 1 1 333.388 2.424 20 5 EEBDMO C[N@@H+]1CCC[C@@H]2CN(CCC(=O)Nc3ccccc3[N+](=O)[O-])CC[C@H]21 ZINC000247013018 160305832 /nfs/dbraw/zinc/30/58/32/160305832.db2.gz QBURJAMMFIKMLA-GDBMZVCRSA-N 1 1 346.431 2.340 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(CCC(=O)Nc3ccccc3[N+](=O)[O-])CC[C@H]21 ZINC000247013018 160305833 /nfs/dbraw/zinc/30/58/33/160305833.db2.gz QBURJAMMFIKMLA-GDBMZVCRSA-N 1 1 346.431 2.340 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)c1 ZINC000338521926 160773581 /nfs/dbraw/zinc/77/35/81/160773581.db2.gz AYFNHOSPBBKINE-ZDUSSCGKSA-N 1 1 333.388 2.302 20 5 EEBDMO C[N@@H+](CC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])[C@@H]1CCSC1 ZINC000345815271 161334478 /nfs/dbraw/zinc/33/44/78/161334478.db2.gz XCRPHDIPGNCYCP-GFCCVEGCSA-N 1 1 337.445 2.383 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)CCOc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000345975074 161346708 /nfs/dbraw/zinc/34/67/08/161346708.db2.gz XTKOQMGHZBFTDE-ZIAGYGMSSA-N 1 1 335.404 2.305 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C[C@@H]1C ZINC000345974132 161346961 /nfs/dbraw/zinc/34/69/61/161346961.db2.gz XRJIAGGZALTGIK-QWRGUYRKSA-N 1 1 331.376 2.026 20 5 EEBDMO COc1c(C(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000354981478 163040643 /nfs/dbraw/zinc/04/06/43/163040643.db2.gz OHXVIBUUCPFECT-CHWSQXEVSA-N 1 1 335.404 2.454 20 5 EEBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000356305879 163399944 /nfs/dbraw/zinc/39/99/44/163399944.db2.gz WEFYMEQWVKLKHP-QGZVFWFLSA-N 1 1 335.379 2.221 20 5 EEBDMO Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000366724400 165843312 /nfs/dbraw/zinc/84/33/12/165843312.db2.gz OPDULNJCYBDDCC-CYBMUJFWSA-N 1 1 347.419 2.099 20 5 EEBDMO CN(C(=O)C[NH+]1CCC(n2cccn2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000369119409 166194200 /nfs/dbraw/zinc/19/42/00/166194200.db2.gz LOXFDDFEQXUWTK-UHFFFAOYSA-N 1 1 343.387 2.091 20 5 EEBDMO CCC[C@@]1(CO)CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000277805871 269185352 /nfs/dbraw/zinc/18/53/52/269185352.db2.gz PQQLRXFBSSEVHW-SFHVURJKSA-N 1 1 347.415 2.111 20 5 EEBDMO C[N@H+]1CC[C@H]2OCCN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)[C@H]2C1 ZINC000284447980 269596301 /nfs/dbraw/zinc/59/63/01/269596301.db2.gz CJJDYZBAPFFZPV-QWHCGFSZSA-N 1 1 343.330 2.106 20 5 EEBDMO CC(C)CCOCCNC(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271795212 274153558 /nfs/dbraw/zinc/15/35/58/274153558.db2.gz VNVPTIBGJIVNOG-CQSZACIVSA-N 1 1 337.420 2.424 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1 ZINC000274444556 274196445 /nfs/dbraw/zinc/19/64/45/274196445.db2.gz IAMCTULGQRJONE-CYBMUJFWSA-N 1 1 334.420 2.263 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000408069981 274331169 /nfs/dbraw/zinc/33/11/69/274331169.db2.gz HAQIRZVSRLJCMP-VXGBXAGGSA-N 1 1 328.372 2.308 20 5 EEBDMO CN(C)CC[N@@H+](C)CCCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000289169879 275102195 /nfs/dbraw/zinc/10/21/95/275102195.db2.gz UZQQAKPTTKJVFU-UHFFFAOYSA-N 1 1 349.357 2.304 20 5 EEBDMO CN(CCCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])CC[NH+](C)C ZINC000289169879 275102196 /nfs/dbraw/zinc/10/21/96/275102196.db2.gz UZQQAKPTTKJVFU-UHFFFAOYSA-N 1 1 349.357 2.304 20 5 EEBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CC[NH+](CCO)CC1 ZINC000290102070 275179774 /nfs/dbraw/zinc/17/97/74/275179774.db2.gz WXJMTQYLINSEQX-UHFFFAOYSA-N 1 1 334.203 2.012 20 5 EEBDMO CC[N@@H+](CCO)CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290801643 275241320 /nfs/dbraw/zinc/24/13/20/275241320.db2.gz FGNVWEAZGVHRRL-UHFFFAOYSA-N 1 1 336.219 2.305 20 5 EEBDMO CCN(CCO)CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290801643 275241321 /nfs/dbraw/zinc/24/13/21/275241321.db2.gz FGNVWEAZGVHRRL-UHFFFAOYSA-N 1 1 336.219 2.305 20 5 EEBDMO COC(=O)c1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)n(C)c1C ZINC000291159168 275276855 /nfs/dbraw/zinc/27/68/55/275276855.db2.gz IDMCBLAHGNLARO-UHFFFAOYSA-N 1 1 347.371 2.327 20 5 EEBDMO COCc1cc([N+](=O)[O-])ccc1N1CC[C@@H]([NH+]2CCOCC2)[C@H]1C ZINC000291171132 275277933 /nfs/dbraw/zinc/27/79/33/275277933.db2.gz RBASPEBFTXYJTC-CZUORRHYSA-N 1 1 335.404 2.041 20 5 EEBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)C2 ZINC000291420512 275303744 /nfs/dbraw/zinc/30/37/44/275303744.db2.gz KKOSDFSLHSDGSJ-AWEZNQCLSA-N 1 1 328.372 2.021 20 5 EEBDMO C[C@@H](NC(=O)N1CC[C@]2(CC[N@@H+](C)C2)C1)c1cccc([N+](=O)[O-])c1 ZINC000291673781 275328756 /nfs/dbraw/zinc/32/87/56/275328756.db2.gz QIIWXFUTIBHFLS-DYVFJYSZSA-N 1 1 332.404 2.393 20 5 EEBDMO CCc1ccc(C(=O)N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000188736620 281395432 /nfs/dbraw/zinc/39/54/32/281395432.db2.gz WAEFGWPEUDAUCI-CYBMUJFWSA-N 1 1 349.431 2.074 20 5 EEBDMO CC(C)[C@H](C(=O)NCc1cccc([N+](=O)[O-])c1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000255165687 292695590 /nfs/dbraw/zinc/69/55/90/292695590.db2.gz LUILOBRYLKNYKI-CKEIUWERSA-N 1 1 349.431 2.345 20 5 EEBDMO COC(=O)CC1(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000281380431 292752759 /nfs/dbraw/zinc/75/27/59/292752759.db2.gz CCHILTZOANTXDP-UHFFFAOYSA-N 1 1 333.388 2.060 20 5 EEBDMO NC(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000293610574 293251439 /nfs/dbraw/zinc/25/14/39/293251439.db2.gz VOTGRUSTERSLHD-UHFFFAOYSA-N 1 1 331.294 2.311 20 5 EEBDMO C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1nccc2cc([N+](=O)[O-])ccc21 ZINC000295655518 293781519 /nfs/dbraw/zinc/78/15/19/293781519.db2.gz HALMRIQLRVNRNP-CZUORRHYSA-N 1 1 342.399 2.442 20 5 EEBDMO COCCC[N@@H+](CCO)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425441903 314394614 /nfs/dbraw/zinc/39/46/14/314394614.db2.gz IVPIEOCKMQKGJI-UHFFFAOYSA-N 1 1 347.209 2.188 20 5 EEBDMO C[NH+](C)[C@H]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000448881521 315396786 /nfs/dbraw/zinc/39/67/86/315396786.db2.gz MBSXQPCLOZQQRO-AWEZNQCLSA-N 1 1 343.387 2.151 20 5 EEBDMO C[C@H]1CC[N@@H+](CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000547269581 318276601 /nfs/dbraw/zinc/27/66/01/318276601.db2.gz WHPRFZDZEVPVEW-LBPRGKRZSA-N 1 1 337.395 2.470 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])c1ccccc1Cl ZINC000547752009 318318991 /nfs/dbraw/zinc/31/89/91/318318991.db2.gz RUXUMIOHOALFHW-LBPRGKRZSA-N 1 1 337.767 2.004 20 5 EEBDMO O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000567561214 319389966 /nfs/dbraw/zinc/38/99/66/319389966.db2.gz OLDUXDQPDJYTPP-INIZCTEOSA-N 1 1 332.404 2.411 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1Cc1c([N+](=O)[O-])ncn1C ZINC000347592466 465111315 /nfs/dbraw/zinc/11/13/15/465111315.db2.gz NNBZOYJSYDSHHO-GJZGRUSLSA-N 1 1 343.431 2.423 20 5 EEBDMO COc1cc(CN2CCC[C@H](C[NH+]3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000337404095 465349797 /nfs/dbraw/zinc/34/97/97/465349797.db2.gz LUVBFSISAUERAH-MRXNPFEDSA-N 1 1 349.431 2.148 20 5 EEBDMO CN1CC[N@@H+](C)C[C@@H]1CNc1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC000590580089 468277034 /nfs/dbraw/zinc/27/70/34/468277034.db2.gz ZMLDFLMONVHZEA-NSHDSACASA-N 1 1 332.326 2.271 20 5 EEBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC1 ZINC000521141593 468291836 /nfs/dbraw/zinc/29/18/36/468291836.db2.gz NAMZJONYLWQPOK-UHFFFAOYSA-N 1 1 349.387 2.270 20 5 EEBDMO COC(=O)CC[N@@H+]1CCN(c2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000089265526 462660119 /nfs/dbraw/zinc/66/01/19/462660119.db2.gz JATMCGXDLGCOTB-LLVKDONJSA-N 1 1 341.795 2.322 20 5 EEBDMO COC(=O)CC[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000089265526 462660122 /nfs/dbraw/zinc/66/01/22/462660122.db2.gz JATMCGXDLGCOTB-LLVKDONJSA-N 1 1 341.795 2.322 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@]3(CCOC3)C2)cccc1[N+](=O)[O-] ZINC000153686053 462679036 /nfs/dbraw/zinc/67/90/36/462679036.db2.gz LUFRRACMFUMSSS-DYVFJYSZSA-N 1 1 333.388 2.343 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@]2(CCOC2)C1 ZINC000153903374 462707365 /nfs/dbraw/zinc/70/73/65/462707365.db2.gz CDWXWLBLOIYIKM-KRWDZBQOSA-N 1 1 349.387 2.044 20 5 EEBDMO COc1cc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000154180139 462738261 /nfs/dbraw/zinc/73/82/61/462738261.db2.gz BAKPXEMOPWMBFA-KBPBESRZSA-N 1 1 333.388 2.160 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2n[nH]cc2C1 ZINC000118854575 462856721 /nfs/dbraw/zinc/85/67/21/462856721.db2.gz PAMGPCGEMDJAJE-UHFFFAOYSA-N 1 1 329.360 2.013 20 5 EEBDMO CCOC(=O)N[C@H]1CCC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000051857566 463051753 /nfs/dbraw/zinc/05/17/53/463051753.db2.gz WEFNGUJDTZWJHV-ZDUSSCGKSA-N 1 1 337.376 2.184 20 5 EEBDMO CCOC(=O)N[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000051857566 463051754 /nfs/dbraw/zinc/05/17/54/463051754.db2.gz WEFNGUJDTZWJHV-ZDUSSCGKSA-N 1 1 337.376 2.184 20 5 EEBDMO Cc1ccc(C(=O)NC[C@@H](CC(C)C)[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000026061202 463148253 /nfs/dbraw/zinc/14/82/53/463148253.db2.gz BQYBJFQVDAHVGB-MRXNPFEDSA-N 1 1 349.431 2.380 20 5 EEBDMO Cc1ncsc1CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000078950151 463171137 /nfs/dbraw/zinc/17/11/37/463171137.db2.gz NAJVCEBHKOFSRI-LBPRGKRZSA-N 1 1 333.417 2.484 20 5 EEBDMO CC(C)[N@H+]1CCCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000068777307 463173906 /nfs/dbraw/zinc/17/39/06/463173906.db2.gz QEJVPNZPKBEPOL-UHFFFAOYSA-N 1 1 344.415 2.492 20 5 EEBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000069008891 463198769 /nfs/dbraw/zinc/19/87/69/463198769.db2.gz VPVLDURHWXHEHU-LBPRGKRZSA-N 1 1 345.403 2.232 20 5 EEBDMO CC[N@H+]1CCC[C@@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000069474489 463254094 /nfs/dbraw/zinc/25/40/94/463254094.db2.gz FZHHNYVZJIQSJF-AWEZNQCLSA-N 1 1 334.420 2.245 20 5 EEBDMO CC[C@@H]1C[C@H](C)C[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000080747822 463352115 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EEBDMO Cn1cc(C[N@H+]2CCC[C@H](CO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000269340233 463958623 /nfs/dbraw/zinc/95/86/23/463958623.db2.gz FUVDFGOOGPELEO-ZDUSSCGKSA-N 1 1 330.388 2.200 20 5 EEBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCCN(c3nccs3)CC2)c1 ZINC000269684633 464057314 /nfs/dbraw/zinc/05/73/14/464057314.db2.gz ZHLGXTGWGMWICB-OAHLLOKOSA-N 1 1 348.428 2.297 20 5 EEBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cc(C[NH+]2CCCC2)on1 ZINC000292369724 464210322 /nfs/dbraw/zinc/21/03/22/464210322.db2.gz PITRQIDNDFLVPO-UHFFFAOYSA-N 1 1 344.371 2.151 20 5 EEBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000270275935 464242577 /nfs/dbraw/zinc/24/25/77/464242577.db2.gz SMKPQBKQVXNLMR-SJORKVTESA-N 1 1 342.399 2.362 20 5 EEBDMO CCc1ccc(C(=O)NC[C@@H]2C[N@@H+](CC(C)C)CCO2)cc1[N+](=O)[O-] ZINC000174026358 464352179 /nfs/dbraw/zinc/35/21/79/464352179.db2.gz NGTDVVNKHFSYGL-MRXNPFEDSA-N 1 1 349.431 2.244 20 5 EEBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCCO1 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LSJSSMJOFXJFLJ-UHFFFAOYSA-N 1 1 330.344 2.382 20 5 EEBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)NCc2cccc([N+](=O)[O-])c2)C1 ZINC000245921187 464527410 /nfs/dbraw/zinc/52/74/10/464527410.db2.gz GZJBTFZASCCWHC-HOCLYGCPSA-N 1 1 332.404 2.221 20 5 EEBDMO CCC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000272296688 464553043 /nfs/dbraw/zinc/55/30/43/464553043.db2.gz KPFNVSFKCOYKTK-UHFFFAOYSA-N 1 1 343.330 2.364 20 5 EEBDMO C[N@H+]1CCC[C@@H]1CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000294953878 464661165 /nfs/dbraw/zinc/66/11/65/464661165.db2.gz OEIHJODCLMMZAZ-SNVBAGLBSA-N 1 1 331.294 2.438 20 5 EEBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)c1 ZINC000285757361 464684756 /nfs/dbraw/zinc/68/47/56/464684756.db2.gz ZDXOWPGTLSGXPA-ZIAGYGMSSA-N 1 1 348.321 2.408 20 5 EEBDMO COc1cc(C[N@H+](C)[C@H](C)CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000182657749 464703385 /nfs/dbraw/zinc/70/33/85/464703385.db2.gz JUOKTKFZZNWTFV-SECBINFHSA-N 1 1 334.319 2.060 20 5 EEBDMO COc1cc(C[N@@H+](C)[C@H](C)CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000182657749 464703388 /nfs/dbraw/zinc/70/33/88/464703388.db2.gz JUOKTKFZZNWTFV-SECBINFHSA-N 1 1 334.319 2.060 20 5 EEBDMO CCOCCCNC(=O)[C@@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282383860 464797514 /nfs/dbraw/zinc/79/75/14/464797514.db2.gz GCVJTLUKLZWIPV-CQSZACIVSA-N 1 1 337.420 2.000 20 5 EEBDMO C[C@H]1CN(c2ccccc2F)CC[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000191623011 464823513 /nfs/dbraw/zinc/82/35/13/464823513.db2.gz UKYPEKJJBOBNQK-ZDUSSCGKSA-N 1 1 333.367 2.141 20 5 EEBDMO C[C@H]1CN(c2ccccc2F)CC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000191623011 464823517 /nfs/dbraw/zinc/82/35/17/464823517.db2.gz UKYPEKJJBOBNQK-ZDUSSCGKSA-N 1 1 333.367 2.141 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000276258339 464867227 /nfs/dbraw/zinc/86/72/27/464867227.db2.gz ARUFRDFXKZWKKZ-NEPJUHHUSA-N 1 1 327.812 2.135 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000266915597 464870477 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349.412 2.283 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000330605581 465728805 /nfs/dbraw/zinc/72/88/05/465728805.db2.gz ZHPFEKWSRRETTF-KGLIPLIRSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](C)N(C)C[C@@H]1C ZINC000330605581 465728810 /nfs/dbraw/zinc/72/88/10/465728810.db2.gz ZHPFEKWSRRETTF-KGLIPLIRSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)N(C)C[C@@H]1C ZINC000330605581 465728814 /nfs/dbraw/zinc/72/88/14/465728814.db2.gz ZHPFEKWSRRETTF-KGLIPLIRSA-N 1 1 334.420 2.256 20 5 EEBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccnc(N)c2[N+](=O)[O-])C1 ZINC000548712980 468457835 /nfs/dbraw/zinc/45/78/35/468457835.db2.gz IAUHMWDTWIBNLU-GFCCVEGCSA-N 1 1 349.435 2.202 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N2CC[N@H+]([C@H]3C[C@@H]3C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000346170540 465958380 /nfs/dbraw/zinc/95/83/80/465958380.db2.gz AOILASFMYSFRSW-AVGNSLFASA-N 1 1 349.435 2.244 20 5 EEBDMO 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CC(C)NC(=O)c1ccc(N(C)C[C@@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC000420633543 467438432 /nfs/dbraw/zinc/43/84/32/467438432.db2.gz JLDSBDLJUJXUOO-AWEZNQCLSA-N 1 1 334.420 2.263 20 5 EEBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1 ZINC000452973707 467449550 /nfs/dbraw/zinc/44/95/50/467449550.db2.gz KLRURWQPCHIQLF-HLLBOEOZSA-N 1 1 331.416 2.326 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000408074935 467505362 /nfs/dbraw/zinc/50/53/62/467505362.db2.gz XXGOAXYLXQOAQJ-WDEREUQCSA-N 1 1 344.371 2.013 20 5 EEBDMO CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000449910780 467742717 /nfs/dbraw/zinc/74/27/17/467742717.db2.gz HYGLMJASTFBFMT-INIZCTEOSA-N 1 1 347.415 2.356 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000449910780 467742721 /nfs/dbraw/zinc/74/27/21/467742721.db2.gz HYGLMJASTFBFMT-INIZCTEOSA-N 1 1 347.415 2.356 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000450220432 467802064 /nfs/dbraw/zinc/80/20/64/467802064.db2.gz ZBJDZBGYTLEADP-MRXNPFEDSA-N 1 1 348.447 2.323 20 5 EEBDMO C[C@H]1CN(C(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000458476975 467842208 /nfs/dbraw/zinc/84/22/08/467842208.db2.gz OMXOALGTCOBQQA-CQSZACIVSA-N 1 1 346.431 2.263 20 5 EEBDMO CC(C)[N@H+]1CCCC[C@H]1CN1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000459516477 467960727 /nfs/dbraw/zinc/96/07/27/467960727.db2.gz VJTHLOOCHJJBAR-INIZCTEOSA-N 1 1 347.463 2.375 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000530716696 468004522 /nfs/dbraw/zinc/00/45/22/468004522.db2.gz WTPVKYGWFZQKLC-NEPJUHHUSA-N 1 1 347.371 2.022 20 5 EEBDMO C[C@@H](C(=O)NCCCC[N@H+]1CCC[C@@H]1CO)c1cccc([N+](=O)[O-])c1 ZINC000519517409 468164110 /nfs/dbraw/zinc/16/41/10/468164110.db2.gz DFIFTXXKEQEMPY-RHSMWYFYSA-N 1 1 349.431 2.051 20 5 EEBDMO CO[C@@H]1COC[C@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000567853763 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OVTKGOTTWGOOMK-OAHLLOKOSA-N 1 1 343.383 2.493 20 5 EEBDMO Cc1[nH+]ccn1CCOC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000785678097 806539809 /nfs/dbraw/zinc/53/98/09/806539809.db2.gz QDMBVOZWWMXXTB-UHFFFAOYSA-N 1 1 341.327 2.142 20 5 EEBDMO O=C1NCC[C@@]12CCC[N@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172907712 797133106 /nfs/dbraw/zinc/13/31/06/797133106.db2.gz LMVCTBIRMGGHEI-VQIMIIECSA-N 1 1 343.427 2.444 20 5 EEBDMO CCN(CC)CCNC(=[NH2+])N[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909657 797167965 /nfs/dbraw/zinc/16/79/65/797167965.db2.gz UUQIHPBWYULTTE-INIZCTEOSA-N 1 1 347.463 2.298 20 5 EEBDMO C[N@@H+](CCN1CCOCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909575 797168217 /nfs/dbraw/zinc/16/82/17/797168217.db2.gz SRSPTKURBNKEON-KRWDZBQOSA-N 1 1 333.432 2.106 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N1CCCN(c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC001095188104 797498696 /nfs/dbraw/zinc/49/86/96/797498696.db2.gz KEOMHXQWOBWKJN-UHFFFAOYSA-N 1 1 348.447 2.284 20 5 EEBDMO 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ZINC000423387987 466735738 /nfs/dbraw/zinc/73/57/38/466735738.db2.gz MJSYXCGRPBDRKE-FZMZJTMJSA-N 1 1 346.353 2.082 20 5 EEBDMO Cn1cc[nH+]c1C[C@H]1CCCN(c2ccc([N+](=O)[O-])c3nonc32)C1 ZINC000370643295 466950967 /nfs/dbraw/zinc/95/09/67/466950967.db2.gz IRWJVIMJVMIEKG-LLVKDONJSA-N 1 1 342.359 2.324 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@](CO)(Cc2ccccc2)C1 ZINC000365836220 466958098 /nfs/dbraw/zinc/95/80/98/466958098.db2.gz HXEOIGKLSRAHBE-SFHVURJKSA-N 1 1 344.415 2.146 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@](CO)(Cc2ccccc2)C1 ZINC000365836220 466958100 /nfs/dbraw/zinc/95/81/00/466958100.db2.gz HXEOIGKLSRAHBE-SFHVURJKSA-N 1 1 344.415 2.146 20 5 EEBDMO NC(=O)C[C@@H]1CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000377608633 467095511 /nfs/dbraw/zinc/09/55/11/467095511.db2.gz SXCATMLMTCDCFO-JTQLQIEISA-N 1 1 342.193 2.055 20 5 EEBDMO NC(=O)C[C@@H]1CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000377608633 467095514 /nfs/dbraw/zinc/09/55/14/467095514.db2.gz 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328.307 2.204 20 5 EEBDMO O=C(C[NH+]1CCC(CCO)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000730261307 577013216 /nfs/dbraw/zinc/01/32/16/577013216.db2.gz XRJINMHHPZMNAL-UHFFFAOYSA-N 1 1 341.795 2.281 20 5 EEBDMO COC1(C)CC[NH+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000774642410 577408348 /nfs/dbraw/zinc/40/83/48/577408348.db2.gz AFEQZIJYMBESBA-UHFFFAOYSA-N 1 1 331.376 2.312 20 5 EEBDMO C[C@@H](O)C[C@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000752814258 577776634 /nfs/dbraw/zinc/77/66/34/577776634.db2.gz ZHCJRKZGPKRJHK-TZMCWYRMSA-N 1 1 331.376 2.046 20 5 EEBDMO C[C@@H](O)C[C@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000752814258 577776635 /nfs/dbraw/zinc/77/66/35/577776635.db2.gz ZHCJRKZGPKRJHK-TZMCWYRMSA-N 1 1 331.376 2.046 20 5 EEBDMO CC[C@H]1C[C@@H](C)C[N@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000744439638 577897861 /nfs/dbraw/zinc/89/78/61/577897861.db2.gz BGDKBGORUQHQSH-OLZOCXBDSA-N 1 1 346.387 2.441 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC[N@H+]1C ZINC000741723718 578123085 /nfs/dbraw/zinc/12/30/85/578123085.db2.gz ZAMIVCCFCIPNAM-KBPBESRZSA-N 1 1 346.431 2.408 20 5 EEBDMO CC(C)[C@@H](CNc1nc2ccccn2c1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000143054917 685423526 /nfs/dbraw/zinc/42/35/26/685423526.db2.gz XQFLSFFAAUUYHM-CYBMUJFWSA-N 1 1 333.392 2.011 20 5 EEBDMO O=C(N[C@H]1C[C@H](C[NH2+]Cc2sccc2Cl)C1)[C@@H]1CC1[N+](=O)[O-] ZINC000983652462 683058550 /nfs/dbraw/zinc/05/85/50/683058550.db2.gz CVXAJDZTMNPIJN-DNRKLUKYSA-N 1 1 343.836 2.051 20 5 EEBDMO CC(C)c1ccc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)cc1[N+](=O)[O-] ZINC000896542067 685037936 /nfs/dbraw/zinc/03/79/36/685037936.db2.gz BEOJDQVNHDQZKU-GUYCJALGSA-N 1 1 348.447 2.082 20 5 EEBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)C(F)F)CC1 ZINC000985193306 686070088 /nfs/dbraw/zinc/07/00/88/686070088.db2.gz VSQHFJFFTBDBHE-UHFFFAOYSA-N 1 1 327.331 2.283 20 5 EEBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CCN(C(=O)c2ccon2)CC1 ZINC000985279574 686212909 /nfs/dbraw/zinc/21/29/09/686212909.db2.gz AKWHWXSEDTUXHO-UHFFFAOYSA-N 1 1 344.371 2.319 20 5 EEBDMO O=C1[C@H]([NH2+]CC[N+](=O)[O-])CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000905202829 694567589 /nfs/dbraw/zinc/56/75/89/694567589.db2.gz NLRADIDAJGQDFL-CYBMUJFWSA-N 1 1 345.321 2.063 20 5 EEBDMO C[N@@H+](Cc1ccccc1)C1CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000794753683 1197921371 /nfs/dbraw/zinc/92/13/71/1197921371.db2.gz WXSUYIQDXJQAGD-LJQANCHMSA-N 1 1 341.411 2.444 20 5 EEBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)NCC[N@H+](C)C(C)C ZINC000125478326 1199291768 /nfs/dbraw/zinc/29/17/68/1199291768.db2.gz COPHSDQISZEZHU-UHFFFAOYSA-N 1 1 349.840 2.175 20 5 EEBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000810843461 1199775813 /nfs/dbraw/zinc/77/58/13/1199775813.db2.gz FWGRLBDONSDWES-YPMHNXCESA-N 1 1 348.355 2.150 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+][C@H](c3ccc(O)cc3)C2)c1 ZINC000870082683 1200450969 /nfs/dbraw/zinc/45/09/69/1200450969.db2.gz CSBDTQFUSUCVQI-INIZCTEOSA-N 1 1 341.367 2.396 20 5 EEBDMO C[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)CC1 ZINC000870127095 1200489683 /nfs/dbraw/zinc/48/96/83/1200489683.db2.gz GNBZTEUJJOZEHW-CQSZACIVSA-N 1 1 342.399 2.452 20 5 EEBDMO CCC(=O)c1ccc(N2CC[NH+](C[C@H]3CCOC3)CC2)c([N+](=O)[O-])c1 ZINC000795105123 1200563367 /nfs/dbraw/zinc/56/33/67/1200563367.db2.gz CSDMGFCPOPFVOC-CQSZACIVSA-N 1 1 347.415 2.346 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CCCNc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC000812342965 1200670864 /nfs/dbraw/zinc/67/08/64/1200670864.db2.gz OCQIMTWBAZNWOR-CABCVRRESA-N 1 1 346.431 2.197 20 5 EEBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CCCOC1 ZINC000813174303 1201142782 /nfs/dbraw/zinc/14/27/82/1201142782.db2.gz WPRAYINANLQOQL-ZBFHGGJFSA-N 1 1 334.372 2.139 20 5 EEBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CCCOC1 ZINC000813174303 1201142787 /nfs/dbraw/zinc/14/27/87/1201142787.db2.gz WPRAYINANLQOQL-ZBFHGGJFSA-N 1 1 334.372 2.139 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](CF)C1 ZINC000880297648 1201450075 /nfs/dbraw/zinc/45/00/75/1201450075.db2.gz OVEIGUBZBYBSSG-NSHDSACASA-N 1 1 325.340 2.223 20 5 EEBDMO Cc1nn(C[N@H+]2CCC[C@@H](CCC(N)=O)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121162525 1201577679 /nfs/dbraw/zinc/57/76/79/1201577679.db2.gz BFJCOPJNJYRDJE-ZDUSSCGKSA-N 1 1 345.403 2.188 20 5 EEBDMO CN(CCC1CCOCC1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867951089 1201713059 /nfs/dbraw/zinc/71/30/59/1201713059.db2.gz CKFVXDMFSACSGL-KRWDZBQOSA-N 1 1 335.404 2.044 20 5 EEBDMO COCC[N@@H+]1[C@H](C)CN(Cc2c(F)cccc2[N+](=O)[O-])C[C@@H]1C ZINC000129656731 1201870785 /nfs/dbraw/zinc/87/07/85/1201870785.db2.gz QNTVLMLXTGVDRW-BETUJISGSA-N 1 1 325.384 2.275 20 5 EEBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000886595394 1202529629 /nfs/dbraw/zinc/52/96/29/1202529629.db2.gz IOWDYVRUCOIXKK-GFCCVEGCSA-N 1 1 337.424 2.244 20 5 EEBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000886595394 1202529630 /nfs/dbraw/zinc/52/96/30/1202529630.db2.gz IOWDYVRUCOIXKK-GFCCVEGCSA-N 1 1 337.424 2.244 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000929269862 1206461280 /nfs/dbraw/zinc/46/12/80/1206461280.db2.gz LZHXLGRRMJUDAL-QGZVFWFLSA-N 1 1 346.431 2.116 20 5 EEBDMO CNC(=O)[C@@H](C)C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Br ZINC000929776863 1206500666 /nfs/dbraw/zinc/50/06/66/1206500666.db2.gz ZGMBYRDLAKHRFJ-VIFPVBQESA-N 1 1 344.209 2.171 20 5 EEBDMO CNC(=O)[C@@H](C)C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Br ZINC000929776863 1206500668 /nfs/dbraw/zinc/50/06/68/1206500668.db2.gz ZGMBYRDLAKHRFJ-VIFPVBQESA-N 1 1 344.209 2.171 20 5 EEBDMO CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](C/C=C/c2ccccc2)CC1 ZINC001045436160 1233744314 /nfs/dbraw/zinc/74/43/14/1233744314.db2.gz KRSKPIPOVUAUOF-QQQVMXRDSA-N 1 1 343.427 2.336 20 5 EEBDMO Cc1cccc(C)c1C[NH+]1CCC(C)(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001045436123 1233744380 /nfs/dbraw/zinc/74/43/80/1233744380.db2.gz IRMSGQXVNXRBEK-NVXWUHKLSA-N 1 1 345.443 2.439 20 5 EEBDMO O=C(NCC1=CC[N@@H+](C/C=C\c2ccccc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001000669197 1240697123 /nfs/dbraw/zinc/69/71/23/1240697123.db2.gz GVVMIWBHMJWLMY-SJJKRXNQSA-N 1 1 341.411 2.113 20 5 EEBDMO O=C(NCC1=CC[N@H+](C/C=C\c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000669197 1240697128 /nfs/dbraw/zinc/69/71/28/1240697128.db2.gz GVVMIWBHMJWLMY-SJJKRXNQSA-N 1 1 341.411 2.113 20 5 EEBDMO O=C(NCC1=CC[N@@H+](C/C=C\c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000669197 1240697135 /nfs/dbraw/zinc/69/71/35/1240697135.db2.gz GVVMIWBHMJWLMY-SJJKRXNQSA-N 1 1 341.411 2.113 20 5 EEBDMO Cc1cc(N(CCNC(=O)C[N@H+](C)C(C)C)C2CC2)ccc1[N+](=O)[O-] ZINC001101352522 1245701999 /nfs/dbraw/zinc/70/19/99/1245701999.db2.gz FOXPIRHSSNYZQH-UHFFFAOYSA-N 1 1 348.447 2.328 20 5 EEBDMO O=[N+]([O-])c1ccc2c(ccnc2NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)c1 ZINC000827495943 1248225327 /nfs/dbraw/zinc/22/53/27/1248225327.db2.gz ATLMGARCBPZIBC-CABCVRRESA-N 1 1 328.372 2.418 20 5 EEBDMO Cc1cc(C(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c(N)c([N+](=O)[O-])c1 ZINC000104148271 1284917354 /nfs/dbraw/zinc/91/73/54/1284917354.db2.gz NQRUGDVJMUWEGQ-AAEUAGOBSA-N 1 1 334.420 2.336 20 5 EEBDMO COc1cc(N2CCN([C@@H]3CCC[N@@H+](C)C3)CC2)c([N+](=O)[O-])cc1C ZINC000853340789 1292358578 /nfs/dbraw/zinc/35/85/78/1292358578.db2.gz IWCKTPHBNYNAHF-OAHLLOKOSA-N 1 1 348.447 2.128 20 5 EEBDMO Cc1noc(COC(=O)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000853926753 1292532757 /nfs/dbraw/zinc/53/27/57/1292532757.db2.gz PQHXVFJTBQCFNI-CQSZACIVSA-N 1 1 345.355 2.457 20 5 EEBDMO Cn1nccc1[C@@H](O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000856800994 1293637905 /nfs/dbraw/zinc/63/79/05/1293637905.db2.gz YDVFMVHAKAYJJM-KRWDZBQOSA-N 1 1 348.378 2.413 20 5 EEBDMO Cc1nc(Nc2cc(F)cc([N+](=O)[O-])c2)cc(N2CCOCC2)[nH+]1 ZINC001216481293 1297187608 /nfs/dbraw/zinc/18/76/08/1297187608.db2.gz KWLALXKLBYRWRU-UHFFFAOYSA-N 1 1 333.323 2.413 20 5 EEBDMO CCCSc1nc(O[C@@H]2CCC[NH2+]C[C@H]2F)c([N+](=O)[O-])c(=O)[nH]1 ZINC001217953033 1297535502 /nfs/dbraw/zinc/53/55/02/1297535502.db2.gz ZDAGRDXKSOFEEN-RKDXNWHRSA-N 1 1 346.384 2.061 20 5 EEBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](OCc3ccccc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001222761315 1299836107 /nfs/dbraw/zinc/83/61/07/1299836107.db2.gz MXWUQJXJAAFTOA-DIECFANBSA-N 1 1 334.372 2.278 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(NCCN(C)C(=O)C[N@@H+](C)C2CCC2)c1 ZINC001102017150 1300146016 /nfs/dbraw/zinc/14/60/16/1300146016.db2.gz HOHLKZMFQXUHLI-UHFFFAOYSA-N 1 1 334.420 2.258 20 5 EEBDMO C[N@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2Oc1nc(C2CC2)[nH]c(=O)c1[N+](=O)[O-] ZINC001228610417 1302335475 /nfs/dbraw/zinc/33/54/75/1302335475.db2.gz VHFUCKBANUQCDH-PTEHBNRSSA-N 1 1 334.376 2.077 20 5 EEBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2Oc1nc(C2CC2)[nH]c(=O)c1[N+](=O)[O-] ZINC001228610417 1302335485 /nfs/dbraw/zinc/33/54/85/1302335485.db2.gz VHFUCKBANUQCDH-PTEHBNRSSA-N 1 1 334.376 2.077 20 5 EEBDMO COc1ccc(C[C@H](C)[N@@H+]2CC[C@](N)(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001246565195 1310345132 /nfs/dbraw/zinc/34/51/32/1310345132.db2.gz BVYYWSZTGLHKLW-IINYFYTJSA-N 1 1 347.337 2.500 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@](N)(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001246565195 1310345133 /nfs/dbraw/zinc/34/51/33/1310345133.db2.gz BVYYWSZTGLHKLW-IINYFYTJSA-N 1 1 347.337 2.500 20 5 EEBDMO CC[C@H]1C[N@H+](CC)CCN1C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000836949480 1315044688 /nfs/dbraw/zinc/04/46/88/1315044688.db2.gz ZLMPAJILVRZVCL-JTQLQIEISA-N 1 1 327.331 2.429 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000836949480 1315044691 /nfs/dbraw/zinc/04/46/91/1315044691.db2.gz ZLMPAJILVRZVCL-JTQLQIEISA-N 1 1 327.331 2.429 20 5 EEBDMO C[N@H+](Cc1ncccn1)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254475671 1318082925 /nfs/dbraw/zinc/08/29/25/1318082925.db2.gz FRGRJTGSLBFPMI-UHFFFAOYSA-N 1 1 327.388 2.486 20 5 EEBDMO 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O=C1CCCN1C[C@@H]1CCCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000362136758 466580710 /nfs/dbraw/zinc/58/07/10/466580710.db2.gz MSOSEJZDYDKQMA-IRXDYDNUSA-N 1 1 347.415 2.105 20 5 EEBDMO C[N@H+]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)[C@@H](c2ccccc2)C1 ZINC000372854045 466615912 /nfs/dbraw/zinc/61/59/12/466615912.db2.gz BLJIXPAFTAXYCM-HUUCEWRRSA-N 1 1 340.383 2.005 20 5 EEBDMO C[N@H+]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)[C@@H](c2ccccc2)C1 ZINC000372854039 466616465 /nfs/dbraw/zinc/61/64/65/466616465.db2.gz BLJIXPAFTAXYCM-CABCVRRESA-N 1 1 340.383 2.005 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000363938024 466661631 /nfs/dbraw/zinc/66/16/31/466661631.db2.gz NCHGCHPTDKWVNS-STQMWFEESA-N 1 1 348.359 2.168 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000410636736 466720706 /nfs/dbraw/zinc/72/07/06/466720706.db2.gz NGATVSHBOLVQEB-WDEREUQCSA-N 1 1 339.367 2.297 20 5 EEBDMO C[C@H]1CC[C@@H]([N@@H+](CCO)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000411654487 466867474 /nfs/dbraw/zinc/86/74/74/466867474.db2.gz XVWHFNFJCGFRCH-XJKSGUPXSA-N 1 1 335.404 2.406 20 5 EEBDMO COc1cc(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)cc([N+](=O)[O-])c1C ZINC000377024461 467001511 /nfs/dbraw/zinc/00/15/11/467001511.db2.gz ZKWOEYIMXRNGIC-AWEZNQCLSA-N 1 1 333.388 2.222 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC2(C[C@H]1C)CC[NH2+]CC2 ZINC000424285534 467022565 /nfs/dbraw/zinc/02/25/65/467022565.db2.gz FRSSMNDLINVIRZ-CQSZACIVSA-N 1 1 346.431 2.306 20 5 EEBDMO C[C@@H](CNc1nccc2ccc([N+](=O)[O-])cc21)[NH+]1CCN(C)CC1 ZINC000413110190 467171679 /nfs/dbraw/zinc/17/16/79/467171679.db2.gz HGVGVEASWIXZHN-ZDUSSCGKSA-N 1 1 329.404 2.191 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c([N+](=O)[O-])c1 ZINC000378397483 467290139 /nfs/dbraw/zinc/29/01/39/467290139.db2.gz OZFOBBJYVPALAY-UONOGXRCSA-N 1 1 347.415 2.332 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@H]1CC[N@H+](C(C)C)C1 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OAFVBGXXYMWVKB-BETUJISGSA-N 1 1 328.372 2.418 20 5 EEBDMO CN(C(=O)/C=C/c1cccc([N+](=O)[O-])c1)C(C)(C)C[NH+]1CCOCC1 ZINC000493778046 467981157 /nfs/dbraw/zinc/98/11/57/467981157.db2.gz BKBMDWHLZUQGTQ-BQYQJAHWSA-N 1 1 347.415 2.177 20 5 EEBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486925053 468013264 /nfs/dbraw/zinc/01/32/64/468013264.db2.gz FEWIKJZYSNKGFY-GFCCVEGCSA-N 1 1 331.376 2.423 20 5 EEBDMO CNC(=O)c1ccc(N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000488753700 468102084 /nfs/dbraw/zinc/10/20/84/468102084.db2.gz NDNVWQJDFRWZQK-WOSRLPQWSA-N 1 1 346.431 2.121 20 5 EEBDMO O=C(NC1CC1)c1ccc(N[C@@H]2CCn3cc[nH+]c3C2)c([N+](=O)[O-])c1 ZINC000489921611 468177563 /nfs/dbraw/zinc/17/75/63/468177563.db2.gz KCXKHUKXGBOWCY-CYBMUJFWSA-N 1 1 341.371 2.110 20 5 EEBDMO Cc1cc(OCC(=O)NC[C@H]2CCCC[N@H+](C)C2)ccc1[N+](=O)[O-] ZINC000600315298 468530438 /nfs/dbraw/zinc/53/04/38/468530438.db2.gz RLDYTBDVBAGWQL-CQSZACIVSA-N 1 1 335.404 2.130 20 5 EEBDMO O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594420428 468579295 /nfs/dbraw/zinc/57/92/95/468579295.db2.gz TUYFNDSAPFPLDG-LSDHHAIUSA-N 1 1 332.404 2.140 20 5 EEBDMO O=[N+]([O-])c1ccccc1N1CCN(CCCC2CC[NH2+]CC2)CC1 ZINC000592475602 468705493 /nfs/dbraw/zinc/70/54/93/468705493.db2.gz PUHZCNTYCSGDCA-UHFFFAOYSA-N 1 1 332.448 2.497 20 5 EEBDMO O=C1CCCN1[C@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601151803 468762533 /nfs/dbraw/zinc/76/25/33/468762533.db2.gz FHRJPMUNUOJZKV-ZDUSSCGKSA-N 1 1 326.356 2.344 20 5 EEBDMO COCCn1cc(CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)cn1 ZINC000601162767 468766166 /nfs/dbraw/zinc/76/61/66/468766166.db2.gz WUKPHYMFFOSXCC-UHFFFAOYSA-N 1 1 327.344 2.020 20 5 EEBDMO Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1cc(C)ccc1[N+](=O)[O-])C2 ZINC000601184707 468774476 /nfs/dbraw/zinc/77/44/76/468774476.db2.gz MHSFMGRVSPMWLS-ZDUSSCGKSA-N 1 1 330.388 2.370 20 5 EEBDMO Cc1cncc(CC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000593001087 468836304 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333.388 2.094 20 5 EEBDMO NC(=O)C[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602662066 468996234 /nfs/dbraw/zinc/99/62/34/468996234.db2.gz CRJGDICSMHYXES-VIFPVBQESA-N 1 1 331.294 2.311 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000593494040 469005062 /nfs/dbraw/zinc/00/50/62/469005062.db2.gz XPRNVJVBBOYDHN-ZDUSSCGKSA-N 1 1 337.395 2.467 20 5 EEBDMO CCN1C[C@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CC1=O ZINC000602684666 469010165 /nfs/dbraw/zinc/01/01/65/469010165.db2.gz IJPCEIOEKMWTFH-SSDOTTSWSA-N 1 1 348.222 2.129 20 5 EEBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)CC1=CCSC1 ZINC000595888470 469064841 /nfs/dbraw/zinc/06/48/41/469064841.db2.gz MXCKECPSQLOPID-UHFFFAOYSA-N 1 1 349.412 2.498 20 5 EEBDMO CC[C@@H](O)C[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])Cc1ccccc1 ZINC000602795201 469080251 /nfs/dbraw/zinc/08/02/51/469080251.db2.gz GFSBMJQSFLSWJT-MRXNPFEDSA-N 1 1 332.404 2.373 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCO[C@@H](Cc2ccccc2)C1 ZINC000602803145 469085758 /nfs/dbraw/zinc/08/57/58/469085758.db2.gz XHKNZCNHQZPYIP-INIZCTEOSA-N 1 1 330.388 2.043 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCO[C@@H](Cc2ccccc2)C1 ZINC000602803145 469085765 /nfs/dbraw/zinc/08/57/65/469085765.db2.gz XHKNZCNHQZPYIP-INIZCTEOSA-N 1 1 330.388 2.043 20 5 EEBDMO O=c1[nH]ccc(NC[C@H]2C[N@H+](Cc3ccccc3)CCO2)c1[N+](=O)[O-] ZINC000596053420 469130028 /nfs/dbraw/zinc/13/00/28/469130028.db2.gz DOGNVOGDZURTNF-AWEZNQCLSA-N 1 1 344.371 2.008 20 5 EEBDMO O=c1[nH]ccc(NC[C@H]2C[N@@H+](Cc3ccccc3)CCO2)c1[N+](=O)[O-] ZINC000596053420 469130034 /nfs/dbraw/zinc/13/00/34/469130034.db2.gz DOGNVOGDZURTNF-AWEZNQCLSA-N 1 1 344.371 2.008 20 5 EEBDMO COCCC1CC[NH+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000599506563 469279543 /nfs/dbraw/zinc/27/95/43/469279543.db2.gz MJNKLRWHZRIEJR-QGZVFWFLSA-N 1 1 347.415 2.449 20 5 EEBDMO CNC(=O)c1ccc(NC[C@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000596571298 469304068 /nfs/dbraw/zinc/30/40/68/469304068.db2.gz SZWKIVWHFYEACC-CQSZACIVSA-N 1 1 346.431 2.488 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](n2ccnc2)C1 ZINC000609157350 469897544 /nfs/dbraw/zinc/89/75/44/469897544.db2.gz FKXHEQJSARYTCO-CJNGLKHVSA-N 1 1 343.387 2.455 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](n2ccnc2)C1 ZINC000609157350 469897548 /nfs/dbraw/zinc/89/75/48/469897548.db2.gz FKXHEQJSARYTCO-CJNGLKHVSA-N 1 1 343.387 2.455 20 5 EEBDMO CCCc1n[nH]c(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000609476840 469931111 /nfs/dbraw/zinc/93/11/11/469931111.db2.gz GNUKZZRBRTYGRE-UHFFFAOYSA-N 1 1 337.424 2.217 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CCC[N@@H+](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000609476840 469931113 /nfs/dbraw/zinc/93/11/13/469931113.db2.gz GNUKZZRBRTYGRE-UHFFFAOYSA-N 1 1 337.424 2.217 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000609476840 469931118 /nfs/dbraw/zinc/93/11/18/469931118.db2.gz GNUKZZRBRTYGRE-UHFFFAOYSA-N 1 1 337.424 2.217 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H](CCO)C3)n2)cc1 ZINC000609848954 469965839 /nfs/dbraw/zinc/96/58/39/469965839.db2.gz SEHSZQGEGBHDDL-GFCCVEGCSA-N 1 1 332.360 2.239 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H](CCO)C3)n2)cc1 ZINC000609848954 469965844 /nfs/dbraw/zinc/96/58/44/469965844.db2.gz SEHSZQGEGBHDDL-GFCCVEGCSA-N 1 1 332.360 2.239 20 5 EEBDMO O=C1CN(C[N@H+]2CCC[C@@H]2C2CC2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000728559379 576506868 /nfs/dbraw/zinc/50/68/68/576506868.db2.gz FXPPAUXCYJPHDE-OAHLLOKOSA-N 1 1 344.371 2.195 20 5 EEBDMO CC(C)[C@H](C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1)[NH+]1CCCC1 ZINC000741015204 577015091 /nfs/dbraw/zinc/01/50/91/577015091.db2.gz YVLZUXOJFNYHFK-MRXNPFEDSA-N 1 1 334.372 2.441 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000731809290 577125746 /nfs/dbraw/zinc/12/57/46/577125746.db2.gz SSSMYIYRIQUUJI-QWHCGFSZSA-N 1 1 348.359 2.168 20 5 EEBDMO COc1cc(C[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)ccc1O ZINC000776582186 577463287 /nfs/dbraw/zinc/46/32/87/577463287.db2.gz LOUGNOPPQMKMSV-MRXNPFEDSA-N 1 1 332.356 2.474 20 5 EEBDMO CC[N@@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@H]1C ZINC000765930204 577509172 /nfs/dbraw/zinc/50/91/72/577509172.db2.gz PDWVZRNPZCRNTL-MNOVXSKESA-N 1 1 336.348 2.058 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@H]1C ZINC000765930204 577509173 /nfs/dbraw/zinc/50/91/73/577509173.db2.gz PDWVZRNPZCRNTL-MNOVXSKESA-N 1 1 336.348 2.058 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1Cn1nccc1[N+](=O)[O-] ZINC000766378521 577518178 /nfs/dbraw/zinc/51/81/78/577518178.db2.gz XJKPWFBHYRHNQI-LSDHHAIUSA-N 1 1 329.404 2.344 20 5 EEBDMO CCOCC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000760534069 577664991 /nfs/dbraw/zinc/66/49/91/577664991.db2.gz UZLPHWFLOAYPAK-UHFFFAOYSA-N 1 1 345.346 2.355 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]CCC1(C)OCCO1)c1cccc([N+](=O)[O-])c1 ZINC000761227309 577679772 /nfs/dbraw/zinc/67/97/72/577679772.db2.gz ZSZHWKDPAZWUPF-OAHLLOKOSA-N 1 1 346.387 2.160 20 5 EEBDMO C[C@H]1CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000751069630 577747797 /nfs/dbraw/zinc/74/77/97/577747797.db2.gz QTVCKRCHFSKPBZ-VIFPVBQESA-N 1 1 342.193 2.133 20 5 EEBDMO C[C@H]1CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000751069630 577747798 /nfs/dbraw/zinc/74/77/98/577747798.db2.gz QTVCKRCHFSKPBZ-VIFPVBQESA-N 1 1 342.193 2.133 20 5 EEBDMO COC(=O)C[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000754526944 577807942 /nfs/dbraw/zinc/80/79/42/577807942.db2.gz SHFCNCRWJDTENP-ZDUSSCGKSA-N 1 1 346.343 2.076 20 5 EEBDMO Cc1cccc(NCCNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])[nH+]1 ZINC000737398979 578255050 /nfs/dbraw/zinc/25/50/50/578255050.db2.gz GTNVNTQRQMOJCT-UHFFFAOYSA-N 1 1 340.347 2.002 20 5 EEBDMO C[C@@H](CNC(=O)NC[C@@H](C)[N@@H+](C)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000892820664 683102119 /nfs/dbraw/zinc/10/21/19/683102119.db2.gz REHLMJQLHZDMCU-QWHCGFSZSA-N 1 1 334.420 2.480 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C[C@@H]1C ZINC000893050712 683642532 /nfs/dbraw/zinc/64/25/32/683642532.db2.gz MSSCTRXCSCLUPK-QWHCGFSZSA-N 1 1 344.415 2.366 20 5 EEBDMO CC1(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccc([N+](=O)[O-])cc4)C[C@H]32)CCC1 ZINC001025946895 683671050 /nfs/dbraw/zinc/67/10/50/683671050.db2.gz XCUMIABVNBQOFM-ZSHCYNCHSA-N 1 1 329.400 2.331 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC000909437629 683738359 /nfs/dbraw/zinc/73/83/59/683738359.db2.gz CENBUIBILSUOOT-NSHDSACASA-N 1 1 340.811 2.385 20 5 EEBDMO CC1(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4[N+](=O)[O-])C[C@H]32)CC=CC1 ZINC001026010544 683744144 /nfs/dbraw/zinc/74/41/44/683744144.db2.gz MTMFBCBQZZIICH-QLPKVWCKSA-N 1 1 341.411 2.498 20 5 EEBDMO C[N@@H+]1CC[C@@H]1CNC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000928551850 684104795 /nfs/dbraw/zinc/10/47/95/684104795.db2.gz FMKKFTOZQBWTPZ-ZCFIWIBFSA-N 1 1 336.150 2.475 20 5 EEBDMO C[N@H+]1CC[C@@H]1CNC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000928551850 684104798 /nfs/dbraw/zinc/10/47/98/684104798.db2.gz FMKKFTOZQBWTPZ-ZCFIWIBFSA-N 1 1 336.150 2.475 20 5 EEBDMO C[C@@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000895330356 684505892 /nfs/dbraw/zinc/50/58/92/684505892.db2.gz LKEHNOQEQURIHV-YOEHRIQHSA-N 1 1 332.356 2.172 20 5 EEBDMO C[N@@H+](C[C@@H](O)COc1cccc(C(F)(F)F)c1[N+](=O)[O-])C1CC1 ZINC000899906755 693920122 /nfs/dbraw/zinc/92/01/22/693920122.db2.gz NOPPMXCTDXFKPD-SNVBAGLBSA-N 1 1 334.294 2.448 20 5 EEBDMO C[N@@H+](CC1CC2(CCC2)C1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985433596 686723535 /nfs/dbraw/zinc/72/35/35/686723535.db2.gz MIDBEOROLBBHKP-HZPDHXFCSA-N 1 1 335.448 2.155 20 5 EEBDMO C[N@H+](CC1CC2(CCC2)C1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985433596 686723541 /nfs/dbraw/zinc/72/35/41/686723541.db2.gz MIDBEOROLBBHKP-HZPDHXFCSA-N 1 1 335.448 2.155 20 5 EEBDMO C[N@@H+](CC1CC2(CCC2)C1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985433596 686723545 /nfs/dbraw/zinc/72/35/45/686723545.db2.gz MIDBEOROLBBHKP-HZPDHXFCSA-N 1 1 335.448 2.155 20 5 EEBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000897502357 690755743 /nfs/dbraw/zinc/75/57/43/690755743.db2.gz CUIKQEAVTLBKBE-CQSZACIVSA-N 1 1 334.420 2.263 20 5 EEBDMO C[NH+](C)C1(CNc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])CC1 ZINC000842047187 1188245108 /nfs/dbraw/zinc/24/51/08/1188245108.db2.gz SRKOGRJSZSCIKB-UHFFFAOYSA-N 1 1 349.359 2.097 20 5 EEBDMO C[C@@H]1CC2(CN1C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1)CCOCC2 ZINC000876940006 1199824281 /nfs/dbraw/zinc/82/42/81/1199824281.db2.gz OBSDKCRVRLXPCQ-DYVFJYSZSA-N 1 1 347.415 2.186 20 5 EEBDMO CONC(=O)C1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000877788156 1200106866 /nfs/dbraw/zinc/10/68/66/1200106866.db2.gz SCJJUMCFDQLBLB-UHFFFAOYSA-N 1 1 327.768 2.138 20 5 EEBDMO CC(C)(O)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000877796406 1200113472 /nfs/dbraw/zinc/11/34/72/1200113472.db2.gz FYCKGIQJGHUTRO-CQSZACIVSA-N 1 1 336.388 2.444 20 5 EEBDMO CC(C)(O)[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000877796314 1200114412 /nfs/dbraw/zinc/11/44/12/1200114412.db2.gz COGGIKTXJJVUPO-CYBMUJFWSA-N 1 1 336.388 2.349 20 5 EEBDMO Cc1cc(N2CC[N@@H+](C[C@@H](C)O)C[C@@H]2C)c(Cl)cc1[N+](=O)[O-] ZINC000795141957 1200886257 /nfs/dbraw/zinc/88/62/57/1200886257.db2.gz ZMECDUCTSPIIDH-NWDGAFQWSA-N 1 1 327.812 2.448 20 5 EEBDMO Cc1cc(N2CC[N@H+](C[C@@H](C)O)C[C@@H]2C)c(Cl)cc1[N+](=O)[O-] ZINC000795141957 1200886264 /nfs/dbraw/zinc/88/62/64/1200886264.db2.gz ZMECDUCTSPIIDH-NWDGAFQWSA-N 1 1 327.812 2.448 20 5 EEBDMO O=C(C[N@@H+]1C[C@@H]2CC=CC[C@@H]2C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000879528860 1201126370 /nfs/dbraw/zinc/12/63/70/1201126370.db2.gz DIGWVWBFAFHDNL-GASCZTMLSA-N 1 1 327.384 2.382 20 5 EEBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1C[C@@]12CCOC2 ZINC000813172217 1201141713 /nfs/dbraw/zinc/14/17/13/1201141713.db2.gz CBKYTESZKNLFRE-LZLYRXPVSA-N 1 1 346.383 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COc1ccc(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000886589600 1202528420 /nfs/dbraw/zinc/52/84/20/1202528420.db2.gz ZXTDUCNXXZFGLN-AWEZNQCLSA-N 1 1 335.404 2.406 20 5 EEBDMO COc1ccc(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000886589600 1202528422 /nfs/dbraw/zinc/52/84/22/1202528422.db2.gz ZXTDUCNXXZFGLN-AWEZNQCLSA-N 1 1 335.404 2.406 20 5 EEBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000932297960 1207578040 /nfs/dbraw/zinc/57/80/40/1207578040.db2.gz GOOMSVVGNCMAIE-PVAVHDDUSA-N 1 1 329.400 2.299 20 5 EEBDMO Cc1[nH+]ccn1CCCCOC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000778796350 1208358089 /nfs/dbraw/zinc/35/80/89/1208358089.db2.gz NZIYPNDZSNDSQJ-UHFFFAOYSA-N 1 1 335.364 2.055 20 5 EEBDMO CC[N@@H+]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3N)sc2C1 ZINC000195178905 1211334647 /nfs/dbraw/zinc/33/46/47/1211334647.db2.gz BEGIMWNFXLLXFA-UHFFFAOYSA-N 1 1 347.400 2.264 20 5 EEBDMO CC[N@H+]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3N)sc2C1 ZINC000195178905 1211334650 /nfs/dbraw/zinc/33/46/50/1211334650.db2.gz BEGIMWNFXLLXFA-UHFFFAOYSA-N 1 1 347.400 2.264 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N[C@H]1C[C@H](CNc2ccc([N+](=O)[O-])cc2)C1 ZINC001114780475 1215274219 /nfs/dbraw/zinc/27/42/19/1215274219.db2.gz HAWHKVJLEWEUGG-CTYIDZIISA-N 1 1 334.420 2.243 20 5 EEBDMO CC[N@@H+](CC(=O)N1CCCCCC1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796602268 1221616999 /nfs/dbraw/zinc/61/69/99/1221616999.db2.gz QNYSVAQANXUUIQ-KRWDZBQOSA-N 1 1 349.431 2.353 20 5 EEBDMO CC[N@H+](CC(=O)N1CCCCCC1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796602268 1221617002 /nfs/dbraw/zinc/61/70/02/1221617002.db2.gz QNYSVAQANXUUIQ-KRWDZBQOSA-N 1 1 349.431 2.353 20 5 EEBDMO Cn1cc[nH+]c1N1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000827885104 1248927600 /nfs/dbraw/zinc/92/76/00/1248927600.db2.gz QGNARWLQIGTVRT-UHFFFAOYSA-N 1 1 335.795 2.304 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CC1=CCCCC1 ZINC001039583033 1230702773 /nfs/dbraw/zinc/70/27/73/1230702773.db2.gz ABGJNQFHSINIKU-YYIAUSFCSA-N 1 1 333.432 2.217 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@H+]2CC1=CCCCC1 ZINC001039583033 1230702775 /nfs/dbraw/zinc/70/27/75/1230702775.db2.gz ABGJNQFHSINIKU-YYIAUSFCSA-N 1 1 333.432 2.217 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CC1=CCCCC1 ZINC001039583033 1230702777 /nfs/dbraw/zinc/70/27/77/1230702777.db2.gz ABGJNQFHSINIKU-YYIAUSFCSA-N 1 1 333.432 2.217 20 5 EEBDMO CC(C)N1CC[NH+](CCCC(=O)NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000900401217 1234318294 /nfs/dbraw/zinc/31/82/94/1234318294.db2.gz CQJJTWKECCHXMF-UHFFFAOYSA-N 1 1 348.447 2.017 20 5 EEBDMO O=C(N1C[C@@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@@H]2C1)C1(CF)CC1 ZINC001049048994 1239854402 /nfs/dbraw/zinc/85/44/02/1239854402.db2.gz PUPXRUKPZFBBKW-GASCZTMLSA-N 1 1 347.390 2.235 20 5 EEBDMO O=C(NCC1CC[NH+](CC2CC3(CCC3)C2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001001400323 1242198192 /nfs/dbraw/zinc/19/81/92/1242198192.db2.gz QJFDNAKFOZSTPD-HZPDHXFCSA-N 1 1 335.448 2.060 20 5 EEBDMO C[N@@H+](C[C@H]1CCCOC1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000107670738 1290597788 /nfs/dbraw/zinc/59/77/88/1290597788.db2.gz JOOHKWOBRSKWSJ-CYBMUJFWSA-N 1 1 331.376 2.169 20 5 EEBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3c(C)cccc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001226971243 1301630791 /nfs/dbraw/zinc/63/07/91/1301630791.db2.gz JOILPFNMZWRFES-UGQVUOCMSA-N 1 1 334.372 2.449 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Oc1nc[nH]c(=O)c1[N+](=O)[O-] ZINC001228140599 1302121471 /nfs/dbraw/zinc/12/14/71/1302121471.db2.gz KDRQXCHDTUAWOA-OCCSQVGLSA-N 1 1 344.371 2.380 20 5 EEBDMO Cc1nc(O[C@H](CC[NH+](C)C)c2ccccc2)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229381669 1302754394 /nfs/dbraw/zinc/75/43/94/1302754394.db2.gz OJNJRCGEWOUHHW-CYBMUJFWSA-N 1 1 332.360 2.471 20 5 EEBDMO CC[N@@H+](C)[C@@H]1CCN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC001230367548 1303180632 /nfs/dbraw/zinc/18/06/32/1303180632.db2.gz DWGMHDZOIZOHBP-CYBMUJFWSA-N 1 1 340.811 2.484 20 5 EEBDMO CSCCC(=O)NCCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001233672108 1304553186 /nfs/dbraw/zinc/55/31/86/1304553186.db2.gz ULVRLSMYKBATFN-UHFFFAOYSA-N 1 1 325.434 2.286 20 5 EEBDMO Cc1cc(C(=O)NCCC[N@@H+](C)Cc2csc([N+](=O)[O-])c2)on1 ZINC001233862835 1304619013 /nfs/dbraw/zinc/61/90/13/1304619013.db2.gz ARIRSNXOXCPENC-UHFFFAOYSA-N 1 1 338.389 2.205 20 5 EEBDMO Cc1cc(C(=O)NCCC[N@H+](C)Cc2csc([N+](=O)[O-])c2)on1 ZINC001233862835 1304619023 /nfs/dbraw/zinc/61/90/23/1304619023.db2.gz ARIRSNXOXCPENC-UHFFFAOYSA-N 1 1 338.389 2.205 20 5 EEBDMO CCOc1cc(NCC(C)(C)N2CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC001116452282 1305885207 /nfs/dbraw/zinc/88/52/07/1305885207.db2.gz PMELECHBMUVKCU-UHFFFAOYSA-N 1 1 336.436 2.431 20 5 EEBDMO NC[C@@]1(O)CCCC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001246565745 1310345078 /nfs/dbraw/zinc/34/50/78/1310345078.db2.gz ZNZDEKFOAUVFHQ-AEFFLSMTSA-N 1 1 333.432 2.018 20 5 EEBDMO NC[C@@]1(O)CCCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001246565745 1310345080 /nfs/dbraw/zinc/34/50/80/1310345080.db2.gz ZNZDEKFOAUVFHQ-AEFFLSMTSA-N 1 1 333.432 2.018 20 5 EEBDMO C[C@H]1CN(C(=O)C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000831533359 1314596989 /nfs/dbraw/zinc/59/69/89/1314596989.db2.gz GESWJLZROKOEBK-GOEBONIOSA-N 1 1 347.415 2.022 20 5 EEBDMO C[C@H]1CN(C(=O)C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000831533359 1314596992 /nfs/dbraw/zinc/59/69/92/1314596992.db2.gz GESWJLZROKOEBK-GOEBONIOSA-N 1 1 347.415 2.022 20 5 EEBDMO O=C1C[C@@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000840036609 1315280058 /nfs/dbraw/zinc/28/00/58/1315280058.db2.gz SOTLJEVSAOXGAC-SUMWQHHRSA-N 1 1 331.372 2.221 20 5 EEBDMO Cc1nn(CN2CC[C@]3(C2)CCC[N@H+](C)C3)c2ncc([N+](=O)[O-])cc12 ZINC000840085726 1315289981 /nfs/dbraw/zinc/28/99/81/1315289981.db2.gz GSVJZSLPHNQJGG-QGZVFWFLSA-N 1 1 344.419 2.023 20 5 EEBDMO CCOC(=O)[C@@H]1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254480117 1318083701 /nfs/dbraw/zinc/08/37/01/1318083701.db2.gz VKCRQSLYCWPNNL-CQSZACIVSA-N 1 1 347.415 2.449 20 5 EEBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CC(N2CCOC(C)(C)C2)C1 ZINC001254559119 1318120161 /nfs/dbraw/zinc/12/01/61/1318120161.db2.gz IOLWNXTYNBCCSA-AWEZNQCLSA-N 1 1 333.432 2.321 20 5 EEBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2CN(CC3CC3)C(=O)[C@H]2C1 ZINC001254560344 1318121705 /nfs/dbraw/zinc/12/17/05/1318121705.db2.gz FDCZVMDCSCPWFJ-COXVUDFISA-N 1 1 343.427 2.326 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC3(C1)CC[N@@H+](CC1CC1)C3)C2 ZINC001254595283 1318139343 /nfs/dbraw/zinc/13/93/43/1318139343.db2.gz ICLPACAZVKAWKX-SFHVURJKSA-N 1 1 327.428 2.480 20 5 EEBDMO [NH3+]CCc1cn(-c2ncnc3ccc([N+](=O)[O-])cc32)c2ccncc12 ZINC001160945814 1320326494 /nfs/dbraw/zinc/32/64/94/1320326494.db2.gz NIPNVJDJSWPAOL-UHFFFAOYSA-N 1 1 334.339 2.378 20 5 EEBDMO C[NH+]1CCN(CCCNc2ncc(F)c3cc([N+](=O)[O-])ccc32)CC1 ZINC001161703932 1320593676 /nfs/dbraw/zinc/59/36/76/1320593676.db2.gz SENJAHQAHGHAFR-UHFFFAOYSA-N 1 1 347.394 2.332 20 5 EEBDMO 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ZINC000815154381 1367815869 /nfs/dbraw/zinc/81/58/69/1367815869.db2.gz ANHFUKLEFHDUBX-ZDUSSCGKSA-N 1 1 349.387 2.151 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(Cn2c(=O)oc3cccc([N+](=O)[O-])c32)C1 ZINC000794634942 1369591178 /nfs/dbraw/zinc/59/11/78/1369591178.db2.gz ATYOMEXTLBYTBK-CYBMUJFWSA-N 1 1 348.403 2.124 20 5 EEBDMO CN(C(=O)CN1CCCC2(CC[NH2+]CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC001118198787 1371778496 /nfs/dbraw/zinc/77/84/96/1371778496.db2.gz SFGLGEYVFQKOEN-UHFFFAOYSA-N 1 1 346.431 2.023 20 5 EEBDMO CCN(CCNC(=O)Cn1cc[nH+]c1C)c1ccc(C)cc1[N+](=O)[O-] ZINC001100534677 1373068884 /nfs/dbraw/zinc/06/88/84/1373068884.db2.gz SZTWXBWGZSNZFW-UHFFFAOYSA-N 1 1 345.403 2.051 20 5 EEBDMO O=C(CC(F)(F)F)N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21 ZINC001752844063 1406479465 /nfs/dbraw/zinc/47/94/65/1406479465.db2.gz BJVSQZAYNJSCST-YABSGUDNSA-N 1 1 343.305 2.094 20 5 EEBDMO Cc1nc(C(=O)NCC2C[NH+](Cc3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC001031920964 779719836 /nfs/dbraw/zinc/71/98/36/779719836.db2.gz UTRZCMZGXKBLMG-UHFFFAOYSA-N 1 1 346.412 2.222 20 5 EEBDMO O=C(C[N@H+]1CCCCC[C@@H]1CO)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000847013280 790830586 /nfs/dbraw/zinc/83/05/86/790830586.db2.gz HKDUKGAUDJKXHK-GFCCVEGCSA-N 1 1 341.795 2.424 20 5 EEBDMO O=C(C[N@@H+]1CCCCC[C@@H]1CO)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000847013280 790830601 /nfs/dbraw/zinc/83/06/01/790830601.db2.gz HKDUKGAUDJKXHK-GFCCVEGCSA-N 1 1 341.795 2.424 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NC[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001091470776 790931433 /nfs/dbraw/zinc/93/14/33/790931433.db2.gz DRDDIVARXADVFO-CTYIDZIISA-N 1 1 334.420 2.243 20 5 EEBDMO CN(C[C@@H]1CCC[N@H+]1C)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000817374178 784722137 /nfs/dbraw/zinc/72/21/37/784722137.db2.gz JFWUOKOKFQOTCS-KRWDZBQOSA-N 1 1 329.404 2.442 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCCCC[N@H+]1CCC[C@H]1CO ZINC000821081532 786591473 /nfs/dbraw/zinc/59/14/73/786591473.db2.gz QLIFSENIQJVZRS-HNNXBMFYSA-N 1 1 349.431 2.178 20 5 EEBDMO 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2.244 20 5 EEBDMO CC(C)CC[C@H](O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000280269806 269344974 /nfs/dbraw/zinc/34/49/74/269344974.db2.gz KSCBYRQOJBMRII-KRWDZBQOSA-N 1 1 349.431 2.150 20 5 EEBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)[C@@H](C)C1 ZINC000288629139 275077609 /nfs/dbraw/zinc/07/76/09/275077609.db2.gz YKDCVXGFNOQPOQ-AWEZNQCLSA-N 1 1 346.431 2.361 20 5 EEBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)[C@@H](C)C1 ZINC000288629139 275077610 /nfs/dbraw/zinc/07/76/10/275077610.db2.gz YKDCVXGFNOQPOQ-AWEZNQCLSA-N 1 1 346.431 2.361 20 5 EEBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H]1CCS(=O)(=O)C1 ZINC000290454140 275208884 /nfs/dbraw/zinc/20/88/84/275208884.db2.gz OWDKTZDTWMKCGV-SECBINFHSA-N 1 1 339.200 2.178 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000291624089 275324105 /nfs/dbraw/zinc/32/41/05/275324105.db2.gz AZJXOUDDOPHKKE-KRWDZBQOSA-N 1 1 333.388 2.222 20 5 EEBDMO C[C@H](NC(=O)N1CC[C@@]2(CC[N@@H+](C)C2)C1)c1cccc([N+](=O)[O-])c1 ZINC000291673785 275328753 /nfs/dbraw/zinc/32/87/53/275328753.db2.gz QIIWXFUTIBHFLS-SUMWQHHRSA-N 1 1 332.404 2.393 20 5 EEBDMO CC(=O)c1ccc(N2CC[NH+](C3CCOCC3)CC2)c([N+](=O)[O-])c1 ZINC000267063843 275503977 /nfs/dbraw/zinc/50/39/77/275503977.db2.gz POCKUQDFCWWVDF-UHFFFAOYSA-N 1 1 333.388 2.098 20 5 EEBDMO C[NH+](C)[C@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000266660037 276857027 /nfs/dbraw/zinc/85/70/27/276857027.db2.gz HVBABIJZQHLTNV-OAHLLOKOSA-N 1 1 346.387 2.332 20 5 EEBDMO COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)[N@H+]2CCc2ccc([N+](=O)[O-])cc2)O1 ZINC000374686898 277369049 /nfs/dbraw/zinc/36/90/49/277369049.db2.gz OVTGFIHDLCTAAJ-YYQUZTFQSA-N 1 1 348.399 2.321 20 5 EEBDMO Cc1[nH]nc(C(=O)N(CC[NH+](C)C)CC2CCCCC2)c1[N+](=O)[O-] ZINC000264298247 280187266 /nfs/dbraw/zinc/18/72/66/280187266.db2.gz YHSLAIJMWYZZQZ-UHFFFAOYSA-N 1 1 337.424 2.210 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000293095431 293123629 /nfs/dbraw/zinc/12/36/29/293123629.db2.gz XIGRRQJQWXKJJB-KSSFIOAISA-N 1 1 346.431 2.340 20 5 EEBDMO CC[NH+]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1 ZINC000294175465 293388714 /nfs/dbraw/zinc/38/87/14/293388714.db2.gz DKYRKCCZFGKCCH-UHFFFAOYSA-N 1 1 331.294 2.391 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)[C@@H]2C1 ZINC000296772854 294063527 /nfs/dbraw/zinc/06/35/27/294063527.db2.gz MUVAYTVOJJSYEH-CZUORRHYSA-N 1 1 345.399 2.110 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+](C2CC2)C[C@@H](C)C1 ZINC000296859380 294086188 /nfs/dbraw/zinc/08/61/88/294086188.db2.gz YTFVPIQNCWFKEO-UONOGXRCSA-N 1 1 346.431 2.338 20 5 EEBDMO C[C@@H]1C[C@H](c2ccccc2)[C@H](C)[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000296951704 294110972 /nfs/dbraw/zinc/11/09/72/294110972.db2.gz XWYICTBSFWSIQR-BODMPHMZSA-N 1 1 344.415 2.419 20 5 EEBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000332477414 312013450 /nfs/dbraw/zinc/01/34/50/312013450.db2.gz VMMZITMXXYIZSM-UONOGXRCSA-N 1 1 346.431 2.360 20 5 EEBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000332477414 312013452 /nfs/dbraw/zinc/01/34/52/312013452.db2.gz VMMZITMXXYIZSM-UONOGXRCSA-N 1 1 346.431 2.360 20 5 EEBDMO Cc1c(CNC(=O)N2C[C@H]3CCC[N@@H+]3C[C@H]2C)cccc1[N+](=O)[O-] ZINC000332570661 312026808 /nfs/dbraw/zinc/02/68/08/312026808.db2.gz WFCXQEBLPOURIX-IUODEOHRSA-N 1 1 332.404 2.281 20 5 EEBDMO C[N@H+](Cc1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1)[C@@H]1CCSC1 ZINC000350606619 312334388 /nfs/dbraw/zinc/33/43/88/312334388.db2.gz MPKVSAGCYKZIFB-SNVBAGLBSA-N 1 1 335.389 2.164 20 5 EEBDMO C[N@@H+](Cc1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1)[C@@H]1CCSC1 ZINC000350606619 312334390 /nfs/dbraw/zinc/33/43/90/312334390.db2.gz MPKVSAGCYKZIFB-SNVBAGLBSA-N 1 1 335.389 2.164 20 5 EEBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000421705250 314145999 /nfs/dbraw/zinc/14/59/99/314145999.db2.gz QVHPXSDUMNUNTR-AWEZNQCLSA-N 1 1 332.404 2.335 20 5 EEBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](N2CCNC2=O)C1 ZINC000527054858 317146556 /nfs/dbraw/zinc/14/65/56/317146556.db2.gz LQZHCZXXEDTOJG-IDKBZEPQSA-N 1 1 344.415 2.488 20 5 EEBDMO C[C@H]([NH2+][C@@H]1C[C@@H](O)C1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000565665694 319202892 /nfs/dbraw/zinc/20/28/92/319202892.db2.gz MQUYHZKVAMAYTD-ZWKOPEQDSA-N 1 1 332.360 2.455 20 5 EEBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)N1CCc3ccc([N+](=O)[O-])cc31)CC2 ZINC000578073955 320292990 /nfs/dbraw/zinc/29/29/90/320292990.db2.gz FOZXBPVSKOOHNF-ZDUSSCGKSA-N 1 1 326.356 2.251 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+]3CCCC[C@@H]3C2)c1 ZINC000282811311 464958010 /nfs/dbraw/zinc/95/80/10/464958010.db2.gz JIRHOFCVILERSL-CYBMUJFWSA-N 1 1 333.388 2.304 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+]3CCCC[C@@H]3C2)c1 ZINC000282811311 464958015 /nfs/dbraw/zinc/95/80/15/464958015.db2.gz JIRHOFCVILERSL-CYBMUJFWSA-N 1 1 333.388 2.304 20 5 EEBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000347591693 465111196 /nfs/dbraw/zinc/11/11/96/465111196.db2.gz UWQORKJMRALHFU-QWHCGFSZSA-N 1 1 343.387 2.053 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000347591693 465111198 /nfs/dbraw/zinc/11/11/98/465111198.db2.gz UWQORKJMRALHFU-QWHCGFSZSA-N 1 1 343.387 2.053 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](CCNC(C)=O)C1 ZINC000347621837 465128537 /nfs/dbraw/zinc/12/85/37/465128537.db2.gz HNRYXXGRUVMKLM-CQSZACIVSA-N 1 1 335.404 2.342 20 5 EEBDMO C[N@@H+](CCc1cccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c1)C1CC1 ZINC000341557192 465231411 /nfs/dbraw/zinc/23/14/11/465231411.db2.gz BRAUDNQAMJSDLN-UHFFFAOYSA-N 1 1 343.387 2.067 20 5 EEBDMO O=C(NCC[NH+]1CCC1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000337311826 465299589 /nfs/dbraw/zinc/29/95/89/465299589.db2.gz DBHJCRIGDANOQM-UHFFFAOYSA-N 1 1 332.385 2.154 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000085408904 462545106 /nfs/dbraw/zinc/54/51/06/462545106.db2.gz ZDHRVMTUOCAJHI-HIFRSBDPSA-N 1 1 334.420 2.119 20 5 EEBDMO C[C@@H]1C[C@H](N(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C ZINC000127515861 462560384 /nfs/dbraw/zinc/56/03/84/462560384.db2.gz YVRWNHPCYMBTOJ-GHMZBOCLSA-N 1 1 331.376 2.026 20 5 EEBDMO C[C@@H]1C[C@H](N(C)C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C ZINC000127515861 462560391 /nfs/dbraw/zinc/56/03/91/462560391.db2.gz YVRWNHPCYMBTOJ-GHMZBOCLSA-N 1 1 331.376 2.026 20 5 EEBDMO C[C@@H]1C[C@H](N(C)C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C ZINC000127515861 462560394 /nfs/dbraw/zinc/56/03/94/462560394.db2.gz YVRWNHPCYMBTOJ-GHMZBOCLSA-N 1 1 331.376 2.026 20 5 EEBDMO CCS(=O)(=O)C[C@@H](C)[N@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000113002018 462564008 /nfs/dbraw/zinc/56/40/08/462564008.db2.gz OSEUFIHAENIHTI-CYBMUJFWSA-N 1 1 344.433 2.119 20 5 EEBDMO CCS(=O)(=O)C[C@@H](C)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000113002018 462564010 /nfs/dbraw/zinc/56/40/10/462564010.db2.gz OSEUFIHAENIHTI-CYBMUJFWSA-N 1 1 344.433 2.119 20 5 EEBDMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000113229419 462579027 /nfs/dbraw/zinc/57/90/27/462579027.db2.gz BTIHRTVVLJFWCG-TZMCWYRMSA-N 1 1 335.429 2.382 20 5 EEBDMO CC(C)[C@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000087035062 462584899 /nfs/dbraw/zinc/58/48/99/462584899.db2.gz PUJODIWHVFJSCQ-KRWDZBQOSA-N 1 1 349.431 2.000 20 5 EEBDMO O=C1NCCCC[C@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113320105 462589355 /nfs/dbraw/zinc/58/93/55/462589355.db2.gz ISQMGZMCFDIQFD-CQSZACIVSA-N 1 1 346.412 2.477 20 5 EEBDMO C[N@@H+](CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])C1CCCC1 ZINC000089620256 462699096 /nfs/dbraw/zinc/69/90/96/462699096.db2.gz XKSIDQXFCDWAMX-UHFFFAOYSA-N 1 1 341.433 2.285 20 5 EEBDMO CC(C)[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000066920855 462945948 /nfs/dbraw/zinc/94/59/48/462945948.db2.gz MWUSQVDYXOLEIL-CPUCHLNUSA-N 1 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ZINC000985426276 686672775 /nfs/dbraw/zinc/67/27/75/686672775.db2.gz PGNVBKOLTDMTNB-NVXWUHKLSA-N 1 1 349.406 2.222 20 5 EEBDMO Cc1ccc(F)c(C[N@@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC000985426276 686672780 /nfs/dbraw/zinc/67/27/80/686672780.db2.gz PGNVBKOLTDMTNB-NVXWUHKLSA-N 1 1 349.406 2.222 20 5 EEBDMO Cc1ccc(F)c(C[N@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC000985426276 686672782 /nfs/dbraw/zinc/67/27/82/686672782.db2.gz PGNVBKOLTDMTNB-NVXWUHKLSA-N 1 1 349.406 2.222 20 5 EEBDMO C[C@@H](C(=O)N1C[C@@H]2CC[N@@H+](C)C[C@@H]2C1)c1ccc([N+](=O)[O-])cc1F ZINC000898166565 691889055 /nfs/dbraw/zinc/88/90/55/691889055.db2.gz APRLWZBVHDKYMS-FRRDWIJNSA-N 1 1 335.379 2.248 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]CC[C@@H](O)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000898203829 691893472 /nfs/dbraw/zinc/89/34/72/691893472.db2.gz JVZSMIHLMBQQFN-CVEARBPZSA-N 1 1 330.388 2.168 20 5 EEBDMO Cc1cc(C(=O)N2CCC([NH2+]Cc3ccccc3[N+](=O)[O-])CC2)n[nH]1 ZINC000990086087 692635805 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MOFWDIHPSWFEIT-UHFFFAOYSA-N 1 1 340.323 2.138 20 5 EEBDMO COc1ccc([C@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000870138648 1200500281 /nfs/dbraw/zinc/50/02/81/1200500281.db2.gz NDKSBZQDVSJBHX-QGZVFWFLSA-N 1 1 341.367 2.390 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CSc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC000812335978 1200669327 /nfs/dbraw/zinc/66/93/27/1200669327.db2.gz VXXSTWAEUGSKNW-OLZOCXBDSA-N 1 1 335.429 2.097 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC[C@](CO)(c3ccccc3)C2)cc1 ZINC000812883343 1200968189 /nfs/dbraw/zinc/96/81/89/1200968189.db2.gz STUDCISPZPQKCI-MOPGFXCFSA-N 1 1 342.395 2.264 20 5 EEBDMO COc1ccc(CN(C)C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1 ZINC000867957194 1201714813 /nfs/dbraw/zinc/71/48/13/1201714813.db2.gz FAHYULGCNNFIGC-SFHVURJKSA-N 1 1 343.383 2.436 20 5 EEBDMO O=[N+]([O-])c1cccc([C@H](O)C[NH+]2CCN(c3ccc(O)cc3)CC2)c1 ZINC000136804893 1202470571 /nfs/dbraw/zinc/47/05/71/1202470571.db2.gz VGKWRLUMOCGZJK-GOSISDBHSA-N 1 1 343.383 2.156 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NCC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001095363808 1204193122 /nfs/dbraw/zinc/19/31/22/1204193122.db2.gz RWMUBQMQMGHBIF-UHFFFAOYSA-N 1 1 348.447 2.269 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NCCCN(C)c1cccc(F)c1[N+](=O)[O-] ZINC001095625405 1205895645 /nfs/dbraw/zinc/89/56/45/1205895645.db2.gz OYNVDUSZCQFYEB-UHFFFAOYSA-N 1 1 340.399 2.018 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](N(C)C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000931041302 1206602090 /nfs/dbraw/zinc/60/20/90/1206602090.db2.gz CEUSYCOHKDNXRD-BBRMVZONSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](N(C)C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000931041302 1206602091 /nfs/dbraw/zinc/60/20/91/1206602091.db2.gz CEUSYCOHKDNXRD-BBRMVZONSA-N 1 1 334.420 2.256 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000933433525 1207770630 /nfs/dbraw/zinc/77/06/30/1207770630.db2.gz FCHKAEKWZNTPOE-YYQUZTFQSA-N 1 1 331.416 2.497 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C[C@@H]1C ZINC000778406834 1208238189 /nfs/dbraw/zinc/23/81/89/1208238189.db2.gz BZURFLTWRVJNAE-VHSXEESVSA-N 1 1 349.416 2.154 20 5 EEBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000778939432 1208410575 /nfs/dbraw/zinc/41/05/75/1208410575.db2.gz MSTAKIKXENUCSN-SNVBAGLBSA-N 1 1 343.330 2.410 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCO[C@H]3CCCCO3)CC2)cc1 ZINC000195229744 1211345809 /nfs/dbraw/zinc/34/58/09/1211345809.db2.gz BFPFCBWKLZBOHL-KRWDZBQOSA-N 1 1 335.404 2.260 20 5 EEBDMO Cc1nn(C[N@@H+]2CCS[C@H]3COCC[C@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000245875824 1211985039 /nfs/dbraw/zinc/98/50/39/1211985039.db2.gz MRPVAFIEYAIXRO-ZBFHGGJFSA-N 1 1 348.428 2.417 20 5 EEBDMO Cc1nn(C[N@H+]2CCS[C@H]3COCC[C@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000245875824 1211985044 /nfs/dbraw/zinc/98/50/44/1211985044.db2.gz MRPVAFIEYAIXRO-ZBFHGGJFSA-N 1 1 348.428 2.417 20 5 EEBDMO O=C(c1ccoc1)N1C[C@@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@@H]2C1 ZINC001048676717 1238267347 /nfs/dbraw/zinc/26/73/47/1238267347.db2.gz IUWZAOYEMPQNDY-IYBDPMFKSA-N 1 1 341.367 2.392 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001097205640 1243822636 /nfs/dbraw/zinc/82/26/36/1243822636.db2.gz JTLFLUNTFYHXCR-GASCZTMLSA-N 1 1 334.420 2.386 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NCCN(c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001101352571 1245701117 /nfs/dbraw/zinc/70/11/17/1245701117.db2.gz HLPMGSKKLRBOSP-UHFFFAOYSA-N 1 1 334.420 2.020 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)N[C@H]1C[C@H](CNc2ccccc2[N+](=O)[O-])C1 ZINC001068551836 1251288285 /nfs/dbraw/zinc/28/82/85/1251288285.db2.gz DGDHJQSUUYIYBH-HDJSIYSDSA-N 1 1 343.387 2.107 20 5 EEBDMO O=C(COCC1CC1)N1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001194983329 1283390929 /nfs/dbraw/zinc/39/09/29/1283390929.db2.gz GUJWSNKSMJQGOZ-UHFFFAOYSA-N 1 1 347.415 2.056 20 5 EEBDMO O=C(COCC1CC1)N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001194983329 1283390940 /nfs/dbraw/zinc/39/09/40/1283390940.db2.gz GUJWSNKSMJQGOZ-UHFFFAOYSA-N 1 1 347.415 2.056 20 5 EEBDMO C[N@@H+]1CCc2c(sc(Nc3cc(O)cc([N+](=O)[O-])c3)c2C(N)=O)C1 ZINC001199802611 1285836738 /nfs/dbraw/zinc/83/67/38/1285836738.db2.gz WBJWHCOYTXXDCC-UHFFFAOYSA-N 1 1 348.384 2.192 20 5 EEBDMO C[N@H+]1CCc2c(sc(Nc3cc(O)cc([N+](=O)[O-])c3)c2C(N)=O)C1 ZINC001199802611 1285836745 /nfs/dbraw/zinc/83/67/45/1285836745.db2.gz WBJWHCOYTXXDCC-UHFFFAOYSA-N 1 1 348.384 2.192 20 5 EEBDMO Cc1noc(C[NH+]2CCC(OC[C@H]3CCCO3)CC2)c1[N+](=O)[O-] ZINC000851805292 1291846702 /nfs/dbraw/zinc/84/67/02/1291846702.db2.gz QLMOGWXJIBYADH-CYBMUJFWSA-N 1 1 325.365 2.051 20 5 EEBDMO Cc1noc(C[NH+]2CCC(OC[C@@H]3CCCO3)CC2)c1[N+](=O)[O-] ZINC000851805293 1291847674 /nfs/dbraw/zinc/84/76/74/1291847674.db2.gz QLMOGWXJIBYADH-ZDUSSCGKSA-N 1 1 325.365 2.051 20 5 EEBDMO CO[C@@H]1CC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C[C@H]1C ZINC000853516687 1292405909 /nfs/dbraw/zinc/40/59/09/1292405909.db2.gz NTUWVXHIFAAPLD-IUODEOHRSA-N 1 1 331.376 2.168 20 5 EEBDMO 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332.404 2.398 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N[C@H]2C[N@@H+](C3CC3)C[C@@H]2C)c1F ZINC000830015641 1314523584 /nfs/dbraw/zinc/52/35/84/1314523584.db2.gz ABPIBHUXTZGJIY-ONGXEEELSA-N 1 1 339.342 2.394 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)c1F ZINC000831555398 1314597993 /nfs/dbraw/zinc/59/79/93/1314597993.db2.gz ODOJFDOJSDPOAW-NXEZZACHSA-N 1 1 327.331 2.346 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)c1F ZINC000831555398 1314597997 /nfs/dbraw/zinc/59/79/97/1314597997.db2.gz ODOJFDOJSDPOAW-NXEZZACHSA-N 1 1 327.331 2.346 20 5 EEBDMO C[C@H]1C[C@@H](N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000839687936 1315233594 /nfs/dbraw/zinc/23/35/94/1315233594.db2.gz NDCKLNVDPORDIF-QMCVQRASSA-N 1 1 331.416 2.163 20 5 EEBDMO C[C@H]1C[C@@H](N(C)C(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000839687936 1315233598 /nfs/dbraw/zinc/23/35/98/1315233598.db2.gz NDCKLNVDPORDIF-QMCVQRASSA-N 1 1 331.416 2.163 20 5 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CC(=O)N1CC[C@H]([N@H+](C(C)C)[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254605905 1318141791 /nfs/dbraw/zinc/14/17/91/1318141791.db2.gz CLWBTSIPAMCQNY-ROUUACIJSA-N 1 1 331.416 2.393 20 5 EEBDMO CCC[N@@H+]1C[C@H]2CN(c3cnc4ccc([N+](=O)[O-])cc4n3)C[C@H]2C1 ZINC001157689651 1318798006 /nfs/dbraw/zinc/79/80/06/1318798006.db2.gz IGVGPPWIIQQUJD-BETUJISGSA-N 1 1 327.388 2.316 20 5 EEBDMO CCC[N@@H+]1C[C@H]2CN(c3ncnc4cc([N+](=O)[O-])ccc43)C[C@H]2C1 ZINC001157692658 1318801646 /nfs/dbraw/zinc/80/16/46/1318801646.db2.gz YIIJWUWMSQORTD-BETUJISGSA-N 1 1 327.388 2.316 20 5 EEBDMO C[C@@H]1C[NH+](CCc2nnc(/C=C/c3ccc([N+](=O)[O-])o3)o2)C[C@@H](C)O1 ZINC001258045476 1319153522 /nfs/dbraw/zinc/15/35/22/1319153522.db2.gz CTAJFBPJRLJYFV-WEPHUFDCSA-N 1 1 348.359 2.393 20 5 EEBDMO COCCC(=O)NCCC1=CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001159069395 1319592157 /nfs/dbraw/zinc/59/21/57/1319592157.db2.gz SOBISBQZJWYMDM-UHFFFAOYSA-N 1 1 347.415 2.270 20 5 EEBDMO COc1cnc(N[C@@H](C[NH+]2CCOCC2)C(C)(C)C)c([N+](=O)[O-])c1 ZINC001162876614 1320979525 /nfs/dbraw/zinc/97/95/25/1320979525.db2.gz UDHGFPMNYYZZQW-AWEZNQCLSA-N 1 1 338.408 2.157 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](Nc2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC001163367004 1321106390 /nfs/dbraw/zinc/10/63/90/1321106390.db2.gz XNDSRKQNEWPLDY-QWRGUYRKSA-N 1 1 328.800 2.412 20 5 EEBDMO [NH3+][C@H]1CN(c2ccc(-c3ccccc3[N+](=O)[O-])nn2)CCC1(F)F ZINC001164327436 1321352446 /nfs/dbraw/zinc/35/24/46/1321352446.db2.gz NZFXUUVPAYINQQ-ZDUSSCGKSA-N 1 1 335.314 2.225 20 5 EEBDMO [NH3+][C@H]1CN(c2cc([N+](=O)[O-])cc3c(Cl)ncnc32)CCC1(F)F ZINC001164325091 1321352578 /nfs/dbraw/zinc/35/25/78/1321352578.db2.gz AHBGCQJCZMXNDZ-JTQLQIEISA-N 1 1 343.721 2.364 20 5 EEBDMO C[NH+](C)/C=C/c1cc(N2CCC[C@](F)(CO)CC2)ncc1[N+](=O)[O-] ZINC001164417846 1321374923 /nfs/dbraw/zinc/37/49/23/1321374923.db2.gz OBBPXTDFFJNKLZ-KZJSRBBCSA-N 1 1 338.383 2.213 20 5 EEBDMO Cc1cc(F)ccc1C[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001164494810 1321396014 /nfs/dbraw/zinc/39/60/14/1321396014.db2.gz TYUCYRNKSRXOBU-HZPDHXFCSA-N 1 1 349.406 2.175 20 5 EEBDMO Cc1ccc(C[NH2+]CC2(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1C ZINC001164494284 1321396099 /nfs/dbraw/zinc/39/60/99/1321396099.db2.gz DAAZQXQTHPYVOH-IAGOWNOFSA-N 1 1 345.443 2.345 20 5 EEBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2ncc(F)cc2[N+](=O)[O-])CC1 ZINC001165107628 1321455514 /nfs/dbraw/zinc/45/55/14/1321455514.db2.gz KAHSBYHJCUQLPY-AWEZNQCLSA-N 1 1 338.383 2.209 20 5 EEBDMO CC(C)[C@@]1(CO)CC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000351939384 1321947775 /nfs/dbraw/zinc/94/77/75/1321947775.db2.gz SZMRZJBHSNQXOF-GUYCJALGSA-N 1 1 335.404 2.262 20 5 EEBDMO CC(C)[C@@]1(CO)CC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000351939384 1321947776 /nfs/dbraw/zinc/94/77/76/1321947776.db2.gz SZMRZJBHSNQXOF-GUYCJALGSA-N 1 1 335.404 2.262 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@](CO)(C(C)C)C1 ZINC000351948826 1321967684 /nfs/dbraw/zinc/96/76/84/1321967684.db2.gz ITHHOUZFNUKRTE-QGZVFWFLSA-N 1 1 335.404 2.182 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@](CO)(C(C)C)C1 ZINC000351948826 1321967687 /nfs/dbraw/zinc/96/76/87/1321967687.db2.gz ITHHOUZFNUKRTE-QGZVFWFLSA-N 1 1 335.404 2.182 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)NCCCCn1cc[nH+]c1C ZINC001318681885 1332576177 /nfs/dbraw/zinc/57/61/77/1332576177.db2.gz LHXOZBBHPOEDLQ-UHFFFAOYSA-N 1 1 331.376 2.352 20 5 EEBDMO CCC(CC)[N@@H+](CCOC)Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001609188962 1351882871 /nfs/dbraw/zinc/88/28/71/1351882871.db2.gz FPJOEDMKPAIOIU-UHFFFAOYSA-N 1 1 348.407 2.412 20 5 EEBDMO CC[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C(C)(C)C ZINC001326518462 1334108705 /nfs/dbraw/zinc/10/87/05/1334108705.db2.gz UWFKLBCBLJVFEB-UHFFFAOYSA-N 1 1 348.447 2.364 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)C[C@@H]21 ZINC001333317275 1336006515 /nfs/dbraw/zinc/00/65/15/1336006515.db2.gz FBFVDRAPUMPDHK-PELKAZGASA-N 1 1 327.743 2.163 20 5 EEBDMO C[C@@H]1CC[N@@H+](CCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC001335567158 1336395639 /nfs/dbraw/zinc/39/56/39/1336395639.db2.gz DZBJHGIIHMKKMR-CYBMUJFWSA-N 1 1 334.420 2.471 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])CCCO1 ZINC001589518974 1349000199 /nfs/dbraw/zinc/00/01/99/1349000199.db2.gz WDARPRMWTILYIW-OAHLLOKOSA-N 1 1 346.391 2.022 20 5 EEBDMO C[C@@H]([NH2+]Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])c1ccns1 ZINC001589966158 1349084902 /nfs/dbraw/zinc/08/49/02/1349084902.db2.gz ZIIGIJYCNPCDKM-MRVPVSSYSA-N 1 1 331.361 2.082 20 5 EEBDMO C[C@H](c1cccnc1)[N@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590050165 1349130033 /nfs/dbraw/zinc/13/00/33/1349130033.db2.gz ISEBCSNTMJGINA-LLVKDONJSA-N 1 1 339.359 2.363 20 5 EEBDMO C[C@H](c1cccnc1)[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590050165 1349130038 /nfs/dbraw/zinc/13/00/38/1349130038.db2.gz ISEBCSNTMJGINA-LLVKDONJSA-N 1 1 339.359 2.363 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCCNc1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1 ZINC001590260626 1349234460 /nfs/dbraw/zinc/23/44/60/1349234460.db2.gz QLMNXKIJBCOLEY-LBPRGKRZSA-N 1 1 345.407 2.451 20 5 EEBDMO O=[N+]([O-])c1c(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cccc1-c1nn[nH]n1 ZINC001593465214 1349802684 /nfs/dbraw/zinc/80/26/84/1349802684.db2.gz JVAKLANXBLJERE-OCCSQVGLSA-N 1 1 343.391 2.204 20 5 EEBDMO C[C@H](C[NH+]1CCCCC1)Nc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001603517891 1350715577 /nfs/dbraw/zinc/71/55/77/1350715577.db2.gz PDYQPPKIHHXCIK-SECBINFHSA-N 1 1 337.409 2.123 20 5 EEBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](CO)Cc1ccccc1 ZINC000852287829 1369258502 /nfs/dbraw/zinc/25/85/02/1369258502.db2.gz HFRVIVXAJPILIB-ROUUACIJSA-N 1 1 330.384 2.164 20 5 EEBDMO CC[C@H]1CC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000119498906 1369564599 /nfs/dbraw/zinc/56/45/99/1369564599.db2.gz IBPUEXNIFVFTCU-YVEFUNNKSA-N 1 1 346.387 2.051 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H]1CCSC1 ZINC000798542496 1371589017 /nfs/dbraw/zinc/58/90/17/1371589017.db2.gz XDUBROQFQHJYPB-GFCCVEGCSA-N 1 1 339.417 2.369 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@@H]1CCSC1 ZINC000798542496 1371589026 /nfs/dbraw/zinc/58/90/26/1371589026.db2.gz XDUBROQFQHJYPB-GFCCVEGCSA-N 1 1 339.417 2.369 20 5 EEBDMO CC(C)(C)[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1Br)C(N)=O ZINC000839522463 1372907939 /nfs/dbraw/zinc/90/79/39/1372907939.db2.gz WSQBKAJQVBDECZ-LLVKDONJSA-N 1 1 344.209 2.347 20 5 EEBDMO Cc1cnc(N2CC[NH+](CCOc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000361262509 721952917 /nfs/dbraw/zinc/95/29/17/721952917.db2.gz NKLHXSQUXWOSRX-UHFFFAOYSA-N 1 1 342.399 2.499 20 5 EEBDMO C[NH+](C)/C=C/c1cc(N2CCO[C@@H](C(F)(F)F)C2)ncc1[N+](=O)[O-] ZINC001167083786 757210309 /nfs/dbraw/zinc/21/03/09/757210309.db2.gz GTVNZNSNOSRHPD-AAOUONPWSA-N 1 1 346.309 2.290 20 5 EEBDMO Cc1c(NCC[NH+]2CCSCC2)ccc([N+](=O)[O-])c1[N+](=O)[O-] ZINC001167837982 777049986 /nfs/dbraw/zinc/04/99/86/777049986.db2.gz VIUNSBFVHLJVIR-UHFFFAOYSA-N 1 1 326.378 2.272 20 5 EEBDMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N[C@@H]1CCc2c[nH+]cn2C1 ZINC000893822747 780220912 /nfs/dbraw/zinc/22/09/12/780220912.db2.gz PVBGNTVDHADASG-LLVKDONJSA-N 1 1 327.319 2.327 20 5 EEBDMO O=C(OCc1ccc(C[NH+]2CCOCC2)cc1)c1ccc([N+](=O)[O-])o1 ZINC000817178950 784557353 /nfs/dbraw/zinc/55/73/53/784557353.db2.gz RCDQPWJLXVPVKW-UHFFFAOYSA-N 1 1 346.339 2.377 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000910280503 786610830 /nfs/dbraw/zinc/61/08/30/786610830.db2.gz BRFZMTGUFXLKBG-SNVBAGLBSA-N 1 1 349.416 2.156 20 5 EEBDMO CC1(C)C(=O)N[C@@H]1C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000821337132 786702469 /nfs/dbraw/zinc/70/24/69/786702469.db2.gz TVEHTSDBRGSPHH-OAHLLOKOSA-N 1 1 335.379 2.471 20 5 EEBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CC([N@H+]2CC[C@@H](O)C2)C1 ZINC000846067456 790052148 /nfs/dbraw/zinc/05/21/48/790052148.db2.gz FHQCQDIFAAKRTM-GFCCVEGCSA-N 1 1 346.214 2.152 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(NCCNC(=O)C[N@H+]2CCC(C)(C)C2)c1 ZINC001094140799 795991150 /nfs/dbraw/zinc/99/11/50/795991150.db2.gz VSJGEOAITYOFBP-UHFFFAOYSA-N 1 1 334.420 2.163 20 5 EEBDMO C[N@@H+](CC(=O)NCCCNc1ccccc1[N+](=O)[O-])CC(C)(C)C ZINC001094784151 796578531 /nfs/dbraw/zinc/57/85/31/796578531.db2.gz LJSNDRRYEXYDQB-UHFFFAOYSA-N 1 1 336.436 2.491 20 5 EEBDMO CC(=O)C[N@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173010561 797195738 /nfs/dbraw/zinc/19/57/38/797195738.db2.gz VAMWMPCMBVZLIZ-UHFFFAOYSA-N 1 1 327.331 2.363 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H](O)[C@@H](C)C2)c1F ZINC001173180752 797278487 /nfs/dbraw/zinc/27/84/87/797278487.db2.gz MWSDUTIWRXXARN-COPLHBTASA-N 1 1 326.368 2.376 20 5 EEBDMO Cc1ncoc1C(=O)NC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001002535828 798237160 /nfs/dbraw/zinc/23/71/60/798237160.db2.gz CJUALWYWPSOKBF-UHFFFAOYSA-N 1 1 344.371 2.286 20 5 EEBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC(=O)NCc1ccco1 ZINC000917830118 798378813 /nfs/dbraw/zinc/37/88/13/798378813.db2.gz KRMDDSKYQMVDCZ-UHFFFAOYSA-N 1 1 347.371 2.205 20 5 EEBDMO Cc1ccccc1C[NH2+]CCCCCCNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001178458324 799484200 /nfs/dbraw/zinc/48/42/00/799484200.db2.gz ALHAJZWBESYTBA-IAGOWNOFSA-N 1 1 333.432 2.426 20 5 EEBDMO O=C(NCCCCCC[NH2+]CC1CC2(CCC2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001178463518 799486709 /nfs/dbraw/zinc/48/67/09/799486709.db2.gz FYWHPHOKZBOQLO-HZPDHXFCSA-N 1 1 337.464 2.498 20 5 EEBDMO COc1ccccc1C1([NH3+])CCN([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168994587 803561465 /nfs/dbraw/zinc/56/14/65/803561465.db2.gz QEKYAHZLPWZAEN-GJZGRUSLSA-N 1 1 333.432 2.390 20 5 EEBDMO COc1ccc(CC[N@@H+](C[C@H](C)O)[C@@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001169007230 803568417 /nfs/dbraw/zinc/56/84/17/803568417.db2.gz LZKKPCHJQYVHPJ-BHYGNILZSA-N 1 1 336.432 2.366 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)[C@H]2C[C@H]21 ZINC001169012854 803571305 /nfs/dbraw/zinc/57/13/05/803571305.db2.gz SHGMNRDJJJJWCG-RFQIPJPRSA-N 1 1 325.409 2.125 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)[C@H]2C[C@H]21 ZINC001169012854 803571310 /nfs/dbraw/zinc/57/13/10/803571310.db2.gz SHGMNRDJJJJWCG-RFQIPJPRSA-N 1 1 325.409 2.125 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@]3(C[C@H](OCC4CC4)CO3)C2)C1 ZINC001169023496 803590124 /nfs/dbraw/zinc/59/01/24/803590124.db2.gz UYKYOCGHEHMWQI-VSZNYVQBSA-N 1 1 338.448 2.482 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CC[C@]3(C[C@H](Oc4ccccn4)CO3)C2)C1 ZINC001169025157 803590781 /nfs/dbraw/zinc/59/07/81/803590781.db2.gz SNIMZVFJFUTYAS-OVWQWFNUSA-N 1 1 347.415 2.139 20 5 EEBDMO O=C(Cc1ccccc1)N1CCC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169047030 803592919 /nfs/dbraw/zinc/59/29/19/803592919.db2.gz QAELIGPWQJWEEH-QZTJIDSGSA-N 1 1 345.443 2.209 20 5 EEBDMO C[C@@H]1CN(C(=O)c2ccccc2)CC[N@H+]1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169055781 803597006 /nfs/dbraw/zinc/59/70/06/803597006.db2.gz QHLIULMCSCAXDW-BFYDXBDKSA-N 1 1 331.416 2.278 20 5 EEBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000787675093 807176795 /nfs/dbraw/zinc/17/67/95/807176795.db2.gz JEOFSLBVCXSBIG-MRXNPFEDSA-N 1 1 337.395 2.421 20 5 EEBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000787675093 807176803 /nfs/dbraw/zinc/17/68/03/807176803.db2.gz JEOFSLBVCXSBIG-MRXNPFEDSA-N 1 1 337.395 2.421 20 5 EEBDMO CC(C)[C@@H](C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+](C)C ZINC000787959987 807316010 /nfs/dbraw/zinc/31/60/10/807316010.db2.gz GYNFSDSVGKSXNU-RISCZKNCSA-N 1 1 337.376 2.051 20 5 EEBDMO COC(=O)[C@@]1(C)CC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170355728 809903004 /nfs/dbraw/zinc/90/30/04/809903004.db2.gz QNPVAHZVPPPQJF-SJCJKPOMSA-N 1 1 336.388 2.419 20 5 EEBDMO COC(=O)[C@H]1C[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CC12CC2 ZINC001170356144 809903606 /nfs/dbraw/zinc/90/36/06/809903606.db2.gz YNWQHGHFWZQBIC-IUODEOHRSA-N 1 1 348.399 2.419 20 5 EEBDMO 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VODVETOGUMFWMD-KRWDZBQOSA-N 1 1 340.383 2.393 20 5 EEBDMO CCc1ncc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000414401451 313012772 /nfs/dbraw/zinc/01/27/72/313012772.db2.gz YANFKXYFBPOQQA-ZDUSSCGKSA-N 1 1 328.376 2.029 20 5 EEBDMO CCc1ncc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000414401451 313012775 /nfs/dbraw/zinc/01/27/75/313012775.db2.gz YANFKXYFBPOQQA-ZDUSSCGKSA-N 1 1 328.376 2.029 20 5 EEBDMO CCc1ncc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000414401450 313012938 /nfs/dbraw/zinc/01/29/38/313012938.db2.gz YANFKXYFBPOQQA-CYBMUJFWSA-N 1 1 328.376 2.029 20 5 EEBDMO CCc1ncc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000414401450 313012940 /nfs/dbraw/zinc/01/29/40/313012940.db2.gz YANFKXYFBPOQQA-CYBMUJFWSA-N 1 1 328.376 2.029 20 5 EEBDMO COC[C@@H]1C[C@H](O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000414485772 313033940 /nfs/dbraw/zinc/03/39/40/313033940.db2.gz IMTMHSDTJXCBCF-GJZGRUSLSA-N 1 1 332.356 2.436 20 5 EEBDMO C[C@@H]1C[C@@H](CO)C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000421361021 314091657 /nfs/dbraw/zinc/09/16/57/314091657.db2.gz KBENYQKMMAYAAI-ZIAGYGMSSA-N 1 1 344.415 2.446 20 5 EEBDMO C[N@H+]1CCC[C@H](CNC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000577030616 320224863 /nfs/dbraw/zinc/22/48/63/320224863.db2.gz XEXYLKVHBLNQDP-GFCCVEGCSA-N 1 1 343.387 2.057 20 5 EEBDMO Cc1ccc([C@H](O)C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)cc1 ZINC000298093396 465299622 /nfs/dbraw/zinc/29/96/22/465299622.db2.gz MWPGALMYNMVFTB-QGZVFWFLSA-N 1 1 342.399 2.154 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H]3OCC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000578863549 468270993 /nfs/dbraw/zinc/27/09/93/468270993.db2.gz QIZOHVWUUDPPMN-IOASZLSFSA-N 1 1 333.388 2.341 20 5 EEBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000074317638 462585139 /nfs/dbraw/zinc/58/51/39/462585139.db2.gz PRMCJIBVNLAFHO-HNNXBMFYSA-N 1 1 331.416 2.328 20 5 EEBDMO COC(=O)CC[N@@H+]1CCN(c2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000089265854 462659659 /nfs/dbraw/zinc/65/96/59/462659659.db2.gz XUUPAGOWTCTSEZ-NSHDSACASA-N 1 1 341.795 2.322 20 5 EEBDMO COC(=O)CC[N@H+]1CCN(c2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000089265854 462659664 /nfs/dbraw/zinc/65/96/64/462659664.db2.gz XUUPAGOWTCTSEZ-NSHDSACASA-N 1 1 341.795 2.322 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)CC[C@@H]21 ZINC000153960284 462714584 /nfs/dbraw/zinc/71/45/84/462714584.db2.gz ZWKOCDLNHNZTEG-ABAIWWIYSA-N 1 1 343.387 2.027 20 5 EEBDMO C[N@@H+]1CCC[C@@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)CC[C@@H]21 ZINC000153960284 462714588 /nfs/dbraw/zinc/71/45/88/462714588.db2.gz ZWKOCDLNHNZTEG-ABAIWWIYSA-N 1 1 343.387 2.027 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)CC[C@@H]21 ZINC000153960284 462714591 /nfs/dbraw/zinc/71/45/91/462714591.db2.gz ZWKOCDLNHNZTEG-ABAIWWIYSA-N 1 1 343.387 2.027 20 5 EEBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N ZINC000154239454 462745035 /nfs/dbraw/zinc/74/50/35/462745035.db2.gz FXNHFIRCEFEROD-CYBMUJFWSA-N 1 1 334.420 2.417 20 5 EEBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000047264462 462761209 /nfs/dbraw/zinc/76/12/09/462761209.db2.gz MLAUVZFDFBSZRY-GOEBONIOSA-N 1 1 332.404 2.017 20 5 EEBDMO CC[C@@H](O)C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccccc1 ZINC000090564452 462798894 /nfs/dbraw/zinc/79/88/94/462798894.db2.gz AOIQXGWNUFZDCN-QGZVFWFLSA-N 1 1 345.399 2.030 20 5 EEBDMO COc1ccc(C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)cc1 ZINC000015142182 462943682 /nfs/dbraw/zinc/94/36/82/462943682.db2.gz SHGYNQZZXOJZAO-UHFFFAOYSA-N 1 1 328.372 2.321 20 5 EEBDMO C[C@@H]1C[NH+](C[C@H](O)COc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)O1 ZINC000120228746 462975704 /nfs/dbraw/zinc/97/57/04/462975704.db2.gz YVQPJXUNIRMMAH-WZRBSPASSA-N 1 1 344.795 2.097 20 5 EEBDMO Cc1nn(C)c(NCc2ccccc2C[NH+]2CCOCC2)c1[N+](=O)[O-] ZINC000051421506 463036075 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EEBDMO O=C(CCN1CC[C@@H](C[NH+]2CCCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000150819445 463434252 /nfs/dbraw/zinc/43/42/52/463434252.db2.gz ZNPWKRJJPKOOBC-HNNXBMFYSA-N 1 1 346.431 2.341 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(NC(N)=O)CC1 ZINC000081541703 463456887 /nfs/dbraw/zinc/45/68/87/463456887.db2.gz FYSVMWPSYGDBON-UHFFFAOYSA-N 1 1 336.392 2.015 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@]2(CNC(=O)C2)C1 ZINC000072833304 463553028 /nfs/dbraw/zinc/55/30/28/463553028.db2.gz OCUUASGBAJWFOX-SFHVURJKSA-N 1 1 347.415 2.484 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@]2(CNC(=O)C2)C1 ZINC000072833304 463553032 /nfs/dbraw/zinc/55/30/32/463553032.db2.gz OCUUASGBAJWFOX-SFHVURJKSA-N 1 1 347.415 2.484 20 5 EEBDMO Cc1c(Br)c(NC[C@@H]2CC[N@H+](C)C2)ncc1[N+](=O)[O-] ZINC000165725223 463646829 /nfs/dbraw/zinc/64/68/29/463646829.db2.gz GRJCMDONESYJFG-VIFPVBQESA-N 1 1 329.198 2.424 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCCC[C@@H]2CCO)cccc1[N+](=O)[O-] ZINC000112583086 463704128 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EEBDMO C[C@@H](c1ccsc1)[NH+]1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 ZINC000185462650 463828452 /nfs/dbraw/zinc/82/84/52/463828452.db2.gz QNQQLCPEPXGOPP-ZDUSSCGKSA-N 1 1 335.433 2.232 20 5 EEBDMO C[N@@H+](CCCO)C1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000283295460 463836453 /nfs/dbraw/zinc/83/64/53/463836453.db2.gz YDGHPUDGUFIDSH-UHFFFAOYSA-N 1 1 325.384 2.013 20 5 EEBDMO Cc1ccc(C(=O)N2CC[NH2+]C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000261764286 463852287 /nfs/dbraw/zinc/85/22/87/463852287.db2.gz OHVUJQICLUUAPP-MRXNPFEDSA-N 1 1 326.356 2.085 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C2OCCO2)C1 ZINC000171378165 463853572 /nfs/dbraw/zinc/85/35/72/463853572.db2.gz UZUHJZAGYWJKIU-STQMWFEESA-N 1 1 349.387 2.007 20 5 EEBDMO Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCC[C@@H]1CCC[N@H+]1C ZINC000185730770 463870091 /nfs/dbraw/zinc/87/00/91/463870091.db2.gz XBXLQABBMIUTFW-NSHDSACASA-N 1 1 348.428 2.418 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@]12CCOC2=O ZINC000186641917 464039748 /nfs/dbraw/zinc/03/97/48/464039748.db2.gz NFHKXVWLLZJAGQ-QGZVFWFLSA-N 1 1 347.371 2.013 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@]12CCOC2=O ZINC000186641917 464039753 /nfs/dbraw/zinc/03/97/53/464039753.db2.gz NFHKXVWLLZJAGQ-QGZVFWFLSA-N 1 1 347.371 2.013 20 5 EEBDMO CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000591016412 468392548 /nfs/dbraw/zinc/39/25/48/468392548.db2.gz NEFARQKHKFGOFW-WBVHZDCISA-N 1 1 346.431 2.482 20 5 EEBDMO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000591016412 468392554 /nfs/dbraw/zinc/39/25/54/468392554.db2.gz NEFARQKHKFGOFW-WBVHZDCISA-N 1 1 346.431 2.482 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000591016412 468392559 /nfs/dbraw/zinc/39/25/59/468392559.db2.gz NEFARQKHKFGOFW-WBVHZDCISA-N 1 1 346.431 2.482 20 5 EEBDMO CC(C)n1cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000179819170 464193650 /nfs/dbraw/zinc/19/36/50/464193650.db2.gz NXVNMUPLYQRAFC-CQSZACIVSA-N 1 1 330.392 2.454 20 5 EEBDMO CC(C)n1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000179819170 464193658 /nfs/dbraw/zinc/19/36/58/464193658.db2.gz NXVNMUPLYQRAFC-CQSZACIVSA-N 1 1 330.392 2.454 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)c1 ZINC000284458763 464199427 /nfs/dbraw/zinc/19/94/27/464199427.db2.gz RTOYBXYSNZNQAU-NHYWBVRUSA-N 1 1 333.388 2.206 20 5 EEBDMO COc1cc(C[N@@H+]2CCC[C@@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000179912014 464208217 /nfs/dbraw/zinc/20/82/17/464208217.db2.gz SMVXKRSWWOUMCD-LLVKDONJSA-N 1 1 346.330 2.204 20 5 EEBDMO COc1cc(C[N@H+]2CCC[C@@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000179912014 464208223 /nfs/dbraw/zinc/20/82/23/464208223.db2.gz SMVXKRSWWOUMCD-LLVKDONJSA-N 1 1 346.330 2.204 20 5 EEBDMO CN(CC[C@H]1CCCC[N@H+]1C)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000173665102 464305547 /nfs/dbraw/zinc/30/55/47/464305547.db2.gz AVXBFSIMROFGDP-CYBMUJFWSA-N 1 1 341.433 2.090 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000173714331 464309909 /nfs/dbraw/zinc/30/99/09/464309909.db2.gz ZSCSLUOPZSZSBB-CQSZACIVSA-N 1 1 334.420 2.468 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCCC[C@H]2[C@@H](C)O)cccc1[N+](=O)[O-] ZINC000264461370 464335600 /nfs/dbraw/zinc/33/56/00/464335600.db2.gz VDWTYPRCOCWQDD-CJNGLKHVSA-N 1 1 335.404 2.467 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000281201465 464368029 /nfs/dbraw/zinc/36/80/29/464368029.db2.gz PJEZGPNMMSJWLK-ZDUSSCGKSA-N 1 1 341.433 2.008 20 5 EEBDMO CCC(CC)NC(=O)[C@@H](C)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245440676 464482802 /nfs/dbraw/zinc/48/28/02/464482802.db2.gz GSLXLYUBNHIKNO-TZMCWYRMSA-N 1 1 349.435 2.169 20 5 EEBDMO CCC(CC)NC(=O)[C@@H](C)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245440676 464482805 /nfs/dbraw/zinc/48/28/05/464482805.db2.gz GSLXLYUBNHIKNO-TZMCWYRMSA-N 1 1 349.435 2.169 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1 ZINC000281507905 464483592 /nfs/dbraw/zinc/48/35/92/464483592.db2.gz IJHACHSIFNPLNE-ZIAGYGMSSA-N 1 1 347.415 2.414 20 5 EEBDMO COc1cc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc([N+](=O)[O-])c1C ZINC000189498068 464519719 /nfs/dbraw/zinc/51/97/19/464519719.db2.gz SOFLHQDRKGKSLH-ZFWWWQNUSA-N 1 1 347.415 2.468 20 5 EEBDMO O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000272474039 464624489 /nfs/dbraw/zinc/62/44/89/464624489.db2.gz FBQJNSMVFYHXRX-CQSZACIVSA-N 1 1 333.388 2.391 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+](C2CC2)C[C@H](C)C1 ZINC000294952353 464661286 /nfs/dbraw/zinc/66/12/86/464661286.db2.gz AWYCAKFIFBBWHU-ZIAGYGMSSA-N 1 1 346.431 2.338 20 5 EEBDMO COC[C@@]1(C(=O)OC)CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000295120224 464712471 /nfs/dbraw/zinc/71/24/71/464712471.db2.gz IREVXHBTRMNJRG-SUMWQHHRSA-N 1 1 336.388 2.476 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000295159819 464727350 /nfs/dbraw/zinc/72/73/50/464727350.db2.gz QLLRXWPJWDZESS-GXTWGEPZSA-N 1 1 345.399 2.299 20 5 EEBDMO C[C@]1(F)C[NH2+]CCN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000295180225 464735083 /nfs/dbraw/zinc/73/50/83/464735083.db2.gz HINMBVHBHBGMFP-ZDUSSCGKSA-N 1 1 349.284 2.387 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1ccccn1 ZINC000295257829 464765323 /nfs/dbraw/zinc/76/53/23/464765323.db2.gz ZYMNHVLDYHHRJG-UHFFFAOYSA-N 1 1 344.371 2.459 20 5 EEBDMO C[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC(C)(C)CO ZINC000295264333 464766002 /nfs/dbraw/zinc/76/60/02/464766002.db2.gz RPCAIVVGTGMSAM-UHFFFAOYSA-N 1 1 329.784 2.137 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC(C)(C)CO ZINC000295264333 464766005 /nfs/dbraw/zinc/76/60/05/464766005.db2.gz RPCAIVVGTGMSAM-UHFFFAOYSA-N 1 1 329.784 2.137 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCO[C@H]3CCCCO3)C2)nc1 ZINC000248834330 464808595 /nfs/dbraw/zinc/80/85/95/464808595.db2.gz NLMPAQYFMFGHTM-CJNGLKHVSA-N 1 1 336.392 2.019 20 5 EEBDMO C[C@@H](O)[C@H]1CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000183185384 464816309 /nfs/dbraw/zinc/81/63/09/464816309.db2.gz IVSAVWMNFQHNJT-WZRBSPASSA-N 1 1 332.360 2.409 20 5 EEBDMO C[C@H]1CSCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000248957096 464823957 /nfs/dbraw/zinc/82/39/57/464823957.db2.gz BQKCCGXXAMDJOS-DOMZBBRYSA-N 1 1 335.429 2.385 20 5 EEBDMO CN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000286227780 464847715 /nfs/dbraw/zinc/84/77/15/464847715.db2.gz SQVJPKZAGDMDOE-AWEZNQCLSA-N 1 1 343.387 2.055 20 5 EEBDMO CC[N@H+]1CCN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000286271673 464863608 /nfs/dbraw/zinc/86/36/08/464863608.db2.gz BIOJRYQCKJPXEN-NSHDSACASA-N 1 1 340.811 2.213 20 5 EEBDMO C[N@@H+](CCNC(=O)c1cccc([N+](=O)[O-])c1N)Cc1ccc(F)cc1 ZINC000177064064 464920536 /nfs/dbraw/zinc/92/05/36/464920536.db2.gz MOVWGYPYOJZMOA-UHFFFAOYSA-N 1 1 346.362 2.178 20 5 EEBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](C(F)(F)F)[C@H](CO)C2)c1 ZINC000286618964 464981826 /nfs/dbraw/zinc/98/18/26/464981826.db2.gz RYBXPBFPWCVJIV-SMDDNHRTSA-N 1 1 348.321 2.466 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000282908677 464997511 /nfs/dbraw/zinc/99/75/11/464997511.db2.gz YKSPRMOYAHWJRT-SUMWQHHRSA-N 1 1 346.431 2.261 20 5 EEBDMO COc1cc(C[N@@H+]2C[C@H](C)[C@H](O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000351814858 465376873 /nfs/dbraw/zinc/37/68/73/465376873.db2.gz UXAHIDYCIUXVFB-GZMMTYOYSA-N 1 1 332.303 2.017 20 5 EEBDMO COc1cc(C[N@H+]2C[C@H](C)[C@H](O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000351814858 465376878 /nfs/dbraw/zinc/37/68/78/465376878.db2.gz UXAHIDYCIUXVFB-GZMMTYOYSA-N 1 1 332.303 2.017 20 5 EEBDMO O=C(C[N@@H+]1CC[C@H](CC2CC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000339684196 465441799 /nfs/dbraw/zinc/44/17/99/465441799.db2.gz QVEUFAAVPFPEFX-GFCCVEGCSA-N 1 1 347.371 2.384 20 5 EEBDMO O=C(C[N@H+]1CC[C@H](CC2CC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000339684196 465441805 /nfs/dbraw/zinc/44/18/05/465441805.db2.gz QVEUFAAVPFPEFX-GFCCVEGCSA-N 1 1 347.371 2.384 20 5 EEBDMO CC[N@H+](Cc1ccncc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000298707019 465478182 /nfs/dbraw/zinc/47/81/82/465478182.db2.gz YCHNEXFSKQYABA-MRXNPFEDSA-N 1 1 331.372 2.252 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000357043710 465722445 /nfs/dbraw/zinc/72/24/45/465722445.db2.gz RDXIOMQYIGIPSN-VXGBXAGGSA-N 1 1 331.376 2.169 20 5 EEBDMO Cc1c(NC(=O)CCN2C[C@@H](C)[N@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000330597781 465724436 /nfs/dbraw/zinc/72/44/36/465724436.db2.gz SNOIAUKCNWGAGI-OLZOCXBDSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2C[C@@H](C)N(C)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000330597781 465724447 /nfs/dbraw/zinc/72/44/47/465724447.db2.gz SNOIAUKCNWGAGI-OLZOCXBDSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@@H](C)N(C)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000330597781 465724453 /nfs/dbraw/zinc/72/44/53/465724453.db2.gz SNOIAUKCNWGAGI-OLZOCXBDSA-N 1 1 334.420 2.256 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)c1 ZINC000344675508 465771650 /nfs/dbraw/zinc/77/16/50/465771650.db2.gz SDUIRXNZXAGJHN-HNNXBMFYSA-N 1 1 335.404 2.454 20 5 EEBDMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CC[N@@H+](CCOC)C1 ZINC000361210838 465838321 /nfs/dbraw/zinc/83/83/21/465838321.db2.gz DETAIUZNKVEXCE-HOTGVXAUSA-N 1 1 349.431 2.000 20 5 EEBDMO CCc1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000366725653 465898414 /nfs/dbraw/zinc/89/84/14/465898414.db2.gz TVGSRTNOHJKYNR-ZDUSSCGKSA-N 1 1 349.435 2.407 20 5 EEBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H]1CCC[N@H+](C(C)C)C1 ZINC000331028343 465903278 /nfs/dbraw/zinc/90/32/78/465903278.db2.gz CZRCEWBYVCVGMU-ZDUSSCGKSA-N 1 1 341.433 2.054 20 5 EEBDMO O=[N+]([O-])c1ccccc1CCNc1cc[nH+]c(N2CCCCC2)n1 ZINC000548722847 468460454 /nfs/dbraw/zinc/46/04/54/468460454.db2.gz ODERZZPELHXFFX-UHFFFAOYSA-N 1 1 327.388 3.030 20 5 EEBDMO Cc1ccc(S(=O)(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000331063935 465919301 /nfs/dbraw/zinc/91/93/01/465919301.db2.gz WLMJCVVZAATCOG-CYBMUJFWSA-N 1 1 341.433 2.054 20 5 EEBDMO C[N@@H+](CCCO)C1CCN(C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000353481229 465919435 /nfs/dbraw/zinc/91/94/35/465919435.db2.gz IOPYEQCYKXJQIS-DAXSKMNVSA-N 1 1 333.432 2.387 20 5 EEBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000301456621 465966761 /nfs/dbraw/zinc/96/67/61/465966761.db2.gz MYVOIOHQRAYHHE-ZDUSSCGKSA-N 1 1 334.420 2.265 20 5 EEBDMO C[C@@H](CN1CCOCC1)[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000331225386 465987163 /nfs/dbraw/zinc/98/71/63/465987163.db2.gz FAGRXRBYAUNTAO-LBPRGKRZSA-N 1 1 327.812 2.401 20 5 EEBDMO C[C@@H](CN1CCOCC1)[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000331225386 465987167 /nfs/dbraw/zinc/98/71/67/465987167.db2.gz FAGRXRBYAUNTAO-LBPRGKRZSA-N 1 1 327.812 2.401 20 5 EEBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000346209461 465993463 /nfs/dbraw/zinc/99/34/63/465993463.db2.gz XSJJYTNSIDSMSW-VBQJREDUSA-N 1 1 346.431 2.195 20 5 EEBDMO CC[N@@H+](CCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)C(C)C ZINC000362763969 466008504 /nfs/dbraw/zinc/00/85/04/466008504.db2.gz XXDVWRGCMRUGKE-UHFFFAOYSA-N 1 1 329.347 2.262 20 5 EEBDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000331288748 466014040 /nfs/dbraw/zinc/01/40/40/466014040.db2.gz NLXYRMCKUPUGLZ-DVOMOZLQSA-N 1 1 335.404 2.039 20 5 EEBDMO CC[C@@H]1C[N@H+](C)CCCN1S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000349666826 466182819 /nfs/dbraw/zinc/18/28/19/466182819.db2.gz OQRCPMFORMGYJN-LLVKDONJSA-N 1 1 347.462 2.070 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000349666826 466182822 /nfs/dbraw/zinc/18/28/22/466182822.db2.gz OQRCPMFORMGYJN-LLVKDONJSA-N 1 1 347.462 2.070 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[N@@H+](CC)C2)c1 ZINC000338552983 466216711 /nfs/dbraw/zinc/21/67/11/466216711.db2.gz ZBCIRNBHOKCXAB-ZDUSSCGKSA-N 1 1 335.404 2.455 20 5 EEBDMO C[C@@H](c1ccsc1)[NH+]1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1 ZINC000332090120 466380482 /nfs/dbraw/zinc/38/04/82/466380482.db2.gz LUJJVQZHKYZDNH-LBPRGKRZSA-N 1 1 335.433 2.269 20 5 EEBDMO CC(C)[NH+]1CCC(O)(CNCc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000350247501 466438856 /nfs/dbraw/zinc/43/88/56/466438856.db2.gz KWQLAZXNRBKOLB-UHFFFAOYSA-N 1 1 325.384 2.059 20 5 EEBDMO COC(=O)c1cnc(NC[C@H](C)[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000358150396 466496165 /nfs/dbraw/zinc/49/61/65/466496165.db2.gz MZYWVOXEIJOWDJ-NEPJUHHUSA-N 1 1 336.392 2.451 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])o1)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000373440713 466804264 /nfs/dbraw/zinc/80/42/64/466804264.db2.gz DXGCACHJQWENTB-GASCZTMLSA-N 1 1 341.367 2.392 20 5 EEBDMO Cn1cc[nH+]c1C[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3nonc32)C1 ZINC000370643296 466951457 /nfs/dbraw/zinc/95/14/57/466951457.db2.gz IRWJVIMJVMIEKG-NSHDSACASA-N 1 1 342.359 2.324 20 5 EEBDMO C[C@@H]1C[C@H](O)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000412028502 466969981 /nfs/dbraw/zinc/96/99/81/466969981.db2.gz BHWWJSZDPJWYMZ-DOMZBBRYSA-N 1 1 331.372 2.495 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000412084872 467001154 /nfs/dbraw/zinc/00/11/54/467001154.db2.gz YWNXWBAWNZNKTI-SJKOYZFVSA-N 1 1 349.387 2.197 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000412084872 467001157 /nfs/dbraw/zinc/00/11/57/467001157.db2.gz YWNXWBAWNZNKTI-SJKOYZFVSA-N 1 1 349.387 2.197 20 5 EEBDMO CC(C)[N@H+]1CCCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000428244123 467215781 /nfs/dbraw/zinc/21/57/81/467215781.db2.gz ONOBNACBSQFVIB-KRWDZBQOSA-N 1 1 346.431 2.116 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCNc2nc3ccccc3cc2[N+](=O)[O-])CCCO1 ZINC000432875744 467271376 /nfs/dbraw/zinc/27/13/76/467271376.db2.gz HDQIDZVNQGGTKC-CQSZACIVSA-N 1 1 344.415 3.056 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)C[C@@H]1C ZINC000430785028 467466409 /nfs/dbraw/zinc/46/64/09/467466409.db2.gz SNFOSYDQZICHIU-KBPBESRZSA-N 1 1 335.404 2.223 20 5 EEBDMO C[C@H]1CC[C@@H](C(=O)OC(C)(C)C)C[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000420924511 467515936 /nfs/dbraw/zinc/51/59/36/467515936.db2.gz JZIKUKMGUCDMLO-QWHCGFSZSA-N 1 1 338.408 2.234 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]CCC(C)(C)CO)c1cccc([N+](=O)[O-])c1 ZINC000449408021 467640129 /nfs/dbraw/zinc/64/01/29/467640129.db2.gz KWPADYSJXGACFA-HNNXBMFYSA-N 1 1 332.404 2.416 20 5 EEBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C(=O)NCCc1ccccc1 ZINC000449578268 467664913 /nfs/dbraw/zinc/66/49/13/467664913.db2.gz JSZMYLIPKDDQJU-LBPRGKRZSA-N 1 1 333.413 2.493 20 5 EEBDMO C[N@H+]1CCC[C@H](CCNC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000458161539 467779939 /nfs/dbraw/zinc/77/99/39/467779939.db2.gz HHKUPVUKOLTXCC-CQSZACIVSA-N 1 1 334.420 2.245 20 5 EEBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2N[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000450351794 467833941 /nfs/dbraw/zinc/83/39/41/467833941.db2.gz ABSIFOOKRVNYAR-VXGBXAGGSA-N 1 1 330.388 2.468 20 5 EEBDMO C[C@H]1C[N@@H+](CCCNC(=O)/C=C/c2cccc([N+](=O)[O-])c2)CCCO1 ZINC000493352096 467892639 /nfs/dbraw/zinc/89/26/39/467892639.db2.gz MIHMKKAZVVSWMZ-KIUWMYQTSA-N 1 1 347.415 2.225 20 5 EEBDMO C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000487225035 468029578 /nfs/dbraw/zinc/02/95/78/468029578.db2.gz VXMLCWGKIYGDCE-MFKMUULPSA-N 1 1 325.796 2.105 20 5 EEBDMO CO[C@@H]1C[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1OC ZINC000488091455 468071380 /nfs/dbraw/zinc/07/13/80/468071380.db2.gz MQMKCYRZXHAIRS-ZLKJLUDKSA-N 1 1 348.359 2.051 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](CN2CCOC2=O)C1 ZINC000496290943 468144886 /nfs/dbraw/zinc/14/48/86/468144886.db2.gz FBJASPZSJCQTRP-CYBMUJFWSA-N 1 1 349.387 2.268 20 5 EEBDMO C[N@H+]1CCCC[C@@H](CNC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000600310103 468529039 /nfs/dbraw/zinc/52/90/39/468529039.db2.gz GLAAKQBMAOBLTN-AWEZNQCLSA-N 1 1 335.404 2.212 20 5 EEBDMO CNc1c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-] ZINC000594418836 468579353 /nfs/dbraw/zinc/57/93/53/468579353.db2.gz MFMHRGDZZQDXLU-ZIAGYGMSSA-N 1 1 332.404 2.383 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]2OCC[C@@H]2C1 ZINC000582724140 468584482 /nfs/dbraw/zinc/58/44/82/468584482.db2.gz AQFSWRPBSSCWKX-DOMZBBRYSA-N 1 1 349.387 2.043 20 5 EEBDMO CNC(=O)c1ccc(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000594596943 468631086 /nfs/dbraw/zinc/63/10/86/468631086.db2.gz BJSOGHUFGDXHPP-HIFRSBDPSA-N 1 1 332.404 2.383 20 5 EEBDMO COc1c(C(=O)N2CCC[C@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000597709754 468647105 /nfs/dbraw/zinc/64/71/05/468647105.db2.gz BDEYQYMEIWTDBY-QGZVFWFLSA-N 1 1 333.388 2.161 20 5 EEBDMO C[C@H]1CC2(C[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CCOCC2 ZINC000592182943 468647862 /nfs/dbraw/zinc/64/78/62/468647862.db2.gz DSJHJSVENWSGSJ-AWEZNQCLSA-N 1 1 347.415 2.449 20 5 EEBDMO C[C@@H](Nc1ccnc2ccc([N+](=O)[O-])cc21)[C@@H](C)[NH+]1CCOCC1 ZINC000601113915 468745215 /nfs/dbraw/zinc/74/52/15/468745215.db2.gz JITNXDKERPHEFY-CHWSQXEVSA-N 1 1 330.388 2.086 20 5 EEBDMO COCCn1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cn1 ZINC000595038476 468746911 /nfs/dbraw/zinc/74/69/11/468746911.db2.gz KIMUUOKCMWUZDX-GFCCVEGCSA-N 1 1 334.376 2.297 20 5 EEBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)c1c2c(ccc1[N+](=O)[O-])NCC2 ZINC000584269433 468831031 /nfs/dbraw/zinc/83/10/31/468831031.db2.gz IHAHJPZWIBZMQY-UHFFFAOYSA-N 1 1 334.420 2.110 20 5 EEBDMO CN(CC[N@H+]1CCOC(C)(C)C1)c1c2c(ccc1[N+](=O)[O-])NCC2 ZINC000584269433 468831035 /nfs/dbraw/zinc/83/10/35/468831035.db2.gz IHAHJPZWIBZMQY-UHFFFAOYSA-N 1 1 334.420 2.110 20 5 EEBDMO CCOc1cc(N2CCN(C[C@H]3CCC[N@H+]3C)CC2)ccc1[N+](=O)[O-] ZINC000593029768 468845488 /nfs/dbraw/zinc/84/54/88/468845488.db2.gz WLOWCGRSFQRQHK-MRXNPFEDSA-N 1 1 348.447 2.210 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000601705295 468975366 /nfs/dbraw/zinc/97/53/66/468975366.db2.gz LCRVDLPQUDWMAD-UKRRQHHQSA-N 1 1 342.399 2.421 20 5 EEBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)CC1=CCCOC1 ZINC000595747952 468984845 /nfs/dbraw/zinc/98/48/45/468984845.db2.gz QQAGZTLLRFOJPX-UHFFFAOYSA-N 1 1 347.371 2.171 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CCN1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000602760504 469057939 /nfs/dbraw/zinc/05/79/39/469057939.db2.gz PZUUMGVEYNHDRF-UHFFFAOYSA-N 1 1 343.431 2.308 20 5 EEBDMO CC[N@H+]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@H]1C ZINC000611092018 469160657 /nfs/dbraw/zinc/16/06/57/469160657.db2.gz GQJGIJIUZRPLFS-CQSZACIVSA-N 1 1 334.420 2.258 20 5 EEBDMO CCN1CC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@H]1C ZINC000611092018 469160661 /nfs/dbraw/zinc/16/06/61/469160661.db2.gz GQJGIJIUZRPLFS-CQSZACIVSA-N 1 1 334.420 2.258 20 5 EEBDMO CCN1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@H]1C ZINC000611092018 469160666 /nfs/dbraw/zinc/16/06/66/469160666.db2.gz GQJGIJIUZRPLFS-CQSZACIVSA-N 1 1 334.420 2.258 20 5 EEBDMO NC(=O)c1cc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000596169050 469184715 /nfs/dbraw/zinc/18/47/15/469184715.db2.gz DHYQJKQAVKDWTN-LRDDRELGSA-N 1 1 344.415 2.147 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H]([C@@H]3CCOC3)C1)OCCO2 ZINC000611274777 469217299 /nfs/dbraw/zinc/21/72/99/469217299.db2.gz GABUIIPTAPJLLH-QWHCGFSZSA-N 1 1 334.372 2.224 20 5 EEBDMO CC1(C)C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]1c1ccncc1 ZINC000596591707 469308628 /nfs/dbraw/zinc/30/86/28/469308628.db2.gz KDDMQDUYWPOVKE-MRXNPFEDSA-N 1 1 328.372 2.235 20 5 EEBDMO CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]1c1ccncc1 ZINC000596591707 469308630 /nfs/dbraw/zinc/30/86/30/469308630.db2.gz KDDMQDUYWPOVKE-MRXNPFEDSA-N 1 1 328.372 2.235 20 5 EEBDMO C[C@H](CS(C)(=O)=O)[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602546957 469356193 /nfs/dbraw/zinc/35/61/93/469356193.db2.gz VKAWUDHRVJQNEX-MRVPVSSYSA-N 1 1 340.323 2.136 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000616118379 469374290 /nfs/dbraw/zinc/37/42/90/469374290.db2.gz KWGJMZJPEFXLDK-SWLSCSKDSA-N 1 1 336.392 2.052 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1 ZINC000616118379 469374295 /nfs/dbraw/zinc/37/42/95/469374295.db2.gz KWGJMZJPEFXLDK-SWLSCSKDSA-N 1 1 336.392 2.052 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC2(CCC[N@@H+]2C)CC1 ZINC000612117386 469399258 /nfs/dbraw/zinc/39/92/58/469399258.db2.gz JGNVQYCANFTHEO-UHFFFAOYSA-N 1 1 346.431 2.402 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[NH2+][C@@H](CO)c2cccc(Cl)c2Cl)n1 ZINC000595828292 485609363 /nfs/dbraw/zinc/60/93/63/485609363.db2.gz JXRKINIZGWBDRO-NSHDSACASA-N 1 1 345.186 2.421 20 5 EEBDMO O=C1O[C@@H](C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC12CCC2 ZINC000191884685 534819736 /nfs/dbraw/zinc/81/97/36/534819736.db2.gz XBLKEWMRHHDKLT-MRXNPFEDSA-N 1 1 345.399 2.203 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2cnn(CC[N@@H+]3C[C@H]4CC[C@@H](C3)O4)c2)cc1 ZINC000418864013 534881257 /nfs/dbraw/zinc/88/12/57/534881257.db2.gz HYZJUNHTCNUGNI-CALCHBBNSA-N 1 1 328.372 2.322 20 5 EEBDMO CC1([C@@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)OCCO1 ZINC000183833335 528053059 /nfs/dbraw/zinc/05/30/59/528053059.db2.gz JMUVCPWKHSKKHB-CQSZACIVSA-N 1 1 336.388 2.449 20 5 EEBDMO COC(=O)C[C@]1([NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])CCOC1 ZINC000494701215 536363390 /nfs/dbraw/zinc/36/33/90/536363390.db2.gz CSKWSWDWNMFBJX-CQSZACIVSA-N 1 1 328.752 2.060 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCS(=O)(=O)C3)o2)cc1 ZINC000728775179 576525686 /nfs/dbraw/zinc/52/56/86/576525686.db2.gz UJPODVSXASKDIG-GFCCVEGCSA-N 1 1 336.369 2.132 20 5 EEBDMO COC(=O)c1cc(C[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)oc1C ZINC000776274003 577456201 /nfs/dbraw/zinc/45/62/01/577456201.db2.gz FYWIMGXIQWJTJU-MRXNPFEDSA-N 1 1 348.355 2.448 20 5 EEBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000769144100 577571100 /nfs/dbraw/zinc/57/11/00/577571100.db2.gz GUGPVIUEWNMEIX-ZIAGYGMSSA-N 1 1 346.431 2.360 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000769144100 577571101 /nfs/dbraw/zinc/57/11/01/577571101.db2.gz GUGPVIUEWNMEIX-ZIAGYGMSSA-N 1 1 346.431 2.360 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCOCC4(CCC4)C3)n2)c1 ZINC000758988510 577634897 /nfs/dbraw/zinc/63/48/97/577634897.db2.gz SWEMGMPRUHDVAZ-UHFFFAOYSA-N 1 1 343.387 2.313 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCOCC4(CCC4)C3)n2)c1 ZINC000758988510 577634898 /nfs/dbraw/zinc/63/48/98/577634898.db2.gz SWEMGMPRUHDVAZ-UHFFFAOYSA-N 1 1 343.387 2.313 20 5 EEBDMO O=C1CN(C[N@H+]2CC[C@@H](C3CC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000763332413 577719255 /nfs/dbraw/zinc/71/92/55/577719255.db2.gz LPORZAZVVHJHDI-CYBMUJFWSA-N 1 1 344.371 2.053 20 5 EEBDMO COC[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000752324425 577769126 /nfs/dbraw/zinc/76/91/26/577769126.db2.gz DNHJITNAEWFAEN-LLVKDONJSA-N 1 1 327.768 2.298 20 5 EEBDMO COC[C@H]1CCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000752324425 577769127 /nfs/dbraw/zinc/76/91/27/577769127.db2.gz DNHJITNAEWFAEN-LLVKDONJSA-N 1 1 327.768 2.298 20 5 EEBDMO COc1cc(N)c([N+](=O)[O-])cc1C(=O)OCCCCn1cc[nH+]c1C ZINC000753450021 577787688 /nfs/dbraw/zinc/78/76/88/577787688.db2.gz BOQKCUBQQWPTNT-UHFFFAOYSA-N 1 1 348.359 2.328 20 5 EEBDMO C[C@H]1C[C@@H](NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000742309581 577870825 /nfs/dbraw/zinc/87/08/25/577870825.db2.gz POIUPWOWXYRQFU-ONGXEEELSA-N 1 1 347.824 2.009 20 5 EEBDMO CC(C)(O)C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CCOCC1 ZINC000750048182 577986151 /nfs/dbraw/zinc/98/61/51/577986151.db2.gz UNZRJIGBDPKHDK-UHFFFAOYSA-N 1 1 326.368 2.486 20 5 EEBDMO Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(Cl)c1 ZINC001022064052 676628638 /nfs/dbraw/zinc/62/86/38/676628638.db2.gz SIHWMIPOIZOZMJ-QVHKTLOISA-N 1 1 337.807 2.050 20 5 EEBDMO CSCC(=O)N1CCC([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000985246014 686144707 /nfs/dbraw/zinc/14/47/07/686144707.db2.gz NAXYWEYCNPOFJN-UHFFFAOYSA-N 1 1 337.445 2.381 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCCC[N@H+]2CCCO[C@H](C)C2)c1C ZINC000897571357 691626766 /nfs/dbraw/zinc/62/67/66/691626766.db2.gz ONHQEVFOXJQLJO-CQSZACIVSA-N 1 1 349.431 2.442 20 5 EEBDMO O=[N+]([O-])CC[NH2+]Cc1cc(Br)ccc1OC(F)F ZINC000905078017 694516841 /nfs/dbraw/zinc/51/68/41/694516841.db2.gz BKZHMOLYXPKTKP-UHFFFAOYSA-N 1 1 325.109 2.417 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N(C)CCN(C)c1ccc(C)cc1[N+](=O)[O-] ZINC001105441773 1187158261 /nfs/dbraw/zinc/15/82/61/1187158261.db2.gz JSUGQNUYFXHTAQ-UHFFFAOYSA-N 1 1 336.436 2.140 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)N(C)CCN(C)c1ccc([N+](=O)[O-])c(C)c1 ZINC001105504869 1188123904 /nfs/dbraw/zinc/12/39/04/1188123904.db2.gz GDDZAWZRZXFMJU-UHFFFAOYSA-N 1 1 345.403 2.003 20 5 EEBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC000842348868 1188648002 /nfs/dbraw/zinc/64/80/02/1188648002.db2.gz MMIAXCPAWWGMMQ-OAGGEKHMSA-N 1 1 332.400 2.496 20 5 EEBDMO CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1OC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC000842348868 1188648004 /nfs/dbraw/zinc/64/80/04/1188648004.db2.gz MMIAXCPAWWGMMQ-OAGGEKHMSA-N 1 1 332.400 2.496 20 5 EEBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1OC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC000842348868 1188648005 /nfs/dbraw/zinc/64/80/05/1188648005.db2.gz MMIAXCPAWWGMMQ-OAGGEKHMSA-N 1 1 332.400 2.496 20 5 EEBDMO C[C@@H]1CN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000159428208 1188715920 /nfs/dbraw/zinc/71/59/20/1188715920.db2.gz QUIAYMFXDZMJNR-SNVBAGLBSA-N 1 1 328.210 2.493 20 5 EEBDMO CN(C(=O)c1cocn1)C1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001005167729 1194660103 /nfs/dbraw/zinc/66/01/03/1194660103.db2.gz PXQUZJJIELRPAD-UHFFFAOYSA-N 1 1 344.371 2.319 20 5 EEBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1C[N@H+](C)CCN1C ZINC000872036686 1198032042 /nfs/dbraw/zinc/03/20/42/1198032042.db2.gz VFQSJPQCHZKGKE-JSGCOSHPSA-N 1 1 338.477 2.213 20 5 EEBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1C[N@@H+](C)CCN1C 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ZINC000245543954 160240626 /nfs/dbraw/zinc/24/06/26/160240626.db2.gz KYPHBBLWOPAELW-CZUORRHYSA-N 1 1 335.404 2.406 20 5 EEBDMO CC[N@@H+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000341771903 161012281 /nfs/dbraw/zinc/01/22/81/161012281.db2.gz JLMWNVMWXQSNOQ-GFCCVEGCSA-N 1 1 332.404 2.335 20 5 EEBDMO CC[N@H+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000341771903 161012282 /nfs/dbraw/zinc/01/22/82/161012282.db2.gz JLMWNVMWXQSNOQ-GFCCVEGCSA-N 1 1 332.404 2.335 20 5 EEBDMO COc1ccc(OCCN2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)c([N+](=O)[O-])c1 ZINC000342106114 161039835 /nfs/dbraw/zinc/03/98/35/161039835.db2.gz OUSVOUOAKKTCHB-QEJZJMRPSA-N 1 1 335.404 2.041 20 5 EEBDMO Cc1c(Br)c(=O)n(CC[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000342436226 161065308 /nfs/dbraw/zinc/06/53/08/161065308.db2.gz PLQHLKYPXRCAOM-UHFFFAOYSA-N 1 1 344.209 2.313 20 5 EEBDMO COc1ccc(NC(=O)C[N@H+](C)CC[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000342603282 161077215 /nfs/dbraw/zinc/07/72/15/161077215.db2.gz 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EEBDMO C[N@@H+](CCCNC(=O)C1CCC1)CCOc1cccc([N+](=O)[O-])c1 ZINC000429549871 467345129 /nfs/dbraw/zinc/34/51/29/467345129.db2.gz VMMMXJZCMIPMBE-UHFFFAOYSA-N 1 1 335.404 2.212 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(CN3CC[C@H]4C[NH2+]C[C@H]4CC3)n2)cc1 ZINC000420344463 467370535 /nfs/dbraw/zinc/37/05/35/467370535.db2.gz SVPAYBDMSFASHB-OKILXGFUSA-N 1 1 343.387 2.076 20 5 EEBDMO C[C@@H]1C[C@H](C[NH3+])CN1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000435372451 467463417 /nfs/dbraw/zinc/46/34/17/467463417.db2.gz RHEZVJROOACXFN-CHWSQXEVSA-N 1 1 329.404 2.164 20 5 EEBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)CC[N@H+]1C ZINC000450573310 467872652 /nfs/dbraw/zinc/87/26/52/467872652.db2.gz WYRKXXGYFHXNHC-NEPJUHHUSA-N 1 1 343.387 2.150 20 5 EEBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)CC[N@@H+]1C ZINC000450573310 467872656 /nfs/dbraw/zinc/87/26/56/467872656.db2.gz WYRKXXGYFHXNHC-NEPJUHHUSA-N 1 1 343.387 2.150 20 5 EEBDMO 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Cc1ccccc1OCC[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000731029956 577074156 /nfs/dbraw/zinc/07/41/56/577074156.db2.gz KKXJBRCJHZYVQC-UHFFFAOYSA-N 1 1 342.399 2.499 20 5 EEBDMO COC(=O)C[C@H]1CCC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000771866125 577235085 /nfs/dbraw/zinc/23/50/85/577235085.db2.gz CTABXSHNNVJMAM-MRXNPFEDSA-N 1 1 344.371 2.443 20 5 EEBDMO C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000774528379 577402323 /nfs/dbraw/zinc/40/23/23/577402323.db2.gz DMKJFTSNSSKVTB-GFCCVEGCSA-N 1 1 332.404 2.241 20 5 EEBDMO COC(C[N@H+](CCCO)Cc1ccc(Cl)c([N+](=O)[O-])c1)OC ZINC000759869751 577652682 /nfs/dbraw/zinc/65/26/82/577652682.db2.gz OKQDMBUCRNJUIW-UHFFFAOYSA-N 1 1 332.784 2.052 20 5 EEBDMO COC(C[N@@H+](CCCO)Cc1ccc(Cl)c([N+](=O)[O-])c1)OC ZINC000759869751 577652683 /nfs/dbraw/zinc/65/26/83/577652683.db2.gz OKQDMBUCRNJUIW-UHFFFAOYSA-N 1 1 332.784 2.052 20 5 EEBDMO O=[N+]([O-])c1c(N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)nc2ccccn21 ZINC000763375478 577720177 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O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cnn(CC(F)F)c3)nc2c1 ZINC000353225364 465728666 /nfs/dbraw/zinc/72/86/66/465728666.db2.gz DSZIYHAXEMXXDH-UHFFFAOYSA-N 1 1 336.302 2.223 20 5 EEBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000357228905 465873779 /nfs/dbraw/zinc/87/37/79/465873779.db2.gz ZCBYIVSJOYXIBA-GFCCVEGCSA-N 1 1 335.408 2.155 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]C[C@H]1CC[C@@H](O)C1)c1cccc([N+](=O)[O-])c1 ZINC000353681756 466063706 /nfs/dbraw/zinc/06/37/06/466063706.db2.gz BOGJYJGHZLACBK-APHBMKBZSA-N 1 1 330.388 2.168 20 5 EEBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000331768756 466237980 /nfs/dbraw/zinc/23/79/80/466237980.db2.gz JHXZIHKTYMSCFV-GFCCVEGCSA-N 1 1 344.371 2.015 20 5 EEBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000332072263 466372425 /nfs/dbraw/zinc/37/24/25/466372425.db2.gz XDQQPVQZAXSCON-LSDHHAIUSA-N 1 1 339.342 2.159 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](C)[C@@H]1CO ZINC000305457662 466410893 /nfs/dbraw/zinc/41/08/93/466410893.db2.gz ULTONUJWAOTMQA-CJNGLKHVSA-N 1 1 335.404 2.325 20 5 EEBDMO COCCCNC(=O)C[N@H+](C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000347351430 466585105 /nfs/dbraw/zinc/58/51/05/466585105.db2.gz FCTPHSLJOYYJEI-GXDHUFHOSA-N 1 1 335.404 2.083 20 5 EEBDMO COCCCNC(=O)C[N@@H+](C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000347351430 466585113 /nfs/dbraw/zinc/58/51/13/466585113.db2.gz FCTPHSLJOYYJEI-GXDHUFHOSA-N 1 1 335.404 2.083 20 5 EEBDMO COCC[N@@H+](CC(=O)N(C)C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000347369454 466594409 /nfs/dbraw/zinc/59/44/09/466594409.db2.gz ZLQMNRJYQTVDNP-UVTDQMKNSA-N 1 1 335.404 2.035 20 5 EEBDMO COCC[N@H+](CC(=O)N(C)C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000347369454 466594412 /nfs/dbraw/zinc/59/44/12/466594412.db2.gz ZLQMNRJYQTVDNP-UVTDQMKNSA-N 1 1 335.404 2.035 20 5 EEBDMO Cn1ccnc1[C@H](N[C@H]1CC[C@H](C[NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423508093 466761624 /nfs/dbraw/zinc/76/16/24/466761624.db2.gz NMMBXWZVWYOBSY-DUVNUKRYSA-N 1 1 329.404 2.135 20 5 EEBDMO COc1ccc(NC(=O)CC[N@@H+](C)[C@@H]2CCCOC2)c([N+](=O)[O-])c1 ZINC000411716541 466886534 /nfs/dbraw/zinc/88/65/34/466886534.db2.gz GLYVBKCOSWGDEO-GFCCVEGCSA-N 1 1 337.376 2.043 20 5 EEBDMO Cc1c(CC(=O)N2CC[NH2+]C[C@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000423939180 466920905 /nfs/dbraw/zinc/92/09/05/466920905.db2.gz AEVGGSGSGMNSKZ-KRWDZBQOSA-N 1 1 340.383 2.014 20 5 EEBDMO Cc1c(C(=O)N2CC[NH2+]C[C@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000423967834 466931615 /nfs/dbraw/zinc/93/16/15/466931615.db2.gz JOSPEGRKPXXWJV-INIZCTEOSA-N 1 1 326.356 2.085 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CCC([C@H]3[NH2+]CC3(C)C)CC2)c1[N+](=O)[O-] ZINC000424036411 466959892 /nfs/dbraw/zinc/95/98/92/466959892.db2.gz FALCQGMVPHWFGE-OAHLLOKOSA-N 1 1 349.435 2.121 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@@H]3CC[C@H](O)C[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000412031408 466972249 /nfs/dbraw/zinc/97/22/49/466972249.db2.gz AQSLZPATTPIPBA-XQLPTFJDSA-N 1 1 347.415 2.323 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000412084875 467001371 /nfs/dbraw/zinc/00/13/71/467001371.db2.gz YWNXWBAWNZNKTI-YVEFUNNKSA-N 1 1 349.387 2.197 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000412084875 467001376 /nfs/dbraw/zinc/00/13/76/467001376.db2.gz YWNXWBAWNZNKTI-YVEFUNNKSA-N 1 1 349.387 2.197 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)c1 ZINC000425553591 467109382 /nfs/dbraw/zinc/10/93/82/467109382.db2.gz TWDBIVMFBJZHGQ-HUUCEWRRSA-N 1 1 336.779 2.253 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)c1 ZINC000425553591 467109385 /nfs/dbraw/zinc/10/93/85/467109385.db2.gz TWDBIVMFBJZHGQ-HUUCEWRRSA-N 1 1 336.779 2.253 20 5 EEBDMO C[C@H]1C[N@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431934230 467203394 /nfs/dbraw/zinc/20/33/94/467203394.db2.gz CNBDYWLRZFCBRU-VIFPVBQESA-N 1 1 342.193 2.133 20 5 EEBDMO C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431934230 467203399 /nfs/dbraw/zinc/20/33/99/467203399.db2.gz CNBDYWLRZFCBRU-VIFPVBQESA-N 1 1 342.193 2.133 20 5 EEBDMO C[C@@H]1C[C@H]([NH+]2CCOCC2)CN1c1nccc2ccc([N+](=O)[O-])cc21 ZINC000413277433 467204038 /nfs/dbraw/zinc/20/40/38/467204038.db2.gz DUXCRYULTYHVFC-CJNGLKHVSA-N 1 1 342.399 2.442 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCSC[C@H]1C1CC1 ZINC000451645456 467263874 /nfs/dbraw/zinc/26/38/74/467263874.db2.gz AVJLLODIVUVSFD-HIFRSBDPSA-N 1 1 338.429 2.162 20 5 EEBDMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C12CCC2 ZINC000451860813 467275010 /nfs/dbraw/zinc/27/50/10/467275010.db2.gz XCNHTJIAPKKXEJ-CABCVRRESA-N 1 1 333.388 2.083 20 5 EEBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CCN(CCC(F)(F)F)CC1 ZINC000452108501 467326139 /nfs/dbraw/zinc/32/61/39/467326139.db2.gz FCPQAFGXSWLKEN-UHFFFAOYSA-N 1 1 349.357 2.140 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)NCCC[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000433861810 467359368 /nfs/dbraw/zinc/35/93/68/467359368.db2.gz FUGQGQIZHDVPFS-LBPRGKRZSA-N 1 1 337.424 2.436 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420347070 467373320 /nfs/dbraw/zinc/37/33/20/467373320.db2.gz ZXPMGKCKGNDNQG-KFWWJZLASA-N 1 1 346.431 2.243 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCOCC2(CCOCC2)C1 ZINC000430213232 467409090 /nfs/dbraw/zinc/40/90/90/467409090.db2.gz SKJQSKXVRVCXAK-UHFFFAOYSA-N 1 1 336.388 2.232 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCOCC2(CCOCC2)C1 ZINC000430213232 467409092 /nfs/dbraw/zinc/40/90/92/467409092.db2.gz SKJQSKXVRVCXAK-UHFFFAOYSA-N 1 1 336.388 2.232 20 5 EEBDMO COC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@@H]1CCCO1 ZINC000392724043 467428256 /nfs/dbraw/zinc/42/82/56/467428256.db2.gz RBJYRYGORDBFKX-AWEZNQCLSA-N 1 1 340.351 2.278 20 5 EEBDMO COC(=O)CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@@H]1CCCO1 ZINC000392724043 467428258 /nfs/dbraw/zinc/42/82/58/467428258.db2.gz RBJYRYGORDBFKX-AWEZNQCLSA-N 1 1 340.351 2.278 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)N2CCC3(CC[NH2+]C3)CC2)cccc1[N+](=O)[O-] ZINC000431041072 467490305 /nfs/dbraw/zinc/49/03/05/467490305.db2.gz ZUDOCJHXUNFVLT-AWEZNQCLSA-N 1 1 346.431 2.306 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(c3ncnc4cccc([N+](=O)[O-])c43)CC[C@@H]21 ZINC000408194149 467525992 /nfs/dbraw/zinc/52/59/92/467525992.db2.gz GXCNPRSBPBCEPS-OCCSQVGLSA-N 1 1 327.388 2.459 20 5 EEBDMO Cc1nc(NCC[N@@H+]2CCc3c(Cl)cccc3C2)ncc1[N+](=O)[O-] ZINC000450471968 467855848 /nfs/dbraw/zinc/85/58/48/467855848.db2.gz VZKRJUVXQSDKFI-UHFFFAOYSA-N 1 1 347.806 2.817 20 5 EEBDMO Cc1nc(NCC[N@H+]2CCc3c(Cl)cccc3C2)ncc1[N+](=O)[O-] ZINC000450471968 467855850 /nfs/dbraw/zinc/85/58/50/467855850.db2.gz VZKRJUVXQSDKFI-UHFFFAOYSA-N 1 1 347.806 2.817 20 5 EEBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)C(=O)/C=C\c1ccccc1[N+](=O)[O-] ZINC000493204554 467861974 /nfs/dbraw/zinc/86/19/74/467861974.db2.gz JMKFEUMXZTZQEY-HJWRWDBZSA-N 1 1 347.415 2.177 20 5 EEBDMO CN(CC[N@H+]1CCOC(C)(C)C1)C(=O)/C=C\c1ccccc1[N+](=O)[O-] ZINC000493204554 467861977 /nfs/dbraw/zinc/86/19/77/467861977.db2.gz JMKFEUMXZTZQEY-HJWRWDBZSA-N 1 1 347.415 2.177 20 5 EEBDMO CC(C)[C@H]1CN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])CC[N@H+]1C ZINC000515110129 467974300 /nfs/dbraw/zinc/97/43/00/467974300.db2.gz ADCSRWMEKXRDMW-OAHLLOKOSA-N 1 1 331.376 2.020 20 5 EEBDMO CC(C)[C@H]1CN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)CC[N@H+]1C ZINC000487706824 468050791 /nfs/dbraw/zinc/05/07/91/468050791.db2.gz IAQDKCYOIMPIDV-OAHLLOKOSA-N 1 1 341.358 2.214 20 5 EEBDMO CC(C)[C@@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[N@H+]1C ZINC000488031059 468067877 /nfs/dbraw/zinc/06/78/77/468067877.db2.gz KEWMWYNOIKVUKV-HNNXBMFYSA-N 1 1 345.403 2.417 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC([N@@H+]2CCOC[C@H]2C)CC1 ZINC000590386603 468244778 /nfs/dbraw/zinc/24/47/78/468244778.db2.gz CEXRPMPWLVRIFE-CQSZACIVSA-N 1 1 347.415 2.229 20 5 EEBDMO O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594215681 468515024 /nfs/dbraw/zinc/51/50/24/468515024.db2.gz STXBCCJLUGEHTL-GDBMZVCRSA-N 1 1 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WJTGULYEPBBDDA-AWEZNQCLSA-N 1 1 332.404 2.019 20 5 EEBDMO CC/C=C(\C)C(=O)NCC1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1 ZINC001222523818 1299658084 /nfs/dbraw/zinc/65/80/84/1299658084.db2.gz CUGHIJZWZAOKRR-WLRTZDKTSA-N 1 1 349.435 2.013 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)N(C)CCNc1cccc(F)c1[N+](=O)[O-] ZINC001101712838 1299741915 /nfs/dbraw/zinc/74/19/15/1299741915.db2.gz ONWANTXFYVJQPI-UHFFFAOYSA-N 1 1 340.399 2.336 20 5 EEBDMO C[C@@H](OCCC[NH+]1CCOCC1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC001224869412 1300763894 /nfs/dbraw/zinc/76/38/94/1300763894.db2.gz GWXIHZZBBCRHJK-GFCCVEGCSA-N 1 1 338.360 2.123 20 5 EEBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3c(F)cccc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001226010228 1301231468 /nfs/dbraw/zinc/23/14/68/1301231468.db2.gz RNNBYLHPHLDIJS-UOVKNHIHSA-N 1 1 338.335 2.280 20 5 EEBDMO COCCO[C@H]1CC[N@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000780491481 1303672163 /nfs/dbraw/zinc/67/21/63/1303672163.db2.gz MBNBHXJVLYLQID-KRWDZBQOSA-N 1 1 346.387 2.153 20 5 EEBDMO COCCO[C@H]1CC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000780491481 1303672171 /nfs/dbraw/zinc/67/21/71/1303672171.db2.gz MBNBHXJVLYLQID-KRWDZBQOSA-N 1 1 346.387 2.153 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NCC1(Nc2ccc([N+](=O)[O-])cc2)CCC1 ZINC001111814527 1303930869 /nfs/dbraw/zinc/93/08/69/1303930869.db2.gz NNBGGSXQHWYWIN-UHFFFAOYSA-N 1 1 334.420 2.386 20 5 EEBDMO CCC[N@H+]1CC[C@@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001118631477 1308906850 /nfs/dbraw/zinc/90/68/50/1308906850.db2.gz VLIRPJPQVJBLNC-OAHLLOKOSA-N 1 1 332.404 2.147 20 5 EEBDMO Cc1c(CNC(=O)[C@H]2[NH2+]CCOc3ccccc32)cccc1[N+](=O)[O-] ZINC001121958482 1310186781 /nfs/dbraw/zinc/18/67/81/1310186781.db2.gz BQISPFBCIIVWMA-KRWDZBQOSA-N 1 1 341.367 2.243 20 5 EEBDMO NC[C@]1(O)CCCC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001246565752 1310345258 /nfs/dbraw/zinc/34/52/58/1310345258.db2.gz ZNZDEKFOAUVFHQ-SJLPKXTDSA-N 1 1 333.432 2.018 20 5 EEBDMO NC[C@]1(O)CCCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001246565752 1310345267 /nfs/dbraw/zinc/34/52/67/1310345267.db2.gz ZNZDEKFOAUVFHQ-SJLPKXTDSA-N 1 1 333.432 2.018 20 5 EEBDMO COc1ccc(C[C@@H](C)N2CCC(F)(F)[C@H]([NH3+])C2)c([N+](=O)[O-])c1 ZINC001246595562 1310352992 /nfs/dbraw/zinc/35/29/92/1310352992.db2.gz IHYNMFRJFHAREI-QMTHXVAHSA-N 1 1 329.347 2.203 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)OC[C@@H]2C[N@H+](C(C)C)CCO2)c1C ZINC001122661907 1310365399 /nfs/dbraw/zinc/36/53/99/1310365399.db2.gz YBGHHHLUKSYIPN-AWEZNQCLSA-N 1 1 336.388 2.478 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)OC[C@@H]2C[N@@H+](C(C)C)CCO2)c1C ZINC001122661907 1310365401 /nfs/dbraw/zinc/36/54/01/1310365401.db2.gz YBGHHHLUKSYIPN-AWEZNQCLSA-N 1 1 336.388 2.478 20 5 EEBDMO COc1cc(-c2noc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)n2)ccn1 ZINC001248209657 1310863438 /nfs/dbraw/zinc/86/34/38/1310863438.db2.gz SJIJBSIJGLRWKA-CYBMUJFWSA-N 1 1 341.327 2.291 20 5 EEBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000828840572 1314479126 /nfs/dbraw/zinc/47/91/26/1314479126.db2.gz SHDDKWACFYYANW-CYBMUJFWSA-N 1 1 333.388 2.158 20 5 EEBDMO CCN1CCN(CC(C)(C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000832546045 1314684033 /nfs/dbraw/zinc/68/40/33/1314684033.db2.gz WVSSYQUFXRSLBN-UHFFFAOYSA-N 1 1 338.427 2.240 20 5 EEBDMO CC(C)[NH+]1CC(NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000837546445 1315092366 /nfs/dbraw/zinc/09/23/66/1315092366.db2.gz SPZCDVUQHFHSTP-UHFFFAOYSA-N 1 1 329.759 2.139 20 5 EEBDMO CO[C@H]1CC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C[C@H]1C ZINC000840122616 1315302368 /nfs/dbraw/zinc/30/23/68/1315302368.db2.gz ISUMKRZNDHEIOC-DOMZBBRYSA-N 1 1 331.376 2.168 20 5 EEBDMO CO[C@H]1CC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C[C@H]1C ZINC000840122616 1315302371 /nfs/dbraw/zinc/30/23/71/1315302371.db2.gz ISUMKRZNDHEIOC-DOMZBBRYSA-N 1 1 331.376 2.168 20 5 EEBDMO C[N@@H+](Cc1cncnc1)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254482671 1318084220 /nfs/dbraw/zinc/08/42/20/1318084220.db2.gz MAWFNDSVMQAMJH-UHFFFAOYSA-N 1 1 327.388 2.486 20 5 EEBDMO [NH3+]CCc1cn(-c2ncnc3cccc([N+](=O)[O-])c32)c2ccncc12 ZINC001160951557 1320330187 /nfs/dbraw/zinc/33/01/87/1320330187.db2.gz HGLJTUGFOOVUBM-UHFFFAOYSA-N 1 1 334.339 2.378 20 5 EEBDMO CCC1(CCNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)OCCO1 ZINC001163356406 1321104299 /nfs/dbraw/zinc/10/42/99/1321104299.db2.gz GHUGUFPSMGQDNF-VMPITWQZSA-N 1 1 336.392 2.477 20 5 EEBDMO CC(=O)N1CCc2cc(NCCn3cc[nH+]c3C)cc([N+](=O)[O-])c21 ZINC001163928334 1321249653 /nfs/dbraw/zinc/24/96/53/1321249653.db2.gz GYTZSFZGNOUBLB-UHFFFAOYSA-N 1 1 329.360 2.121 20 5 EEBDMO COC(=O)Cc1ccc(NCC[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC001165289977 1321493732 /nfs/dbraw/zinc/49/37/32/1321493732.db2.gz NKBQLBOJMDEJQA-ZDUSSCGKSA-N 1 1 335.404 2.454 20 5 EEBDMO CC1(C)C[C@H](O)C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001308006500 1331558151 /nfs/dbraw/zinc/55/81/51/1331558151.db2.gz QLOQDNIYRJWHQE-NSHDSACASA-N 1 1 332.360 2.238 20 5 EEBDMO CC1(C)C[C@H](O)C[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001308006500 1331558154 /nfs/dbraw/zinc/55/81/54/1331558154.db2.gz QLOQDNIYRJWHQE-NSHDSACASA-N 1 1 332.360 2.238 20 5 EEBDMO COC(=O)CC(C)(C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001325995222 1334012410 /nfs/dbraw/zinc/01/24/10/1334012410.db2.gz ONHZRLOGYLLXFD-UHFFFAOYSA-N 1 1 337.376 2.197 20 5 EEBDMO O=C(c1cc(C[NH+]2CCCC2)on1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001327665939 1334330113 /nfs/dbraw/zinc/33/01/13/1334330113.db2.gz ZZPANRDCOABVOG-UHFFFAOYSA-N 1 1 342.355 2.335 20 5 EEBDMO CN(Cc1ccccc1[N+](=O)[O-])c1nnc([C@@H]2CCC[N@@H+]2C)n1C ZINC001338772847 1336906074 /nfs/dbraw/zinc/90/60/74/1336906074.db2.gz ZIFSKICWLPPZSU-AWEZNQCLSA-N 1 1 330.392 2.126 20 5 EEBDMO CN(Cc1ccccc1[N+](=O)[O-])c1nnc([C@@H]2CCC[N@H+]2C)n1C ZINC001338772847 1336906076 /nfs/dbraw/zinc/90/60/76/1336906076.db2.gz ZIFSKICWLPPZSU-AWEZNQCLSA-N 1 1 330.392 2.126 20 5 EEBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+]C[C@H]1C(F)F ZINC001340928642 1337267185 /nfs/dbraw/zinc/26/71/85/1337267185.db2.gz ICKUQDUDCLGIDG-LBPRGKRZSA-N 1 1 347.749 2.246 20 5 EEBDMO CSCC1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1 ZINC001341087819 1337280423 /nfs/dbraw/zinc/28/04/23/1337280423.db2.gz MQDMRZPBCAJWOY-MRXNPFEDSA-N 1 1 337.445 2.370 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C(=O)N2CCN(c3[nH]cc[nH+]3)CC2)cc1Cl ZINC000847946612 1338395361 /nfs/dbraw/zinc/39/53/61/1338395361.db2.gz JENRRQXBRUKVER-UHFFFAOYSA-N 1 1 349.778 2.242 20 5 EEBDMO C[C@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@@H]1C[NH3+] ZINC001576811221 1344064467 /nfs/dbraw/zinc/06/44/67/1344064467.db2.gz CRZJFWYKJBVTLA-WCQYABFASA-N 1 1 331.376 2.062 20 5 EEBDMO C[C@@H](c1cccnc1)[N@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590050168 1349130295 /nfs/dbraw/zinc/13/02/95/1349130295.db2.gz ISEBCSNTMJGINA-NSHDSACASA-N 1 1 339.359 2.363 20 5 EEBDMO C[C@@H](c1cccnc1)[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590050168 1349130299 /nfs/dbraw/zinc/13/02/99/1349130299.db2.gz ISEBCSNTMJGINA-NSHDSACASA-N 1 1 339.359 2.363 20 5 EEBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CCS1 ZINC001590273131 1349243463 /nfs/dbraw/zinc/24/34/63/1349243463.db2.gz VFUNGJJXELXRIR-JTQLQIEISA-N 1 1 334.405 2.102 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC001593479935 1349812495 /nfs/dbraw/zinc/81/24/95/1349812495.db2.gz CLDSYFPTJZEQNT-QWHCGFSZSA-N 1 1 343.391 2.204 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC001593483041 1349814234 /nfs/dbraw/zinc/81/42/34/1349814234.db2.gz SGQHSOXZUCGTDM-OAHLLOKOSA-N 1 1 339.359 2.440 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC001593483041 1349814237 /nfs/dbraw/zinc/81/42/37/1349814237.db2.gz SGQHSOXZUCGTDM-OAHLLOKOSA-N 1 1 339.359 2.440 20 5 EEBDMO CC(C)C[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(-c3nn[nH]n3)c2)C1 ZINC001603295065 1350681413 /nfs/dbraw/zinc/68/14/13/1350681413.db2.gz RXJGXXNHNOYIIQ-GFCCVEGCSA-N 1 1 345.407 2.165 20 5 EEBDMO C[N@H+](CCc1nccs1)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1 ZINC000853504083 1369341171 /nfs/dbraw/zinc/34/11/71/1369341171.db2.gz MPGLEJHWLOSPCC-UHFFFAOYSA-N 1 1 344.400 2.442 20 5 EEBDMO C[N@@H+](CCc1nccs1)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1 ZINC000853504083 1369341178 /nfs/dbraw/zinc/34/11/78/1369341178.db2.gz MPGLEJHWLOSPCC-UHFFFAOYSA-N 1 1 344.400 2.442 20 5 EEBDMO O=C(O[C@H]1C[C@@H]([NH+]2CCOCC2)C1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000838909181 1372874900 /nfs/dbraw/zinc/87/49/00/1372874900.db2.gz VCTYDMWMNROWPA-OKILXGFUSA-N 1 1 346.339 2.361 20 5 EEBDMO CC(=O)c1ccc(N2CCC[C@H]([NH+]3CCOCC3)CC2)c([N+](=O)[O-])c1 ZINC000848792674 1373181632 /nfs/dbraw/zinc/18/16/32/1373181632.db2.gz APDFOCMLLJJUPI-INIZCTEOSA-N 1 1 347.415 2.489 20 5 EEBDMO C[C@@]([NH3+])(C(=O)Nc1cc2ccccn2n1)c1cccc([N+](=O)[O-])c1 ZINC001576084415 1403560056 /nfs/dbraw/zinc/56/00/56/1403560056.db2.gz BVAHZFMAFQWQAG-INIZCTEOSA-N 1 1 325.328 2.055 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCCN(CC)c1ccc(F)cc1[N+](=O)[O-] ZINC001100576513 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293182569 /nfs/dbraw/zinc/18/25/69/293182569.db2.gz GPCRZHDMQQUYPA-PHIMTYICSA-N 1 1 340.811 2.211 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3cc(F)c([N+](=O)[O-])cc3F)C2)C1 ZINC000293982427 293343294 /nfs/dbraw/zinc/34/32/94/293343294.db2.gz VRLOYKYIJMKYLI-OAHLLOKOSA-N 1 1 325.315 2.041 20 5 EEBDMO CCc1nn(C)c(OC)c1C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294876355 293568394 /nfs/dbraw/zinc/56/83/94/293568394.db2.gz UMGLUTMNIYFBGB-JTQLQIEISA-N 1 1 333.392 2.332 20 5 EEBDMO CCOc1cc(C[N@@H+]2CC[C@@H](OC(=O)N(C)C)C2)ccc1[N+](=O)[O-] ZINC000296534141 294001355 /nfs/dbraw/zinc/00/13/55/294001355.db2.gz BBMXEPBKRPKXID-CYBMUJFWSA-N 1 1 337.376 2.266 20 5 EEBDMO CCOc1cc(C[N@H+]2CC[C@@H](OC(=O)N(C)C)C2)ccc1[N+](=O)[O-] ZINC000296534141 294001357 /nfs/dbraw/zinc/00/13/57/294001357.db2.gz BBMXEPBKRPKXID-CYBMUJFWSA-N 1 1 337.376 2.266 20 5 EEBDMO C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000297405446 294234816 /nfs/dbraw/zinc/23/48/16/294234816.db2.gz CMXXXHNFBSSMJM-RCCFBDPRSA-N 1 1 344.415 2.420 20 5 EEBDMO COc1cc(C(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000160969255 311360371 /nfs/dbraw/zinc/36/03/71/311360371.db2.gz LCOUMBLYSXFQRQ-CHWSQXEVSA-N 1 1 335.404 2.454 20 5 EEBDMO C[C@@H]1C[C@H](CO)C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000421361019 314091496 /nfs/dbraw/zinc/09/14/96/314091496.db2.gz KBENYQKMMAYAAI-KGLIPLIRSA-N 1 1 344.415 2.446 20 5 EEBDMO CC(C)C[C@@H]1C(=O)NCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000445992203 315363038 /nfs/dbraw/zinc/36/30/38/315363038.db2.gz OSAHTSGZXCPBCV-MRXNPFEDSA-N 1 1 335.404 2.210 20 5 EEBDMO CC(C)C[C@@H]1C(=O)NCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000445992203 315363042 /nfs/dbraw/zinc/36/30/42/315363042.db2.gz OSAHTSGZXCPBCV-MRXNPFEDSA-N 1 1 335.404 2.210 20 5 EEBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000448726046 315381955 /nfs/dbraw/zinc/38/19/55/315381955.db2.gz RDLHIHFZMLEAFK-HUUCEWRRSA-N 1 1 345.399 2.301 20 5 EEBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](N2CCNC2=O)C1 ZINC000527054860 317146691 /nfs/dbraw/zinc/14/66/91/317146691.db2.gz LQZHCZXXEDTOJG-QXSWTLKVSA-N 1 1 344.415 2.488 20 5 EEBDMO Cc1nc(CC[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cs1 ZINC000534317008 317940663 /nfs/dbraw/zinc/94/06/63/317940663.db2.gz KOQASCWCJVKUBF-UHFFFAOYSA-N 1 1 333.417 2.119 20 5 EEBDMO C[NH+](C)[C@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])c1ccccc1Cl ZINC000547752008 318319220 /nfs/dbraw/zinc/31/92/20/318319220.db2.gz RUXUMIOHOALFHW-GFCCVEGCSA-N 1 1 337.767 2.004 20 5 EEBDMO CSc1cccc(C(=O)N2CCN(c3[nH]cc[nH+]3)CC2)c1[N+](=O)[O-] ZINC000563973844 319060841 /nfs/dbraw/zinc/06/08/41/319060841.db2.gz UFIYHJMUJYKRGM-UHFFFAOYSA-N 1 1 347.400 2.002 20 5 EEBDMO C[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000181663698 323352112 /nfs/dbraw/zinc/35/21/12/323352112.db2.gz YJOJBPSILNGLIZ-JTQLQIEISA-N 1 1 343.330 2.268 20 5 EEBDMO C[C@@H]1CCC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1C ZINC000181909208 323359455 /nfs/dbraw/zinc/35/94/55/323359455.db2.gz QGCQZGUHYBWHHQ-CHWSQXEVSA-N 1 1 326.418 2.489 20 5 EEBDMO C[C@@H]1CCC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1C ZINC000181909208 323359458 /nfs/dbraw/zinc/35/94/58/323359458.db2.gz QGCQZGUHYBWHHQ-CHWSQXEVSA-N 1 1 326.418 2.489 20 5 EEBDMO CCOC(=O)C[C@H](C)[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000182653417 323382395 /nfs/dbraw/zinc/38/23/95/323382395.db2.gz YSSPQQCFLJIOHV-NSHDSACASA-N 1 1 348.359 2.418 20 5 EEBDMO CCOC(=O)C[C@H](C)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000182653417 323382396 /nfs/dbraw/zinc/38/23/96/323382396.db2.gz YSSPQQCFLJIOHV-NSHDSACASA-N 1 1 348.359 2.418 20 5 EEBDMO COC(=O)c1cnc(N2CCC[N@H+](C(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC000582156617 324390750 /nfs/dbraw/zinc/39/07/50/324390750.db2.gz NHBMLMADIJFMSG-UHFFFAOYSA-N 1 1 336.392 2.087 20 5 EEBDMO CC(C)[C@@H](CNc1ncnc2ccc([N+](=O)[O-])cc21)[NH+]1CCOCC1 ZINC000609850018 450105357 /nfs/dbraw/zinc/10/53/57/450105357.db2.gz RTMVLQHFLZCFEN-MRXNPFEDSA-N 1 1 345.403 2.307 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](SC)C1 ZINC000296329865 465159525 /nfs/dbraw/zinc/15/95/25/465159525.db2.gz PFTGUIGBAVSHKK-GFCCVEGCSA-N 1 1 339.417 2.369 20 5 EEBDMO C[C@@H]1C[NH+](C[C@@H](O)COc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)O1 ZINC000339291825 465191793 /nfs/dbraw/zinc/19/17/93/465191793.db2.gz YVQPJXUNIRMMAH-NQBHXWOUSA-N 1 1 344.795 2.097 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000521129876 468290911 /nfs/dbraw/zinc/29/09/11/468290911.db2.gz RNSZCTMAYCGFQP-CQSZACIVSA-N 1 1 335.404 2.137 20 5 EEBDMO O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000153080086 462613795 /nfs/dbraw/zinc/61/37/95/462613795.db2.gz KECUFLLSNIWSQF-CYBMUJFWSA-N 1 1 335.379 2.410 20 5 EEBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000115273190 462703922 /nfs/dbraw/zinc/70/39/22/462703922.db2.gz CFFHNZZNWHDDGB-PBHICJAKSA-N 1 1 349.431 2.462 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000153926082 462709623 /nfs/dbraw/zinc/70/96/23/462709623.db2.gz PAVBXENBRGJZPJ-HNNXBMFYSA-N 1 1 335.404 2.162 20 5 EEBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000119290307 462887225 /nfs/dbraw/zinc/88/72/25/462887225.db2.gz DVAAOMNDBRILJC-AWEZNQCLSA-N 1 1 334.420 2.101 20 5 EEBDMO Cc1cc([N+](=O)[O-])cnc1N1CCN(CC[N@@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000092630379 462966718 /nfs/dbraw/zinc/96/67/18/462966718.db2.gz BNXWJEARXVDNBH-IYBDPMFKSA-N 1 1 347.463 2.293 20 5 EEBDMO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)CN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000120897344 463052181 /nfs/dbraw/zinc/05/21/81/463052181.db2.gz NZQNIVADCCNIHS-GDBMZVCRSA-N 1 1 334.464 2.437 20 5 EEBDMO C[N@@H+](CCNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F)C1CC1 ZINC000579258455 468334135 /nfs/dbraw/zinc/33/41/35/468334135.db2.gz NKIUJAVFIQYLOL-UHFFFAOYSA-N 1 1 338.383 2.077 20 5 EEBDMO Cc1cc(CN2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)on1 ZINC000052309255 463073481 /nfs/dbraw/zinc/07/34/81/463073481.db2.gz NZZGDQDULOGFMM-UHFFFAOYSA-N 1 1 330.388 2.252 20 5 EEBDMO COc1ccccc1[C@@H](CNC(=O)c1ccc([N+](=O)[O-])o1)[NH+](C)C ZINC000023982014 463073963 /nfs/dbraw/zinc/07/39/63/463073963.db2.gz HMLIJQATSILFBA-GFCCVEGCSA-N 1 1 333.344 2.229 20 5 EEBDMO C[C@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C[NH+]1CCCCC1 ZINC000068115424 463095365 /nfs/dbraw/zinc/09/53/65/463095365.db2.gz AREGGLAKSBGXRV-GFCCVEGCSA-N 1 1 345.403 2.323 20 5 EEBDMO CCOC(=O)[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000026218828 463154310 /nfs/dbraw/zinc/15/43/10/463154310.db2.gz MGJMETCTCCGPBS-CYBMUJFWSA-N 1 1 349.387 2.199 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1cnn(C)c1 ZINC000026256865 463156810 /nfs/dbraw/zinc/15/68/10/463156810.db2.gz GGCHSLMYTUMJAO-UHFFFAOYSA-N 1 1 331.376 2.097 20 5 EEBDMO O=C(NCC[NH+]1Cc2ccccc2C1)NCc1ccc([N+](=O)[O-])cc1 ZINC000068638253 463160756 /nfs/dbraw/zinc/16/07/56/463160756.db2.gz QLGCMEJWNHNUMR-UHFFFAOYSA-N 1 1 340.383 2.410 20 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EEBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000177862241 463805986 /nfs/dbraw/zinc/80/59/86/463805986.db2.gz WECUUQSAJVVQPE-HNNXBMFYSA-N 1 1 334.420 2.121 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000283447010 463888013 /nfs/dbraw/zinc/88/80/13/463888013.db2.gz KNQZLXANVLJILC-MNOVXSKESA-N 1 1 338.383 2.166 20 5 EEBDMO O=C(NCC1CC1)[C@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000171627247 463896239 /nfs/dbraw/zinc/89/62/39/463896239.db2.gz HGADRBIJWZWPNQ-ZDUSSCGKSA-N 1 1 335.379 2.472 20 5 EEBDMO O=C(NCC1CC1)[C@H]1CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000171627247 463896244 /nfs/dbraw/zinc/89/62/44/463896244.db2.gz HGADRBIJWZWPNQ-ZDUSSCGKSA-N 1 1 335.379 2.472 20 5 EEBDMO C[C@@H]1C[N@@H+](CCN(C)C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000194730001 463916639 /nfs/dbraw/zinc/91/66/39/463916639.db2.gz UDKISAVXYONOQV-GASCZTMLSA-N 1 1 349.431 2.095 20 5 EEBDMO 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/nfs/dbraw/zinc/08/97/92/1208089792.db2.gz ZPYLNPZARNCZDC-MRVPVSSYSA-N 1 1 344.774 2.136 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000778317918 1208120320 /nfs/dbraw/zinc/12/03/20/1208120320.db2.gz QGTXMHXOCXIPMS-CMPLNLGQSA-N 1 1 339.342 2.428 20 5 EEBDMO C[C@@H]1C[N@@H+](CCN(C)Cc2cc(F)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000195304540 1211375179 /nfs/dbraw/zinc/37/51/79/1211375179.db2.gz JAHZPLKNVSUDTA-BETUJISGSA-N 1 1 325.384 2.275 20 5 EEBDMO C[C@@H]1C[N@H+](CCN(C)Cc2cc(F)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000195304540 1211375182 /nfs/dbraw/zinc/37/51/82/1211375182.db2.gz JAHZPLKNVSUDTA-BETUJISGSA-N 1 1 325.384 2.275 20 5 EEBDMO CCOC1CC2(C1)CC[N@@H+](Cn1nc(C)c3cc([N+](=O)[O-])cnc31)C2 ZINC000795720364 1215014715 /nfs/dbraw/zinc/01/47/15/1215014715.db2.gz MQFACPRLYHUBKM-UHFFFAOYSA-N 1 1 345.403 2.496 20 5 EEBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)CC1CCN(C(=O)COC)CC1 ZINC000957654332 1215304230 /nfs/dbraw/zinc/30/42/30/1215304230.db2.gz TVHUSWZXWOGEMA-UHFFFAOYSA-N 1 1 349.431 2.302 20 5 EEBDMO O=C(NC1CC2(C1)CC([NH2+]Cc1ccccc1F)C2)[C@@H]1CC1[N+](=O)[O-] ZINC000963786380 1218038664 /nfs/dbraw/zinc/03/86/64/1218038664.db2.gz CMOMQEPJTBSBHL-KLQVMUDPSA-N 1 1 347.390 2.008 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCCCN(c1ccccc1[N+](=O)[O-])C1CC1 ZINC001096043291 1233956135 /nfs/dbraw/zinc/95/61/35/1233956135.db2.gz BKOFMXDFQCUSHM-UHFFFAOYSA-N 1 1 348.447 2.412 20 5 EEBDMO CC(C)=CC(=O)N1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC001048654012 1238200609 /nfs/dbraw/zinc/20/06/09/1238200609.db2.gz WBMIHVCXOPPRKY-IYBDPMFKSA-N 1 1 329.400 2.451 20 5 EEBDMO O=C(NCC1=CC[N@@H+](Cc2cccc(Cl)c2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001000672958 1240705624 /nfs/dbraw/zinc/70/56/24/1240705624.db2.gz CHBRYUZDHBVCIE-HZPDHXFCSA-N 1 1 349.818 2.254 20 5 EEBDMO C[C@@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1CO ZINC000856791701 1293632521 /nfs/dbraw/zinc/63/25/21/1293632521.db2.gz BRVHGIZHCOTIPK-GHMZBOCLSA-N 1 1 341.795 2.137 20 5 EEBDMO C[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1CO ZINC000856791701 1293632528 /nfs/dbraw/zinc/63/25/28/1293632528.db2.gz BRVHGIZHCOTIPK-GHMZBOCLSA-N 1 1 341.795 2.137 20 5 EEBDMO O=[N+]([O-])c1ccccc1N1CCC(OCCC[NH+]2CCOCC2)CC1 ZINC001224867796 1300763276 /nfs/dbraw/zinc/76/32/76/1300763276.db2.gz ODUFJCYWPSIJRX-UHFFFAOYSA-N 1 1 349.431 2.303 20 5 EEBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1Oc1nc[nH]c(=O)c1[N+](=O)[O-] ZINC001228143167 1302123708 /nfs/dbraw/zinc/12/37/08/1302123708.db2.gz JXHNYRVZFQHYOG-JSGCOSHPSA-N 1 1 344.371 2.380 20 5 EEBDMO COC(=O)c1c(O[C@@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)cccc1[N+](=O)[O-] ZINC001229050056 1302590991 /nfs/dbraw/zinc/59/09/91/1302590991.db2.gz SIEPQBLOLYTFBU-DRXBFXEBSA-N 1 1 334.372 2.491 20 5 EEBDMO CCCSc1nc(O[C@@H]2CC[N@@H+](CC)C2)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229790772 1302946374 /nfs/dbraw/zinc/94/63/74/1302946374.db2.gz DGYJRLGYGKSMPF-SECBINFHSA-N 1 1 328.394 2.066 20 5 EEBDMO CSCCC[N@H+](C)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000799159516 1305170265 /nfs/dbraw/zinc/17/02/65/1305170265.db2.gz HWGDMWWTNRBTIQ-UHFFFAOYSA-N 1 1 338.433 2.479 20 5 EEBDMO CSCCC[N@@H+](C)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000799159516 1305170270 /nfs/dbraw/zinc/17/02/70/1305170270.db2.gz HWGDMWWTNRBTIQ-UHFFFAOYSA-N 1 1 338.433 2.479 20 5 EEBDMO CC[C@@H](N)C[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246310933 1310278323 /nfs/dbraw/zinc/27/83/23/1310278323.db2.gz ALQATYGHHXCFCI-SNVBAGLBSA-N 1 1 328.363 2.169 20 5 EEBDMO COc1cc(N2CCC([NH+]3C[C@H](C)N[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC001246966402 1310482412 /nfs/dbraw/zinc/48/24/12/1310482412.db2.gz UJDIMHXAIVIUGV-KBPBESRZSA-N 1 1 348.447 2.254 20 5 EEBDMO CC(C)[N@H+]1CCCC[C@H]1COC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000838284657 1315149239 /nfs/dbraw/zinc/14/92/39/1315149239.db2.gz LLHMKRYWGUSMBK-JKSUJKDBSA-N 1 1 336.388 2.434 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(Cn3c4cc([N+](=O)[O-])ccc4oc3=S)C[C@@H]21 ZINC000840132568 1315303911 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20 5 EEBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3C[C@H](F)C[C@@H](CO)C3)CC2)cc1 ZINC001254475238 1318083257 /nfs/dbraw/zinc/08/32/57/1318083257.db2.gz CUCHJLREJMCFKQ-ZIAGYGMSSA-N 1 1 337.395 2.216 20 5 EEBDMO CCNC(=O)CO[C@H]1CCC[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254560126 1318119886 /nfs/dbraw/zinc/11/98/86/1318119886.db2.gz PJDLTKWJUZTLIY-HOCLYGCPSA-N 1 1 349.431 2.143 20 5 EEBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC001258144905 1319189606 /nfs/dbraw/zinc/18/96/06/1319189606.db2.gz FOZRRVFQUSFCHV-TXEJJXNPSA-N 1 1 332.360 2.297 20 5 EEBDMO COC(=O)c1cnc(N[C@H]2CC[N@H+](C(C)C)C[C@H]2C)c([N+](=O)[O-])c1 ZINC001163362402 1321105918 /nfs/dbraw/zinc/10/59/18/1321105918.db2.gz NDOFXTCUSYPTIP-YPMHNXCESA-N 1 1 336.392 2.307 20 5 EEBDMO C[NH+](C)/C=C/c1cc(N2CCC[C@@](F)(CO)CC2)ncc1[N+](=O)[O-] ZINC001164417848 1321374709 /nfs/dbraw/zinc/37/47/09/1321374709.db2.gz OBBPXTDFFJNKLZ-YCOJEUHLSA-N 1 1 338.383 2.213 20 5 EEBDMO CS[C@H]1CC[C@@H]([N@H+](C)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)C1 ZINC001323267904 1333426784 /nfs/dbraw/zinc/42/67/84/1333426784.db2.gz CRQWICDLOGEOMM-PWSUYJOCSA-N 1 1 349.412 2.364 20 5 EEBDMO CS[C@H]1CC[C@@H]([N@@H+](C)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)C1 ZINC001323267904 1333426788 /nfs/dbraw/zinc/42/67/88/1333426788.db2.gz CRQWICDLOGEOMM-PWSUYJOCSA-N 1 1 349.412 2.364 20 5 EEBDMO CCOC1(C)CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1 ZINC001578078356 1344231175 /nfs/dbraw/zinc/23/11/75/1344231175.db2.gz SEGCJRJGEMEXLZ-QGZVFWFLSA-N 1 1 335.404 2.186 20 5 EEBDMO C[S@](=O)c1cccc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)c1 ZINC001579357641 1344374482 /nfs/dbraw/zinc/37/44/82/1344374482.db2.gz JNBSUIRBFVSLMU-FYSMJZIKSA-N 1 1 347.396 2.145 20 5 EEBDMO CC[C@@H]1CC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000119498762 1369564039 /nfs/dbraw/zinc/56/40/39/1369564039.db2.gz IBPUEXNIFVFTCU-SJKOYZFVSA-N 1 1 346.387 2.051 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC2(CNC(=O)O2)CC1 ZINC000782002318 1371258079 /nfs/dbraw/zinc/25/80/79/1371258079.db2.gz ZKDMCZDBCGJUHN-UHFFFAOYSA-N 1 1 335.360 2.068 20 5 EEBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1C[C@@H](C)[N@H+](CCO)[C@@H](C)C1 ZINC000829020290 1372261976 /nfs/dbraw/zinc/26/19/76/1372261976.db2.gz ZVYJRSNCWMBZJY-TXEJJXNPSA-N 1 1 327.812 2.448 20 5 EEBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1C[C@@H](C)[N@@H+](CCO)[C@@H](C)C1 ZINC000829020290 1372261981 /nfs/dbraw/zinc/26/19/81/1372261981.db2.gz ZVYJRSNCWMBZJY-TXEJJXNPSA-N 1 1 327.812 2.448 20 5 EEBDMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc([N+](=O)[O-])ccn1)C2 ZINC001164814878 720072964 /nfs/dbraw/zinc/07/29/64/720072964.db2.gz XSOOBBKEGVYATF-MAUKXSAKSA-N 1 1 346.431 2.175 20 5 EEBDMO Cc1ccnc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c1[N+](=O)[O-] ZINC001164791490 721398925 /nfs/dbraw/zinc/39/89/25/721398925.db2.gz YTVXDDQRPDQACT-BETUJISGSA-N 1 1 345.428 2.323 20 5 EEBDMO 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O=C1CCCCN1[C@@H]1CCC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000370990647 467065552 /nfs/dbraw/zinc/06/55/52/467065552.db2.gz FXTVKGXMINPZOO-IAGOWNOFSA-N 1 1 347.415 2.105 20 5 EEBDMO Cc1c[nH+]ccc1OC1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1 ZINC000377652106 467107165 /nfs/dbraw/zinc/10/71/65/467107165.db2.gz ZTPTWDRSDWGIDR-UHFFFAOYSA-N 1 1 331.376 2.075 20 5 EEBDMO CC[C@H]1CN(c2ccc([N+](=O)[O-])c3ncccc32)CC[N@H+]1C[C@H](C)O ZINC000413129282 467175676 /nfs/dbraw/zinc/17/56/76/467175676.db2.gz LHLQBWRPTDAFPA-KBPBESRZSA-N 1 1 344.415 2.424 20 5 EEBDMO Cc1ncccc1OC[C@@H]1CCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C ZINC000419402008 467195554 /nfs/dbraw/zinc/19/55/54/467195554.db2.gz PSEFQVZUMIMGHF-ZDUSSCGKSA-N 1 1 331.376 2.075 20 5 EEBDMO Cc1ncccc1OC[C@@H]1CCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C ZINC000419402008 467195555 /nfs/dbraw/zinc/19/55/55/467195555.db2.gz PSEFQVZUMIMGHF-ZDUSSCGKSA-N 1 1 331.376 2.075 20 5 EEBDMO C[C@H](CN1CC[NH+](C)CC1)Nc1ccnc2c1cccc2[N+](=O)[O-] ZINC000432339318 467233035 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O=C(NCc1cccc2c1CC[N@@H+](CCC1CC1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001051288980 1245482663 /nfs/dbraw/zinc/48/26/63/1245482663.db2.gz ARUGNHNDUNKLCC-QZTJIDSGSA-N 1 1 343.427 2.126 20 5 EEBDMO O=C(NCc1cccc2c1CC[N@H+](CCC1CC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051288980 1245482668 /nfs/dbraw/zinc/48/26/68/1245482668.db2.gz ARUGNHNDUNKLCC-QZTJIDSGSA-N 1 1 343.427 2.126 20 5 EEBDMO O=C(NCc1cccc2c1CC[N@@H+](CCC1CC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051288980 1245482673 /nfs/dbraw/zinc/48/26/73/1245482673.db2.gz ARUGNHNDUNKLCC-QZTJIDSGSA-N 1 1 343.427 2.126 20 5 EEBDMO Cc1noc(C[N@@H+]2CCC[C@@H](C(=O)Nc3ccccn3)C2)c1[N+](=O)[O-] ZINC000851825643 1291865368 /nfs/dbraw/zinc/86/53/68/1291865368.db2.gz NQDUPIKJYRTCHD-GFCCVEGCSA-N 1 1 345.359 2.137 20 5 EEBDMO Cc1noc(C[N@H+]2CCC[C@@H](C(=O)Nc3ccccn3)C2)c1[N+](=O)[O-] ZINC000851825643 1291865380 /nfs/dbraw/zinc/86/53/80/1291865380.db2.gz NQDUPIKJYRTCHD-GFCCVEGCSA-N 1 1 345.359 2.137 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(NC(=O)OC)CC1 ZINC000852768566 1292192774 /nfs/dbraw/zinc/19/27/74/1292192774.db2.gz BRMGNEJNPQLEFT-UHFFFAOYSA-N 1 1 337.376 2.314 20 5 EEBDMO CO[C@]1(C)CCC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000794650105 1296509260 /nfs/dbraw/zinc/50/92/60/1296509260.db2.gz NXINCUCPKOVKKQ-MRXNPFEDSA-N 1 1 331.376 2.312 20 5 EEBDMO CO[C@]1(C)CCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000794650105 1296509271 /nfs/dbraw/zinc/50/92/71/1296509271.db2.gz NXINCUCPKOVKKQ-MRXNPFEDSA-N 1 1 331.376 2.312 20 5 EEBDMO CO[C@]1(C)CCC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000794648744 1296509729 /nfs/dbraw/zinc/50/97/29/1296509729.db2.gz FXYUIHKLFZGVKH-MRXNPFEDSA-N 1 1 331.376 2.312 20 5 EEBDMO CO[C@]1(C)CCC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000794648744 1296509731 /nfs/dbraw/zinc/50/97/31/1296509731.db2.gz FXYUIHKLFZGVKH-MRXNPFEDSA-N 1 1 331.376 2.312 20 5 EEBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2Oc1[nH]c(=O)nc2cc([N+](=O)[O-])ccc21 ZINC001228245682 1302173925 /nfs/dbraw/zinc/17/39/25/1302173925.db2.gz WFELOGXLYHSGCU-QHBPRCKVSA-N 1 1 344.371 2.353 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)NCC1(Nc2ccc([N+](=O)[O-])cc2)CCC1 ZINC001111810013 1303921581 /nfs/dbraw/zinc/92/15/81/1303921581.db2.gz DNMFIJPNNRNGDW-UHFFFAOYSA-N 1 1 343.387 2.251 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NCC1(Nc2ccc([N+](=O)[O-])cn2)CCC1 ZINC001111826982 1303953648 /nfs/dbraw/zinc/95/36/48/1303953648.db2.gz LIRVQXBSRHTMAQ-UHFFFAOYSA-N 1 1 349.435 2.173 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CC[C@@H](c3ccccn3)C2)c([N+](=O)[O-])c1 ZINC000799192034 1305181195 /nfs/dbraw/zinc/18/11/95/1305181195.db2.gz BAKWIGSJHHWKAW-CYBMUJFWSA-N 1 1 326.356 2.078 20 5 EEBDMO CC1(C)CC[N@@H+](CCNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC001122031758 1310202787 /nfs/dbraw/zinc/20/27/87/1310202787.db2.gz OKUBGPAADAMIRW-UHFFFAOYSA-N 1 1 334.420 2.168 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)OC[C@H]2C[N@H+](C(C)C)CCO2)c1C ZINC001122661908 1310366120 /nfs/dbraw/zinc/36/61/20/1310366120.db2.gz YBGHHHLUKSYIPN-CQSZACIVSA-N 1 1 336.388 2.478 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)OC[C@H]2C[N@@H+](C(C)C)CCO2)c1C ZINC001122661908 1310366129 /nfs/dbraw/zinc/36/61/29/1310366129.db2.gz YBGHHHLUKSYIPN-CQSZACIVSA-N 1 1 336.388 2.478 20 5 EEBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000829570893 1314502916 /nfs/dbraw/zinc/50/29/16/1314502916.db2.gz UPJCECQOWQDVCU-PQEBFOHHSA-N 1 1 329.400 2.393 20 5 EEBDMO CC(C)O[C@@H]1CC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000842611309 1315731282 /nfs/dbraw/zinc/73/12/82/1315731282.db2.gz XCUWDDJOKDJKMW-OAHLLOKOSA-N 1 1 331.376 2.310 20 5 EEBDMO CC(C)O[C@@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000842611309 1315731283 /nfs/dbraw/zinc/73/12/83/1315731283.db2.gz XCUWDDJOKDJKMW-OAHLLOKOSA-N 1 1 331.376 2.310 20 5 EEBDMO CC[C@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@@H]1[NH3+] ZINC000843376766 1315903773 /nfs/dbraw/zinc/90/37/73/1315903773.db2.gz DJWNIKAXVUGQHP-FZMZJTMJSA-N 1 1 338.383 2.122 20 5 EEBDMO CCN(c1ccc(-c2ccc(F)c([N+](=O)[O-])c2)nn1)C1C[NH+](C)C1 ZINC001157461154 1318654059 /nfs/dbraw/zinc/65/40/59/1318654059.db2.gz CHLORDFBBVESJM-UHFFFAOYSA-N 1 1 331.351 2.331 20 5 EEBDMO CC(C)[N@H+]1CCN(c2cc(/C=C/N(C)C)c([N+](=O)[O-])cn2)C[C@@H]1C ZINC001158495483 1319269941 /nfs/dbraw/zinc/26/99/41/1319269941.db2.gz SKPGVYAHCDOXID-UZYOAWRESA-N 1 1 333.436 2.441 20 5 EEBDMO C[N@@H+](C1CN(c2nc(Cl)c(Cl)cc2[N+](=O)[O-])C1)[C@H]1CCOC1 ZINC001158731761 1319406342 /nfs/dbraw/zinc/40/63/42/1319406342.db2.gz XUCVQZLQRKXMCD-QMMMGPOBSA-N 1 1 347.202 2.206 20 5 EEBDMO N[C@H](CCC[NH3+])Nc1ccc(-c2ccc(Cl)c([N+](=O)[O-])c2)nn1 ZINC001159789325 1319992318 /nfs/dbraw/zinc/99/23/18/1319992318.db2.gz SJMHLBBGBGOEPG-ZDUSSCGKSA-N 1 1 336.783 2.141 20 5 EEBDMO COc1cc(N2CCC[N@@H+](Cc3ccncc3)CC2)ncc1[N+](=O)[O-] ZINC001163827860 1321227939 /nfs/dbraw/zinc/22/79/39/1321227939.db2.gz XBQHJNLUYQUCJB-UHFFFAOYSA-N 1 1 343.387 2.106 20 5 EEBDMO [NH3+][C@@H]1CN(C(F)(F)c2ccc([N+](=O)[O-])c(Cl)n2)CCC1(F)F ZINC001164319334 1321350528 /nfs/dbraw/zinc/35/05/28/1321350528.db2.gz CURJAINLBMCWOH-SSDOTTSWSA-N 1 1 342.680 2.361 20 5 EEBDMO [NH3+][C@@H]1CN(c2nc(Cl)nc3ccc([N+](=O)[O-])cc32)CCC1(F)F ZINC001164319587 1321350604 /nfs/dbraw/zinc/35/06/04/1321350604.db2.gz KFWBALPSXZLDDV-SNVBAGLBSA-N 1 1 343.721 2.364 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[NH+](CCc3ccncc3)CC2)n1 ZINC001165059380 1321448916 /nfs/dbraw/zinc/44/89/16/1321448916.db2.gz BIVZKVWIIICKKE-UHFFFAOYSA-N 1 1 341.415 2.366 20 5 EEBDMO Nc1cc(N2C[C@H]3[C@@H](CC[N@H+]3Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC001165084525 1321452143 /nfs/dbraw/zinc/45/21/43/1321452143.db2.gz LEOHZXRQSOUXPM-YOEHRIQHSA-N 1 1 339.399 2.283 20 5 EEBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2ncc([N+](=O)[O-])cc2C)CC1 ZINC001165108078 1321456225 /nfs/dbraw/zinc/45/62/25/1321456225.db2.gz KTPNELPIGOBDEP-HNNXBMFYSA-N 1 1 334.420 2.378 20 5 EEBDMO C[C@@H](CO)C1CC[NH+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC001307905023 1331553828 /nfs/dbraw/zinc/55/38/28/1331553828.db2.gz IBEQIYZRHXGZFN-LBPRGKRZSA-N 1 1 346.387 2.485 20 5 EEBDMO COC(=O)CC(C)(C)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC001324314433 1333656015 /nfs/dbraw/zinc/65/60/15/1333656015.db2.gz JHOQHJFQVVMDMO-UHFFFAOYSA-N 1 1 338.360 2.235 20 5 EEBDMO COc1ccc(NC(=O)c2ccn(-c3cc[nH+]cc3)n2)cc1[N+](=O)[O-] ZINC001324653619 1333731478 /nfs/dbraw/zinc/73/14/78/1333731478.db2.gz FYHYRHKEVGQDBQ-UHFFFAOYSA-N 1 1 339.311 2.436 20 5 EEBDMO Cc1nc(N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC001330589444 1334874425 /nfs/dbraw/zinc/87/44/25/1334874425.db2.gz HENRMDQDVJRDHS-OAHLLOKOSA-N 1 1 327.388 2.404 20 5 EEBDMO O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC001331349045 1335000582 /nfs/dbraw/zinc/00/05/82/1335000582.db2.gz ZAOQEHRRSLSQGF-YESZJQIVSA-N 1 1 329.400 2.395 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C[N@H+]1C1CC1 ZINC001331680144 1335057495 /nfs/dbraw/zinc/05/74/95/1335057495.db2.gz MQRKZLBKRGPFJY-FZMZJTMJSA-N 1 1 330.388 2.245 20 5 EEBDMO C[NH+](C)Cc1cc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)no1 ZINC001337834371 1336742527 /nfs/dbraw/zinc/74/25/27/1336742527.db2.gz RBONSRTUVMEOCC-UHFFFAOYSA-N 1 1 330.344 2.237 20 5 EEBDMO C[C@]([NH3+])(C(=O)N1CC[C@@H](C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC001576081163 1343963355 /nfs/dbraw/zinc/96/33/55/1343963355.db2.gz JHXLNPDWBVTODD-ZWNOBZJWSA-N 1 1 331.294 2.180 20 5 EEBDMO Cn1nc(C2CC2)cc1NC(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC001579992568 1344445507 /nfs/dbraw/zinc/44/55/07/1344445507.db2.gz KUVIFTMMHHZZTC-INIZCTEOSA-N 1 1 329.360 2.018 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nn[nH]n2)cc1NC[C@H]1CC[N@H+]1C1CCCC1 ZINC001607081598 1351410386 /nfs/dbraw/zinc/41/03/86/1351410386.db2.gz HZMIPYJBNSLNQF-CYBMUJFWSA-N 1 1 343.391 2.204 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000850433624 1367142699 /nfs/dbraw/zinc/14/26/99/1367142699.db2.gz OXNMDFVLIIVVIM-AEGPPILISA-N 1 1 335.404 2.117 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)nc1-c1ccccn1 ZINC000853511215 1369343400 /nfs/dbraw/zinc/34/34/00/1369343400.db2.gz KKAMTANAIZQIBH-ZBFHGGJFSA-N 1 1 343.387 2.454 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)nc1-c1ccccn1 ZINC000853511215 1369343404 /nfs/dbraw/zinc/34/34/04/1369343404.db2.gz KKAMTANAIZQIBH-ZBFHGGJFSA-N 1 1 343.387 2.454 20 5 EEBDMO O=C(CC[N@@H+]1CCC[C@@H](CCO)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782488902 1371302027 /nfs/dbraw/zinc/30/20/27/1371302027.db2.gz JPUJRWQPIUYDQS-LBPRGKRZSA-N 1 1 339.367 2.157 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2)C1 ZINC000839537331 1372908565 /nfs/dbraw/zinc/90/85/65/1372908565.db2.gz WSJDFASQMANPAF-LTCOOKNTSA-N 1 1 345.443 2.446 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)C1 ZINC000839537331 1372908568 /nfs/dbraw/zinc/90/85/68/1372908568.db2.gz WSJDFASQMANPAF-LTCOOKNTSA-N 1 1 345.443 2.446 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)C1 ZINC000839537331 1372908573 /nfs/dbraw/zinc/90/85/73/1372908573.db2.gz WSJDFASQMANPAF-LTCOOKNTSA-N 1 1 345.443 2.446 20 5 EEBDMO CCN(CCNC(=O)C[N@@H+](C)C(C)C)c1ccc(C)cc1[N+](=O)[O-] ZINC001100546898 1373077096 /nfs/dbraw/zinc/07/70/96/1373077096.db2.gz XBGFYATULFSQPD-UHFFFAOYSA-N 1 1 336.436 2.186 20 5 EEBDMO CN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001753059814 1406651560 /nfs/dbraw/zinc/65/15/60/1406651560.db2.gz WHTAEOMZLLOSGI-UHFFFAOYSA-N 1 1 348.447 2.017 20 5 EEBDMO CC(C)OCC(=O)N1CCC([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001755527494 1407589473 /nfs/dbraw/zinc/58/94/73/1407589473.db2.gz FPYNTUSMPSAYEV-UHFFFAOYSA-N 1 1 349.431 2.443 20 5 EEBDMO O=[N+]([O-])c1ccnc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164725221 720332814 /nfs/dbraw/zinc/33/28/14/720332814.db2.gz MRDCRFZJXFWONI-HZPDHXFCSA-N 1 1 325.372 2.238 20 5 EEBDMO C[N@@H+](C[C@H]1CCCOC1)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000154741244 769166651 /nfs/dbraw/zinc/16/66/51/769166651.db2.gz FPZCFDQUQCNYRQ-CQSZACIVSA-N 1 1 348.403 2.153 20 5 EEBDMO Cc1ccoc1C(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001031549362 769541481 /nfs/dbraw/zinc/54/14/81/769541481.db2.gz KZQJTIJRWXHFTJ-UHFFFAOYSA-N 1 1 329.356 2.358 20 5 EEBDMO Cc1ccc(C[N@H+]2CCCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c(C)c1 ZINC000981138678 776585530 /nfs/dbraw/zinc/58/55/30/776585530.db2.gz XRCOYNJKNSTDTH-IAGOWNOFSA-N 1 1 331.416 2.003 20 5 EEBDMO Cc1ccc(C[N@@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC000981138678 776585541 /nfs/dbraw/zinc/58/55/41/776585541.db2.gz XRCOYNJKNSTDTH-IAGOWNOFSA-N 1 1 331.416 2.003 20 5 EEBDMO Cc1ccc(C[N@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC000981138678 776585553 /nfs/dbraw/zinc/58/55/53/776585553.db2.gz XRCOYNJKNSTDTH-IAGOWNOFSA-N 1 1 331.416 2.003 20 5 EEBDMO CSCC(=O)N1CC2(C1)CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C2 ZINC000981607641 777766215 /nfs/dbraw/zinc/76/62/15/777766215.db2.gz 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343.431 2.492 20 5 EEBDMO CC(C)N1CCN(C(=O)c2ccc(O[C@H](C)C[N+](C)(C)C)cc2)CC1 ZINC001234903668 1305048523 /nfs/dbraw/zinc/04/85/23/1305048523.db2.gz KUMSBROVYGQCNK-QGZVFWFLSA-N 1 1 348.511 2.326 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(Cn3ncc4cc([N+](=O)[O-])cc(Cl)c43)C[C@@H]21 ZINC000840133052 1315303959 /nfs/dbraw/zinc/30/39/59/1315303959.db2.gz OASRHQZBJRCTJS-YGRLFVJLSA-N 1 1 335.795 2.191 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCN4CCC3CC4)CC2)cc1 ZINC001254479551 1318083557 /nfs/dbraw/zinc/08/35/57/1318083557.db2.gz FDOUYRMSBDXFAO-UHFFFAOYSA-N 1 1 330.432 2.344 20 5 EEBDMO CCO[C@@H]1C[C@H]2CN([C@@H](C)Cc3ccccc3[N+](=O)[O-])CC[N@H+]2C1 ZINC001254556927 1318120684 /nfs/dbraw/zinc/12/06/84/1318120684.db2.gz NHCDWJORLKVGFY-BHYGNILZSA-N 1 1 333.432 2.321 20 5 EEBDMO Cc1ccnc(N2CC[NH+]([C@H](C)Cc3ccccc3[N+](=O)[O-])CC2)n1 ZINC001254568540 1318125124 /nfs/dbraw/zinc/12/51/24/1318125124.db2.gz GXOIXZURJKLMEZ-OAHLLOKOSA-N 1 1 341.415 2.446 20 5 EEBDMO 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C[NH+](C)Cc1cc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)no1 ZINC001319984929 1332806301 /nfs/dbraw/zinc/80/63/01/1332806301.db2.gz KJWUJCJEABCQRI-UHFFFAOYSA-N 1 1 344.371 2.449 20 5 EEBDMO CC1(C)CCC[N@H+]1CCNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC001330819022 1334909062 /nfs/dbraw/zinc/90/90/62/1334909062.db2.gz OOOZYXFZTRLDIJ-UHFFFAOYSA-N 1 1 335.404 2.354 20 5 EEBDMO COc1ccc(NC(=O)c2ccn(-c3cc[nH+]cc3)n2)c([N+](=O)[O-])c1 ZINC001339126002 1336963282 /nfs/dbraw/zinc/96/32/82/1336963282.db2.gz OMAZBLIBPOVWDI-UHFFFAOYSA-N 1 1 339.311 2.436 20 5 EEBDMO CC[N@H+]1CCN(c2nnc(-c3cc(C)cc([N+](=O)[O-])c3)n2C)C[C@H]1C ZINC001339172877 1336970756 /nfs/dbraw/zinc/97/07/56/1336970756.db2.gz JXBCORDQQFQUNF-CYBMUJFWSA-N 1 1 344.419 2.229 20 5 EEBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001339467608 1337009475 /nfs/dbraw/zinc/00/94/75/1337009475.db2.gz ORDDYQJEHZRZFJ-GUTXKFCHSA-N 1 1 348.451 2.089 20 5 EEBDMO C[C@@]([NH3+])(C(=O)N[C@H]1CC(=O)c2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC001576081130 1343963052 /nfs/dbraw/zinc/96/30/52/1343963052.db2.gz IYZNTGOKXJHPOY-YJBOKZPZSA-N 1 1 339.351 2.213 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C(=O)Nc2cc3n(n2)CC[NH2+]C3)cc1Cl ZINC001579642472 1344402270 /nfs/dbraw/zinc/40/22/70/1344402270.db2.gz HYDQKWFTZNUOKZ-UHFFFAOYSA-N 1 1 335.751 2.109 20 5 EEBDMO CC[N@H+]1CCC[C@H](CNc2cc(C)c([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC001590731853 1349394031 /nfs/dbraw/zinc/39/40/31/1349394031.db2.gz AAAAMJUTENTADL-GFCCVEGCSA-N 1 1 345.407 2.227 20 5 EEBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000828833521 1372252874 /nfs/dbraw/zinc/25/28/74/1372252874.db2.gz HFYVDVSSDCSVGY-LLVKDONJSA-N 1 1 338.383 2.014 20 5 EEBDMO C[C@@H]1[C@H](C)N(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC[N@@H+]1C ZINC000839536230 1372908893 /nfs/dbraw/zinc/90/88/93/1372908893.db2.gz LRSALAOXGUTPQY-MNOVXSKESA-N 1 1 340.811 2.211 20 5 EEBDMO C[N@@H+](CCNC(=O)c1ccc(Cl)[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC001753063620 1406656735 /nfs/dbraw/zinc/65/67/35/1406656735.db2.gz YQAYYNAIACBDFU-UHFFFAOYSA-N 1 1 336.779 2.438 20 5 EEBDMO Cc1ccnc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c1[N+](=O)[O-] ZINC001164791495 721399438 /nfs/dbraw/zinc/39/94/38/721399438.db2.gz YTVXDDQRPDQACT-STQMWFEESA-N 1 1 345.428 2.323 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)N(C)CCCN(C)c1ccccc1[N+](=O)[O-] ZINC001112093462 769562274 /nfs/dbraw/zinc/56/22/74/769562274.db2.gz WFOZMOVLIOCHCT-UHFFFAOYSA-N 1 1 336.436 2.220 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2C2CC2)CC1 ZINC000981138178 776584691 /nfs/dbraw/zinc/58/46/91/776584691.db2.gz OSBBRXRNPMKNII-QZTJIDSGSA-N 1 1 343.427 2.264 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](Cc2ccccc2C2CC2)CC1 ZINC000981138178 776584703 /nfs/dbraw/zinc/58/47/03/776584703.db2.gz OSBBRXRNPMKNII-QZTJIDSGSA-N 1 1 343.427 2.264 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2C2CC2)CC1 ZINC000981138178 776584713 /nfs/dbraw/zinc/58/47/13/776584713.db2.gz OSBBRXRNPMKNII-QZTJIDSGSA-N 1 1 343.427 2.264 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CCC1=CCCCC1)C2 ZINC000981765187 778161575 /nfs/dbraw/zinc/16/15/75/778161575.db2.gz TYKKZUCZOVXYIB-IAGOWNOFSA-N 1 1 347.459 2.467 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@H+](CCC1=CCCCC1)C2 ZINC000981765187 778161580 /nfs/dbraw/zinc/16/15/80/778161580.db2.gz TYKKZUCZOVXYIB-IAGOWNOFSA-N 1 1 347.459 2.467 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CCC1=CCCCC1)C2 ZINC000981765187 778161582 /nfs/dbraw/zinc/16/15/82/778161582.db2.gz TYKKZUCZOVXYIB-IAGOWNOFSA-N 1 1 347.459 2.467 20 5 EEBDMO CC[N@@H+]1CC[C@@H]1CNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000893872983 780262930 /nfs/dbraw/zinc/26/29/30/780262930.db2.gz MXLHMCSAFMOKAE-CQSZACIVSA-N 1 1 340.383 2.481 20 5 EEBDMO CC[N@H+]1CC[C@@H]1CNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000893872983 780262937 /nfs/dbraw/zinc/26/29/37/780262937.db2.gz MXLHMCSAFMOKAE-CQSZACIVSA-N 1 1 340.383 2.481 20 5 EEBDMO C[N@H+]1C[C@H]2CCN(c3ccc([N+](=O)[O-])cc3Br)[C@H]2C1 ZINC000893938140 780320598 /nfs/dbraw/zinc/32/05/98/780320598.db2.gz BSBWYUOBKAWLJJ-RNCFNFMXSA-N 1 1 326.194 2.498 20 5 EEBDMO Cc1ccnc(NCCCN(C)C(=O)C[N@@H+](C)C2CCC2)c1[N+](=O)[O-] ZINC001109653289 805831619 /nfs/dbraw/zinc/83/16/19/805831619.db2.gz QPBRMLIFFKXBSP-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO C[C@H](CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@H]1C ZINC000825046486 788414706 /nfs/dbraw/zinc/41/47/06/788414706.db2.gz URPXOXJCMOKFFV-IOASZLSFSA-N 1 1 335.404 2.007 20 5 EEBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825394330 788609335 /nfs/dbraw/zinc/60/93/35/788609335.db2.gz ZJFALDSQTWSSCS-BBRMVZONSA-N 1 1 349.431 2.255 20 5 EEBDMO C[C@@H]1CCN(Cn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000173532870 791862909 /nfs/dbraw/zinc/86/29/09/791862909.db2.gz XQKXAGYRRZEPET-OAHLLOKOSA-N 1 1 329.404 2.345 20 5 EEBDMO Cc1ccc(NCCNC(=O)C[N@H+]2CCC(C)(C)C2)c([N+](=O)[O-])c1 ZINC001094140913 795991242 /nfs/dbraw/zinc/99/12/42/795991242.db2.gz ZQAKSEXVRHTUTQ-UHFFFAOYSA-N 1 1 334.420 2.163 20 5 EEBDMO Cc1ccc(NCCNC(=O)C[N@H+](C)CC(C)(C)C)c([N+](=O)[O-])c1 ZINC001094141200 795992155 /nfs/dbraw/zinc/99/21/55/795992155.db2.gz KBRUBOIBTCFGJL-UHFFFAOYSA-N 1 1 336.436 2.409 20 5 EEBDMO C[N@@H+](CC(=O)NCC1(Nc2ncccc2[N+](=O)[O-])CC1)CC(C)(C)C ZINC001110357711 802347989 /nfs/dbraw/zinc/34/79/89/802347989.db2.gz GVAVMKZAUUFLRX-UHFFFAOYSA-N 1 1 349.435 2.028 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2C[C@H](Oc3cccnc3)[C@H]3OCCC[C@@H]32)C1 ZINC001169017519 803586466 /nfs/dbraw/zinc/58/64/66/803586466.db2.gz AGMLSBVTPANWPD-SRIISGBFSA-N 1 1 347.415 2.138 20 5 EEBDMO CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2cnn(CC)c21 ZINC001169019743 803587922 /nfs/dbraw/zinc/58/79/22/803587922.db2.gz JEMHBRKDDKCQCL-VNQPRFMTSA-N 1 1 336.436 2.284 20 5 EEBDMO CC(C)N1CCOC[C@]2(CCC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)C1 ZINC001169019451 803587948 /nfs/dbraw/zinc/58/79/48/803587948.db2.gz IDLGQOWVFBBRSB-RCCFBDPRSA-N 1 1 339.480 2.255 20 5 EEBDMO O=C(Cc1ccccc1)N1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169047032 803593042 /nfs/dbraw/zinc/59/30/42/803593042.db2.gz QAELIGPWQJWEEH-ZWKOTPCHSA-N 1 1 345.443 2.209 20 5 EEBDMO CN(CC1CC[NH+](C)CC1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000103461989 804213551 /nfs/dbraw/zinc/21/35/51/804213551.db2.gz KQSIBRUDMVBCEE-UHFFFAOYSA-N 1 1 344.419 2.084 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)[C@@H]2CCCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000426208239 241234815 /nfs/dbraw/zinc/23/48/15/241234815.db2.gz BRERKGWBTFEJFT-APHBMKBZSA-N 1 1 335.404 2.466 20 5 EEBDMO O=C(C[N@@H+]1CC[C@H]2CCC[C@H]21)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000426480202 241294961 /nfs/dbraw/zinc/29/49/61/241294961.db2.gz QTMAINWNKGDNBF-ZYHUDNBSSA-N 1 1 333.344 2.136 20 5 EEBDMO O=C(C[N@H+]1CC[C@H]2CCC[C@H]21)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000426480202 241294964 /nfs/dbraw/zinc/29/49/64/241294964.db2.gz 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BIGVRJULSIGFRE-GFCCVEGCSA-N 1 1 333.388 2.160 20 5 EEBDMO Cc1c(C[NH+]2CCC[C@H]([N@H+](C)CC(=O)[O-])CC2)cccc1[N+](=O)[O-] ZINC000192001623 464845282 /nfs/dbraw/zinc/84/52/82/464845282.db2.gz CUOHTQWTFIVIDW-HNNXBMFYSA-N 1 1 335.404 2.274 20 5 EEBDMO Cc1c(C[NH+]2CCC[C@H]([N@@H+](C)CC(=O)[O-])CC2)cccc1[N+](=O)[O-] ZINC000192001623 464845288 /nfs/dbraw/zinc/84/52/88/464845288.db2.gz CUOHTQWTFIVIDW-HNNXBMFYSA-N 1 1 335.404 2.274 20 5 EEBDMO Cc1c(C[N@H+]2CCC[C@H]([NH+](C)CC(=O)[O-])CC2)cccc1[N+](=O)[O-] ZINC000192001623 464845290 /nfs/dbraw/zinc/84/52/90/464845290.db2.gz CUOHTQWTFIVIDW-HNNXBMFYSA-N 1 1 335.404 2.274 20 5 EEBDMO Cc1c(C[N@@H+]2CCC[C@H]([NH+](C)CC(=O)[O-])CC2)cccc1[N+](=O)[O-] ZINC000192001623 464845295 /nfs/dbraw/zinc/84/52/95/464845295.db2.gz CUOHTQWTFIVIDW-HNNXBMFYSA-N 1 1 335.404 2.274 20 5 EEBDMO C[C@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)N1CCN(C)CC1 ZINC000192832471 465007331 /nfs/dbraw/zinc/00/73/31/465007331.db2.gz LYBLEZMATROGFF-RDTXWAMCSA-N 1 1 332.448 2.198 20 5 EEBDMO C[C@@H](C1CCC1)[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000357012282 465699629 /nfs/dbraw/zinc/69/96/29/465699629.db2.gz QQLILWXTACGHQM-JTQLQIEISA-N 1 1 335.360 2.382 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C[C@H]1C ZINC000330552030 465701537 /nfs/dbraw/zinc/70/15/37/465701537.db2.gz FFCFMJJECBICPA-ZIAGYGMSSA-N 1 1 334.420 2.256 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@H]1C ZINC000330560104 465707049 /nfs/dbraw/zinc/70/70/49/465707049.db2.gz IOUCMZWVPSJDFA-KGLIPLIRSA-N 1 1 334.420 2.256 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000330560105 465707185 /nfs/dbraw/zinc/70/71/85/465707185.db2.gz IOUCMZWVPSJDFA-UONOGXRCSA-N 1 1 334.420 2.256 20 5 EEBDMO Cn1cc([C@H](O)C[C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)cn1 ZINC000371335464 465723102 /nfs/dbraw/zinc/72/31/02/465723102.db2.gz LFBSKENRBRUMOE-DOTOQJQBSA-N 1 1 330.388 2.416 20 5 EEBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCn1cc[nH+]c1C ZINC000361158418 465806919 /nfs/dbraw/zinc/80/69/19/465806919.db2.gz DPNFELOWGGUCLF-OAHLLOKOSA-N 1 1 330.388 2.485 20 5 EEBDMO CC[C@H]1C[C@@H](C)C[N@@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000330843275 465827481 /nfs/dbraw/zinc/82/74/81/465827481.db2.gz MVTYEOMWCHXXKY-OLZOCXBDSA-N 1 1 326.418 2.489 20 5 EEBDMO CC[C@H]1C[C@@H](C)C[N@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000330843275 465827485 /nfs/dbraw/zinc/82/74/85/465827485.db2.gz MVTYEOMWCHXXKY-OLZOCXBDSA-N 1 1 326.418 2.489 20 5 EEBDMO O=[N+]([O-])c1cccc2ncnc(NCCc3cn4c([nH+]3)CCCC4)c21 ZINC000357300277 465925471 /nfs/dbraw/zinc/92/54/71/465925471.db2.gz HGNZMQHHAINDEU-UHFFFAOYSA-N 1 1 338.371 2.725 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCCCC[C@H]2CO)cccc1[N+](=O)[O-] ZINC000594016679 468461400 /nfs/dbraw/zinc/46/14/00/468461400.db2.gz DNPJLQWPRUJXMH-AWEZNQCLSA-N 1 1 335.404 2.469 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCCC[C@@H]1CO ZINC000594017377 468462780 /nfs/dbraw/zinc/46/27/80/468462780.db2.gz XLCATXMOVZGTOH-OAHLLOKOSA-N 1 1 335.404 2.469 20 5 EEBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000346200033 465984258 /nfs/dbraw/zinc/98/42/58/465984258.db2.gz QSGGVHHDXSXLFB-ZQIUZPCESA-N 1 1 347.415 2.162 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+]([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000346238256 466017183 /nfs/dbraw/zinc/01/71/83/466017183.db2.gz OHVSMRRZPMZZBH-XJKCOSOUSA-N 1 1 347.415 2.406 20 5 EEBDMO C[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1O ZINC000349379614 466090060 /nfs/dbraw/zinc/09/00/60/466090060.db2.gz CGTHMHKHLROFTH-BLLLJJGKSA-N 1 1 330.388 2.198 20 5 EEBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@H](C)C[N@H+](C)C(C)C ZINC000349796957 466244632 /nfs/dbraw/zinc/24/46/32/466244632.db2.gz DCMNGTWMYBAGNN-CYBMUJFWSA-N 1 1 343.449 2.219 20 5 EEBDMO C[C@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000331978978 466332386 /nfs/dbraw/zinc/33/23/86/466332386.db2.gz DZQPSPZHLOWXMU-LSDHHAIUSA-N 1 1 346.431 2.482 20 5 EEBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000305236267 466388253 /nfs/dbraw/zinc/38/82/53/466388253.db2.gz XKZXTKOZDPQNPH-STQMWFEESA-N 1 1 349.387 2.128 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000332220057 466453828 /nfs/dbraw/zinc/45/38/28/466453828.db2.gz AGAILKHJXGIMTH-QGZVFWFLSA-N 1 1 344.415 2.348 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H]1CCCC[C@H]1O ZINC000305811847 466471354 /nfs/dbraw/zinc/47/13/54/466471354.db2.gz MOKOFVMLPKBKOK-DVOMOZLQSA-N 1 1 335.404 2.405 20 5 EEBDMO C[N@H+]1CC[C@](O)(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000358174198 466513997 /nfs/dbraw/zinc/51/39/97/466513997.db2.gz XXJNHPWOQOZMJR-KRWDZBQOSA-N 1 1 331.372 2.011 20 5 EEBDMO Cn1cc[nH+]c1N1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000597253613 468497666 /nfs/dbraw/zinc/49/76/66/468497666.db2.gz FGRKAFFQKJNYAN-GQCTYLIASA-N 1 1 327.388 2.164 20 5 EEBDMO Cc1c(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000363935979 466660893 /nfs/dbraw/zinc/66/08/93/466660893.db2.gz CXXZXYYDHZILSG-RYUDHWBXSA-N 1 1 348.359 2.168 20 5 EEBDMO COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@H](C)[N@@H+]2Cc2cccc([N+](=O)[O-])c2)O1 ZINC000374635465 466700655 /nfs/dbraw/zinc/70/06/55/466700655.db2.gz HQEWSXMSFHWUGR-SRMUXQRQSA-N 1 1 334.372 2.278 20 5 EEBDMO COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@H](C)[N@H+]2Cc2cccc([N+](=O)[O-])c2)O1 ZINC000374635465 466700659 /nfs/dbraw/zinc/70/06/59/466700659.db2.gz HQEWSXMSFHWUGR-SRMUXQRQSA-N 1 1 334.372 2.278 20 5 EEBDMO Cn1cc[nH+]c1[C@@H]1CCCN(c2nc3sccn3c2[N+](=O)[O-])C1 ZINC000369364332 466728969 /nfs/dbraw/zinc/72/89/69/466728969.db2.gz WHBIVQCUENVPEE-SNVBAGLBSA-N 1 1 332.389 2.422 20 5 EEBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000411974452 466953887 /nfs/dbraw/zinc/95/38/87/466953887.db2.gz YQLXNKJWPMINAU-SFHVURJKSA-N 1 1 343.358 2.363 20 5 EEBDMO NC(=O)[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000411977908 466955883 /nfs/dbraw/zinc/95/58/83/466955883.db2.gz KVOXYZJQQBFVLX-JKSUJKDBSA-N 1 1 325.368 2.296 20 5 EEBDMO NC(=O)[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000411985199 466957174 /nfs/dbraw/zinc/95/71/74/466957174.db2.gz SEJFWCCCDWBTOT-ZWKOTPCHSA-N 1 1 339.395 2.338 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000412060084 466988491 /nfs/dbraw/zinc/98/84/91/466988491.db2.gz DUWRNMNMLJOAIB-QGZVFWFLSA-N 1 1 349.387 2.117 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000412060084 466988495 /nfs/dbraw/zinc/98/84/95/466988495.db2.gz DUWRNMNMLJOAIB-QGZVFWFLSA-N 1 1 349.387 2.117 20 5 EEBDMO CC[C@@H]1CN(c2ccc([N+](=O)[O-])c3ncccc32)CC[N@H+]1C[C@@H](C)O ZINC000413129289 467175449 /nfs/dbraw/zinc/17/54/49/467175449.db2.gz LHLQBWRPTDAFPA-ZIAGYGMSSA-N 1 1 344.415 2.424 20 5 EEBDMO C[C@@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])c2ncccc12 ZINC000413281568 467206449 /nfs/dbraw/zinc/20/64/49/467206449.db2.gz NGRUPLDXKMUGHM-KGLIPLIRSA-N 1 1 342.399 2.442 20 5 EEBDMO C[C@@H](CN1CC[NH+](C)CC1)Nc1ccnc2c1cccc2[N+](=O)[O-] ZINC000432339319 467233408 /nfs/dbraw/zinc/23/34/08/467233408.db2.gz YRDIUBUAOVBSBM-ZDUSSCGKSA-N 1 1 329.404 2.191 20 5 EEBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](n2cc(C[NH3+])nn2)C1 ZINC000420376153 467384682 /nfs/dbraw/zinc/38/46/82/467384682.db2.gz JQGKKHTWIRWRKD-JSGCOSHPSA-N 1 1 330.392 2.043 20 5 EEBDMO COc1ccc(CN2CCC([C@H]3OCCC[C@H]3[NH3+])CC2)cc1[N+](=O)[O-] ZINC000415100450 467489298 /nfs/dbraw/zinc/48/92/98/467489298.db2.gz AIYKZQLBINJBHW-CRAIPNDOSA-N 1 1 349.431 2.322 20 5 EEBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000448979122 467610477 /nfs/dbraw/zinc/61/04/77/467610477.db2.gz GIMMCQNQJOABQR-ZDUSSCGKSA-N 1 1 333.388 2.110 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)/C=C/c3ccc(F)cc3[N+](=O)[O-])C2)C1 ZINC000492921881 467795635 /nfs/dbraw/zinc/79/56/35/467795635.db2.gz MFLSJWSUFRXHOL-NJELEJDNSA-N 1 1 333.363 2.301 20 5 EEBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])cn2C)C1 ZINC000517648882 468092233 /nfs/dbraw/zinc/09/22/33/468092233.db2.gz MFSFWVRIWXMTOP-UKRRQHHQSA-N 1 1 342.399 2.499 20 5 EEBDMO O=C(NC[C@@H]1CCC[N@H+]1CC1CCCCC1)c1c[nH]nc1[N+](=O)[O-] ZINC000549183023 468175583 /nfs/dbraw/zinc/17/55/83/468175583.db2.gz CUGXSOZLWLEUMM-ZDUSSCGKSA-N 1 1 335.408 2.092 20 5 EEBDMO CCN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000549724349 468193957 /nfs/dbraw/zinc/19/39/57/468193957.db2.gz SJKLMOFBKFAOCB-AWEZNQCLSA-N 1 1 343.387 2.055 20 5 EEBDMO Cc1cc(OCC(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-] ZINC000594195348 468508709 /nfs/dbraw/zinc/50/87/09/468508709.db2.gz FZRZICZNPDJQCF-NVXWUHKLSA-N 1 1 347.415 2.415 20 5 EEBDMO O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594201135 468510568 /nfs/dbraw/zinc/51/05/68/468510568.db2.gz NZCLNSHXLJUQEW-CVEARBPZSA-N 1 1 333.388 2.107 20 5 EEBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1n[nH]c3ccc([N+](=O)[O-])cc31)C2 ZINC000597717011 468648665 /nfs/dbraw/zinc/64/86/65/468648665.db2.gz VWDDJWHLCWHEIK-QGZVFWFLSA-N 1 1 343.387 2.029 20 5 EEBDMO C[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)c1[nH]nc3ccc([N+](=O)[O-])cc31)C2 ZINC000597717011 468648671 /nfs/dbraw/zinc/64/86/71/468648671.db2.gz VWDDJWHLCWHEIK-QGZVFWFLSA-N 1 1 343.387 2.029 20 5 EEBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1[nH]nc3ccc([N+](=O)[O-])cc31)C2 ZINC000597717011 468648676 /nfs/dbraw/zinc/64/86/76/468648676.db2.gz VWDDJWHLCWHEIK-QGZVFWFLSA-N 1 1 343.387 2.029 20 5 EEBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H](C)C[NH+]1CCOCC1 ZINC000600839901 468668960 /nfs/dbraw/zinc/66/89/60/468668960.db2.gz WDRJQZNVYPOJPZ-OAHLLOKOSA-N 1 1 349.431 2.300 20 5 EEBDMO [NH3+]Cc1noc(CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000592357553 468682043 /nfs/dbraw/zinc/68/20/43/468682043.db2.gz VRTFIMVZDKRAMP-UHFFFAOYSA-N 1 1 331.254 2.110 20 5 EEBDMO CCC[N@H+]1CC[C@H](N[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000595097593 468758464 /nfs/dbraw/zinc/75/84/64/468758464.db2.gz YUCIFEOVTWFSHO-RDJZCZTQSA-N 1 1 343.431 2.492 20 5 EEBDMO C[C@@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCS1(=O)=O ZINC000601155757 468763189 /nfs/dbraw/zinc/76/31/89/468763189.db2.gz MQRZLIYARJLOLW-LLVKDONJSA-N 1 1 335.385 2.156 20 5 EEBDMO Cc1noc(CN2CC[N@@H+](C)C[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000595561815 468903253 /nfs/dbraw/zinc/90/32/53/468903253.db2.gz DVEYUTCVQUNCGL-OAHLLOKOSA-N 1 1 330.388 2.250 20 5 EEBDMO Cc1noc(CN2CC[N@H+](C)C[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000595561815 468903259 /nfs/dbraw/zinc/90/32/59/468903259.db2.gz DVEYUTCVQUNCGL-OAHLLOKOSA-N 1 1 330.388 2.250 20 5 EEBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000561617583 468904401 /nfs/dbraw/zinc/90/44/01/468904401.db2.gz ZQJDGKIIVSVZNR-AWEZNQCLSA-N 1 1 332.404 2.335 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000561617583 468904403 /nfs/dbraw/zinc/90/44/03/468904403.db2.gz 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CCC[C@@]1(C(=O)OCC)CCC[N@H+]1CCn1c(C)ncc1[N+](=O)[O-] ZINC000602819950 469095351 /nfs/dbraw/zinc/09/53/51/469095351.db2.gz VRPPCPKTMFCDFU-INIZCTEOSA-N 1 1 338.408 2.298 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)C[C@@H](C)C(=O)OC(C)(C)C ZINC000602841841 469110931 /nfs/dbraw/zinc/11/09/31/469110931.db2.gz WBHSULUJMUOUHI-LLVKDONJSA-N 1 1 326.397 2.009 20 5 EEBDMO COc1ccc(OCCN2CCC[C@@H](C)[C@H]2CC[NH3+])c([N+](=O)[O-])c1 ZINC000593733408 469115031 /nfs/dbraw/zinc/11/50/31/469115031.db2.gz MNOLDLDJQLZTAF-UKRRQHHQSA-N 1 1 337.420 2.432 20 5 EEBDMO Cc1cc(NCC[N@H+]2CC[C@@H](O)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000599176368 469150193 /nfs/dbraw/zinc/15/01/93/469150193.db2.gz RRWMLUMFXYISGW-SNVBAGLBSA-N 1 1 333.310 2.401 20 5 EEBDMO C[NH+](C)CC1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000611254591 469210416 /nfs/dbraw/zinc/21/04/16/469210416.db2.gz WCVPNASAGOZWMK-UHFFFAOYSA-N 1 1 335.404 2.140 20 5 EEBDMO C[C@H]1C[N@H+](CCNc2ccc3cc([N+](=O)[O-])ccc3n2)[C@@H](C)CO1 ZINC000596427950 469263712 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C[C@@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC001326481701 1334102050 /nfs/dbraw/zinc/10/20/50/1334102050.db2.gz JHLMQQJWMZXAHM-SECBINFHSA-N 1 1 331.294 2.390 20 5 EEBDMO Cc1cn2cc(NC(=O)[C@](C)([NH3+])c3cccc([N+](=O)[O-])c3)ccc2n1 ZINC001579819240 1344418024 /nfs/dbraw/zinc/41/80/24/1344418024.db2.gz QWXSCCIKRJPNOF-QGZVFWFLSA-N 1 1 339.355 2.364 20 5 EEBDMO C[C@@H](c1ccncc1)[N@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590052336 1349130907 /nfs/dbraw/zinc/13/09/07/1349130907.db2.gz XZHKVGXAJMTFMO-NSHDSACASA-N 1 1 339.359 2.363 20 5 EEBDMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590052336 1349130908 /nfs/dbraw/zinc/13/09/08/1349130908.db2.gz XZHKVGXAJMTFMO-NSHDSACASA-N 1 1 339.359 2.363 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590258862 1349233137 /nfs/dbraw/zinc/23/31/37/1349233137.db2.gz DBAJFDMOISFYQF-NEPJUHHUSA-N 1 1 345.407 2.307 20 5 EEBDMO 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20 5 EEBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000715696511 795482051 /nfs/dbraw/zinc/48/20/51/795482051.db2.gz LZCPJQZPILKDIB-HNNXBMFYSA-N 1 1 340.383 2.181 20 5 EEBDMO CC(C)c1[nH+]ccn1CC(=O)NCCNc1ccc([N+](=O)[O-])cc1F ZINC001094157980 795971511 /nfs/dbraw/zinc/97/15/11/795971511.db2.gz UYGXZEAMSRPCGR-UHFFFAOYSA-N 1 1 349.366 2.282 20 5 EEBDMO CCCc1ccc(C[NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001002786679 798608464 /nfs/dbraw/zinc/60/84/64/798608464.db2.gz DZEDKLDLKPGPLY-QZTJIDSGSA-N 1 1 345.443 2.385 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CCC[NH2+]CC1CCC1)CC1CCCC1 ZINC001177313793 798852884 /nfs/dbraw/zinc/85/28/84/798852884.db2.gz PXZISBYPFPJUHR-IAGOWNOFSA-N 1 1 337.464 2.450 20 5 EEBDMO Cc1c[nH]c(C(=O)NC2CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)n1 ZINC001003772156 800151688 /nfs/dbraw/zinc/15/16/88/800151688.db2.gz PSIIZRLSFFPKLZ-UHFFFAOYSA-N 1 1 343.387 2.021 20 5 EEBDMO O=C(c1ccco1)N1C[C@H]2CCC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)[C@H]2C1 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CCOC[C@@H]1C[N@@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2nn(CC)cc21 ZINC001169025333 803591044 /nfs/dbraw/zinc/59/10/44/803591044.db2.gz YRRCPUVRBUBYDA-KKUMJFAQSA-N 1 1 336.436 2.284 20 5 EEBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2nn(CC)cc21 ZINC001169025333 803591046 /nfs/dbraw/zinc/59/10/46/803591046.db2.gz YRRCPUVRBUBYDA-KKUMJFAQSA-N 1 1 336.436 2.284 20 5 EEBDMO Cn1cc2c(n1)C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@@H]2COCC1CC1 ZINC001169025246 803591333 /nfs/dbraw/zinc/59/13/33/803591333.db2.gz YITFROKIBPZILZ-ARFHVFGLSA-N 1 1 348.447 2.191 20 5 EEBDMO Cn1cc2c(n1)C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@@H]2COCC1CC1 ZINC001169025246 803591336 /nfs/dbraw/zinc/59/13/36/803591336.db2.gz YITFROKIBPZILZ-ARFHVFGLSA-N 1 1 348.447 2.191 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@H](C)C1 ZINC000793588352 810420422 /nfs/dbraw/zinc/42/04/22/810420422.db2.gz JABHUINSJOHABE-NEPJUHHUSA-N 1 1 327.812 2.135 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CNC(=S)NNc1ccc([N+](=O)[O-])cc1C ZINC000806589082 811943512 /nfs/dbraw/zinc/94/35/12/811943512.db2.gz BFKZNIOYFLNENC-ZDUSSCGKSA-N 1 1 337.449 2.179 20 5 EEBDMO CN(CC[C@@H]1CCCC[N@H+]1C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000173665083 529930235 /nfs/dbraw/zinc/93/02/35/529930235.db2.gz SYSIXELXANWAAW-ZDUSSCGKSA-N 1 1 341.433 2.090 20 5 EEBDMO COc1ccc(C(=O)NCCCCn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000130105689 223121603 /nfs/dbraw/zinc/12/16/03/223121603.db2.gz NMXBEDPLKXICHX-UHFFFAOYSA-N 1 1 332.360 2.319 20 5 EEBDMO COc1ccc(OCCN2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000422635674 240168456 /nfs/dbraw/zinc/16/84/56/240168456.db2.gz LWYVJIQLMXPRBX-MJBXVCDLSA-N 1 1 337.420 2.287 20 5 EEBDMO C[C@H](CO)[N@H+]1CCCN(c2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000450476103 242828850 /nfs/dbraw/zinc/82/88/50/242828850.db2.gz NAMAKTQYHLPMOJ-CYBMUJFWSA-N 1 1 330.388 2.036 20 5 EEBDMO O=C(C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)Nc1ccncc1 ZINC000451552610 243156130 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KIGFOGGECGIQCA-UHFFFAOYSA-N 1 1 331.372 2.394 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000299207061 465648304 /nfs/dbraw/zinc/64/83/04/465648304.db2.gz CVHKBLCFJMBZEA-CQSZACIVSA-N 1 1 335.404 2.273 20 5 EEBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000299226741 465656109 /nfs/dbraw/zinc/65/61/09/465656109.db2.gz QGGPIQIBKSGLFN-KGLIPLIRSA-N 1 1 333.388 2.107 20 5 EEBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000330567879 465710009 /nfs/dbraw/zinc/71/00/09/465710009.db2.gz BOULEDDORWNNJZ-RYUDHWBXSA-N 1 1 331.376 2.169 20 5 EEBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000344612838 465722325 /nfs/dbraw/zinc/72/23/25/465722325.db2.gz JRXSZFFVXQAKAV-CQSZACIVSA-N 1 1 349.387 2.174 20 5 EEBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000371364695 465745201 /nfs/dbraw/zinc/74/52/01/465745201.db2.gz PDBPPTLKICRIRY-ZIAGYGMSSA-N 1 1 342.399 2.362 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)c1 ZINC000330678297 465758598 /nfs/dbraw/zinc/75/85/98/465758598.db2.gz JXGFTWAJLNHHLU-UONOGXRCSA-N 1 1 335.404 2.223 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000371546033 465868480 /nfs/dbraw/zinc/86/84/80/465868480.db2.gz XVVMEPQSFQRXMV-TZMCWYRMSA-N 1 1 339.342 2.430 20 5 EEBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[NH+](C(C)C)CC1 ZINC000301284776 465935377 /nfs/dbraw/zinc/93/53/77/465935377.db2.gz MGWWJQISAGSZAX-UHFFFAOYSA-N 1 1 339.367 2.441 20 5 EEBDMO CCOc1cc(NC2CC[NH+](CCN(C)C)CC2)ccc1[N+](=O)[O-] ZINC000362735159 465985489 /nfs/dbraw/zinc/98/54/89/465985489.db2.gz ILWWGAVSVQFFPZ-UHFFFAOYSA-N 1 1 336.436 2.431 20 5 EEBDMO CC[N@@H+]1CCCC[C@@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301899453 466057646 /nfs/dbraw/zinc/05/76/46/466057646.db2.gz TVYJQVCMXKWJGO-GFCCVEGCSA-N 1 1 341.433 2.285 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301899453 466057656 /nfs/dbraw/zinc/05/76/56/466057656.db2.gz TVYJQVCMXKWJGO-GFCCVEGCSA-N 1 1 341.433 2.285 20 5 EEBDMO CCC[N@H+]1CC[C@@H](CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000301898685 466058018 /nfs/dbraw/zinc/05/80/18/466058018.db2.gz SKHHDPVLAIZKSD-LBPRGKRZSA-N 1 1 341.433 2.142 20 5 EEBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C(=O)N2CCOCC2)C1 ZINC000331432685 466081586 /nfs/dbraw/zinc/08/15/86/466081586.db2.gz JSFLUJRCIAKVBY-LSDHHAIUSA-N 1 1 347.415 2.227 20 5 EEBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000354373968 466517746 /nfs/dbraw/zinc/51/77/46/466517746.db2.gz WOMNRDORAOUHNR-GFCCVEGCSA-N 1 1 338.383 2.310 20 5 EEBDMO O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1 ZINC000370570056 466927093 /nfs/dbraw/zinc/92/70/93/466927093.db2.gz RLZDXAWNTDJDPG-CVEARBPZSA-N 1 1 348.403 2.360 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](CO)[C@H]1C ZINC000412087111 467002987 /nfs/dbraw/zinc/00/29/87/467002987.db2.gz OXFNCHLELNBLLI-ZIAGYGMSSA-N 1 1 335.404 2.325 20 5 EEBDMO CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000374147188 467012834 /nfs/dbraw/zinc/01/28/34/467012834.db2.gz HOFZOBLFAAHKDE-KEYYUXOJSA-N 1 1 334.420 2.461 20 5 EEBDMO CC1(C)C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1 ZINC000377233263 467048557 /nfs/dbraw/zinc/04/85/57/467048557.db2.gz RWJVPSYYXBICNJ-OAHLLOKOSA-N 1 1 333.388 2.201 20 5 EEBDMO CC1(C)C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1 ZINC000377233263 467048567 /nfs/dbraw/zinc/04/85/67/467048567.db2.gz RWJVPSYYXBICNJ-OAHLLOKOSA-N 1 1 333.388 2.201 20 5 EEBDMO C[C@@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)C[C@H](C)[N@@H+]1CCO ZINC000413319285 467215485 /nfs/dbraw/zinc/21/54/85/467215485.db2.gz OLHXPIAUOBFEAK-BETUJISGSA-N 1 1 330.388 2.034 20 5 EEBDMO CC1(C)C[C@H](O)CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000451816474 467268984 /nfs/dbraw/zinc/26/89/84/467268984.db2.gz XGFLHDGIXWFXCL-HZPDHXFCSA-N 1 1 347.415 2.183 20 5 EEBDMO C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000413956899 467350257 /nfs/dbraw/zinc/35/02/57/467350257.db2.gz OSOBURMZJNAHEK-ZDUSSCGKSA-N 1 1 328.372 2.269 20 5 EEBDMO C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000413956899 467350262 /nfs/dbraw/zinc/35/02/62/467350262.db2.gz OSOBURMZJNAHEK-ZDUSSCGKSA-N 1 1 328.372 2.269 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CN1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420380049 467386226 /nfs/dbraw/zinc/38/62/26/467386226.db2.gz BPRLSMKXPKAZQF-CRAIPNDOSA-N 1 1 349.431 2.322 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1C[C@@H](C2CC2)[C@H]1C1CC1 ZINC000453047019 467457528 /nfs/dbraw/zinc/45/75/28/467457528.db2.gz YXKCIWDRQHJJDH-RVKKMQEKSA-N 1 1 332.400 2.455 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000448601598 467595322 /nfs/dbraw/zinc/59/53/22/467595322.db2.gz VQNLEZGRPHPRLY-CQSZACIVSA-N 1 1 343.387 2.199 20 5 EEBDMO CNc1nc(C(=O)NCC[N@@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000455044271 467631530 /nfs/dbraw/zinc/63/15/30/467631530.db2.gz IHCZUCUOKDRYNL-UHFFFAOYSA-N 1 1 335.408 2.026 20 5 EEBDMO CNc1nc(C(=O)N2CCC[N@H+](C3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000455716046 467695888 /nfs/dbraw/zinc/69/58/88/467695888.db2.gz PGCHABIRRSQKML-UHFFFAOYSA-N 1 1 347.419 2.122 20 5 EEBDMO CCOc1cc(C[N@@H+](C)C2(CCO)CCOCC2)ccc1[N+](=O)[O-] ZINC000492776097 467748661 /nfs/dbraw/zinc/74/86/61/467748661.db2.gz UGBOGZHTOAOTTL-UHFFFAOYSA-N 1 1 338.404 2.357 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)NCC[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000458223648 467792448 /nfs/dbraw/zinc/79/24/48/467792448.db2.gz RKADJGJVNIWUOL-ZDUSSCGKSA-N 1 1 335.404 2.455 20 5 EEBDMO COc1ccc(NC(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000487227721 468029283 /nfs/dbraw/zinc/02/92/83/468029283.db2.gz TWOCADJYROHMRY-CQSZACIVSA-N 1 1 336.392 2.407 20 5 EEBDMO CC(C)[C@H]1CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[N@H+]1C ZINC000487947026 468062483 /nfs/dbraw/zinc/06/24/83/468062483.db2.gz KUPPGKQCIIEVFP-MRXNPFEDSA-N 1 1 335.404 2.233 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000518814392 468128341 /nfs/dbraw/zinc/12/83/41/468128341.db2.gz FGUIOPCCISNLCM-RYUDHWBXSA-N 1 1 349.387 2.174 20 5 EEBDMO COCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCO[C@@H]1C ZINC000489429474 468135624 /nfs/dbraw/zinc/13/56/24/468135624.db2.gz NXIKZRTUINQHBC-IAQYHMDHSA-N 1 1 334.376 2.097 20 5 EEBDMO COCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCO[C@@H]1C ZINC000489429474 468135629 /nfs/dbraw/zinc/13/56/29/468135629.db2.gz NXIKZRTUINQHBC-IAQYHMDHSA-N 1 1 334.376 2.097 20 5 EEBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594234476 468523635 /nfs/dbraw/zinc/52/36/35/468523635.db2.gz XJHQUKMSTKJFIM-DOTOQJQBSA-N 1 1 346.431 2.453 20 5 EEBDMO O=C(C1CC1)N1CCC(Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000601103071 468741144 /nfs/dbraw/zinc/74/11/44/468741144.db2.gz MUPXGIBVCILIRQ-UHFFFAOYSA-N 1 1 340.383 2.378 20 5 EEBDMO C[C@H](C(=O)NCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000583849040 468763723 /nfs/dbraw/zinc/76/37/23/468763723.db2.gz CXFUNVNJJDGSIV-ZNMIVQPWSA-N 1 1 349.431 2.314 20 5 EEBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595465175 468863771 /nfs/dbraw/zinc/86/37/71/468863771.db2.gz HANYOGLWENGCOR-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO CN(CC[N@H+]1CCOC(C)(C)C1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595465175 468863777 /nfs/dbraw/zinc/86/37/77/468863777.db2.gz HANYOGLWENGCOR-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595474541 468867574 /nfs/dbraw/zinc/86/75/74/468867574.db2.gz WMHBRZPOLGJZKI-GFCCVEGCSA-N 1 1 325.384 2.011 20 5 EEBDMO Cc1ccc(CS(=O)(=O)Cc2cc(O)ccc2[N+](=O)[O-])c(C)n1 ZINC000593207151 468904357 /nfs/dbraw/zinc/90/43/57/468904357.db2.gz YYOHXGZLMASITM-UHFFFAOYSA-N 1 1 336.369 2.427 20 5 EEBDMO COc1cc(C(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000598558808 468912311 /nfs/dbraw/zinc/91/23/11/468912311.db2.gz DLZOTYOCWQUGET-AWEZNQCLSA-N 1 1 347.415 2.455 20 5 EEBDMO COC(=O)c1ccnc(NC[C@@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-] ZINC000598619090 468935965 /nfs/dbraw/zinc/93/59/65/468935965.db2.gz ABFMCMBZJGDUFM-LBPRGKRZSA-N 1 1 334.376 2.205 20 5 EEBDMO C[C@@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1CO ZINC000598675990 468955142 /nfs/dbraw/zinc/95/51/42/468955142.db2.gz CBIMVFPHHSHXFC-CJNGLKHVSA-N 1 1 344.415 2.446 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000601705297 468976257 /nfs/dbraw/zinc/97/62/57/468976257.db2.gz LCRVDLPQUDWMAD-ZFWWWQNUSA-N 1 1 342.399 2.421 20 5 EEBDMO CCc1ccccc1NC(=O)C[N@H+](C)CCn1c(C)ncc1[N+](=O)[O-] ZINC000610680867 469035939 /nfs/dbraw/zinc/03/59/39/469035939.db2.gz VHYFXFIAGPRWDQ-UHFFFAOYSA-N 1 1 345.403 2.233 20 5 EEBDMO CCc1ccccc1NC(=O)C[N@@H+](C)CCn1c(C)ncc1[N+](=O)[O-] ZINC000610680867 469035946 /nfs/dbraw/zinc/03/59/46/469035946.db2.gz VHYFXFIAGPRWDQ-UHFFFAOYSA-N 1 1 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EEBDMO CC(C)(C[NH+]1CCOCC1)Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000308665915 466498220 /nfs/dbraw/zinc/49/82/20/466498220.db2.gz XELYJOVADGIPLG-UHFFFAOYSA-N 1 1 337.405 2.122 20 5 EEBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[N@H+]([C@H](C)CO)CC1 ZINC000347289347 466539663 /nfs/dbraw/zinc/53/96/63/466539663.db2.gz QXXQUVJVTCYOMC-UVQBRAAOSA-N 1 1 333.432 2.387 20 5 EEBDMO C[C@@H](C[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](C)CO)c1ccccc1 ZINC000347363042 466591607 /nfs/dbraw/zinc/59/16/07/466591607.db2.gz JKDOWXXIDMRHOG-LSDHHAIUSA-N 1 1 332.404 2.278 20 5 EEBDMO C[C@@H]1CC[C@H]([N@@H+](CCO)CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000411638761 466862175 /nfs/dbraw/zinc/86/21/75/466862175.db2.gz DZENQIKUFWSLAY-KGLIPLIRSA-N 1 1 335.404 2.406 20 5 EEBDMO Cn1ccnc1[C@@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000365631705 466888070 /nfs/dbraw/zinc/88/80/70/466888070.db2.gz AFULTYGUKFHVCK-GDBMZVCRSA-N 1 1 330.388 2.241 20 5 EEBDMO COc1ccc(NC(=O)CC[N@@H+](C)[C@@H](C)C(C)(C)O)c([N+](=O)[O-])c1 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ZINC000454321999 467584665 /nfs/dbraw/zinc/58/46/65/467584665.db2.gz CIANTHGRKHLJEP-LBPRGKRZSA-N 1 1 335.408 2.026 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(NC[C@H]3CCCn4cc[nH+]c43)n2)cc1 ZINC000446972990 467586773 /nfs/dbraw/zinc/58/67/73/467586773.db2.gz BUDLBYYLFCDPCA-GFCCVEGCSA-N 1 1 340.343 2.831 20 5 EEBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000457933331 467733914 /nfs/dbraw/zinc/73/39/14/467733914.db2.gz DMDNVABQUNTDNP-OAHLLOKOSA-N 1 1 334.420 2.263 20 5 EEBDMO C[C@H]1C[C@H](Nc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000516943393 468057818 /nfs/dbraw/zinc/05/78/18/468057818.db2.gz YJVDXFCBSYNLPM-UWVGGRQHSA-N 1 1 329.360 2.281 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](n3ccnc3)C2)c1 ZINC000589497070 468156839 /nfs/dbraw/zinc/15/68/39/468156839.db2.gz MNRHMXVYFDAYRP-OAHLLOKOSA-N 1 1 344.371 2.415 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](n3ccnc3)C2)c1 ZINC000589497070 468156842 /nfs/dbraw/zinc/15/68/42/468156842.db2.gz MNRHMXVYFDAYRP-OAHLLOKOSA-N 1 1 344.371 2.415 20 5 EEBDMO CC[NH+]1C[C@@H](C)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000594375534 468565853 /nfs/dbraw/zinc/56/58/53/468565853.db2.gz ZWGLYMRWAXTDKW-ZIAGYGMSSA-N 1 1 347.415 2.499 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCNC[C@H]1C(C)C ZINC000600713905 468630270 /nfs/dbraw/zinc/63/02/70/468630270.db2.gz GETIFHLXFYCKJU-INIZCTEOSA-N 1 1 334.420 2.162 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCNC[C@H]1C(C)C ZINC000600713905 468630276 /nfs/dbraw/zinc/63/02/76/468630276.db2.gz GETIFHLXFYCKJU-INIZCTEOSA-N 1 1 334.420 2.162 20 5 EEBDMO Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1ccc(C)cc1[N+](=O)[O-])C2 ZINC000601184043 468774238 /nfs/dbraw/zinc/77/42/38/468774238.db2.gz JMXQWFSPICDXME-ZDUSSCGKSA-N 1 1 330.388 2.370 20 5 EEBDMO Nc1c(C(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)cccc1[N+](=O)[O-] ZINC000598222054 468798255 /nfs/dbraw/zinc/79/82/55/468798255.db2.gz ZHONKAGBVZKJGR-LBPRGKRZSA-N 1 1 332.404 2.314 20 5 EEBDMO CCCN(C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000592829784 468799098 /nfs/dbraw/zinc/79/90/98/468799098.db2.gz YSMOZJBVXDANOQ-CQSZACIVSA-N 1 1 335.404 2.468 20 5 EEBDMO COc1cccc(C(=O)N2CCC3(CCC[N@H+]3C)CC2)c1[N+](=O)[O-] ZINC000571846696 468847339 /nfs/dbraw/zinc/84/73/39/468847339.db2.gz MXGJZRMWCPDIDK-UHFFFAOYSA-N 1 1 333.388 2.304 20 5 EEBDMO CC(C)O[C@@H]1CCC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000593054104 468853466 /nfs/dbraw/zinc/85/34/66/468853466.db2.gz ASOIYKZZJMDPKE-MRXNPFEDSA-N 1 1 347.415 2.373 20 5 EEBDMO CC(C)O[C@@H]1CCC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000593054104 468853472 /nfs/dbraw/zinc/85/34/72/468853472.db2.gz ASOIYKZZJMDPKE-MRXNPFEDSA-N 1 1 347.415 2.373 20 5 EEBDMO CC[N@H+]1CCCN(S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000601439094 468874047 /nfs/dbraw/zinc/87/40/47/468874047.db2.gz BNYASJZXIIIJIZ-ZDUSSCGKSA-N 1 1 341.433 2.008 20 5 EEBDMO C[C@@H]1[C@H](C)N(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)[C@@H](C)C[N@H+]1C ZINC000593188753 468899032 /nfs/dbraw/zinc/89/90/32/468899032.db2.gz PDBKPBVOKNKYHE-MJBXVCDLSA-N 1 1 344.415 2.489 20 5 EEBDMO Cc1cc(OCC(=O)N2[C@H](C)C[N@@H+](C)[C@@H](C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000593189630 468899932 /nfs/dbraw/zinc/89/99/32/468899932.db2.gz WIDGPJAWPMUYFS-HZSPNIEDSA-N 1 1 335.404 2.222 20 5 EEBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598562085 468914375 /nfs/dbraw/zinc/91/43/75/468914375.db2.gz SSHRHGVCYBDZQN-MRXNPFEDSA-N 1 1 331.416 2.376 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCCC[C@H]1[C@@H](C)CO ZINC000595674535 468949169 /nfs/dbraw/zinc/94/91/69/468949169.db2.gz LDYOUVAVFIVRNL-BBRMVZONSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@@H](CO)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000595678117 468951170 /nfs/dbraw/zinc/95/11/70/468951170.db2.gz QXANLEITYIDAMK-ZFWWWQNUSA-N 1 1 335.404 2.406 20 5 EEBDMO C[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]1CCO ZINC000595695885 468958612 /nfs/dbraw/zinc/95/86/12/468958612.db2.gz IXFGTCMNNZKWNQ-LRDDRELGSA-N 1 1 336.388 2.444 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCN1CCOCC1)CC1CC1 ZINC000595806021 469020844 /nfs/dbraw/zinc/02/08/44/469020844.db2.gz DLVMRWFLEVWADE-UHFFFAOYSA-N 1 1 349.431 2.148 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)[C@@](C)(CO)C1 ZINC000595876387 469059372 /nfs/dbraw/zinc/05/93/72/469059372.db2.gz SRYLQAKKILRXQB-CXAGYDPISA-N 1 1 335.404 2.182 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCO)[C@@H]1CCCc2ccccc21 ZINC000602790590 469075814 /nfs/dbraw/zinc/07/58/14/469075814.db2.gz LYXHEPRYUGYDOY-QGZVFWFLSA-N 1 1 344.415 2.472 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000602797656 469082597 /nfs/dbraw/zinc/08/25/97/469082597.db2.gz NPEUSLGDMKTSKT-HOCLYGCPSA-N 1 1 333.436 2.048 20 5 EEBDMO CC1(C)CN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1CCO ZINC000614920121 469094051 /nfs/dbraw/zinc/09/40/51/469094051.db2.gz DVPYOIOYTBHDQF-UHFFFAOYSA-N 1 1 327.812 2.137 20 5 EEBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000614917671 469095329 /nfs/dbraw/zinc/09/53/29/469095329.db2.gz JOBOMEMOEWGMJK-GFCCVEGCSA-N 1 1 348.403 2.013 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])C2)C1 ZINC000593729680 469112713 /nfs/dbraw/zinc/11/27/13/469112713.db2.gz IFZCAUPRTLYTLK-KRWDZBQOSA-N 1 1 335.379 2.221 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000588365274 469143552 /nfs/dbraw/zinc/14/35/52/469143552.db2.gz LQEOACBVJNLZBS-HNNXBMFYSA-N 1 1 334.420 2.263 20 5 EEBDMO COc1cc(Cn2cc(C[NH+]3CCCCC3)nn2)c([N+](=O)[O-])cc1F ZINC000603240121 469319929 /nfs/dbraw/zinc/31/99/29/469319929.db2.gz XEOBSENWFDYHGU-UHFFFAOYSA-N 1 1 349.366 2.368 20 5 EEBDMO Cc1cc(NC(=O)NCC(C)(C)[NH+]2CCN(C)CC2)ccc1[N+](=O)[O-] ZINC000603840138 469435527 /nfs/dbraw/zinc/43/55/27/469435527.db2.gz ITBVBAWKFLHYRJ-UHFFFAOYSA-N 1 1 349.435 2.051 20 5 EEBDMO COc1ccc(CC(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000609016480 469888801 /nfs/dbraw/zinc/88/88/01/469888801.db2.gz FHFNOVBEKIPMLD-KGLIPLIRSA-N 1 1 349.431 2.383 20 5 EEBDMO CC(C)(C)C[N@@H+](CCO)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000609317314 469916423 /nfs/dbraw/zinc/91/64/23/469916423.db2.gz UETKOPWCCFFXEM-UHFFFAOYSA-N 1 1 334.376 2.485 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](CCO)C2)cccc1[N+](=O)[O-] ZINC000610213606 469988448 /nfs/dbraw/zinc/98/84/48/469988448.db2.gz ITXZBUPWTQBDRL-UONOGXRCSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](CCO)C2)cccc1[N+](=O)[O-] ZINC000610213606 469988451 /nfs/dbraw/zinc/98/84/51/469988451.db2.gz ITXZBUPWTQBDRL-UONOGXRCSA-N 1 1 335.404 2.325 20 5 EEBDMO Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000180885578 534741592 /nfs/dbraw/zinc/74/15/92/534741592.db2.gz AAAUASIEQVGIOQ-AWEZNQCLSA-N 1 1 344.371 2.337 20 5 EEBDMO O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1NCC[NH+]1CCCC1 ZINC000171811817 534880522 /nfs/dbraw/zinc/88/05/22/534880522.db2.gz GIBORXWBJDQILI-UHFFFAOYSA-N 1 1 349.359 2.099 20 5 EEBDMO CC1(CO)CC[NH+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000186936245 528002359 /nfs/dbraw/zinc/00/23/59/528002359.db2.gz NVPQYTDIPBRECB-UHFFFAOYSA-N 1 1 332.360 2.239 20 5 EEBDMO CC[NH+](CC)[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccsc1 ZINC000160030113 528247136 /nfs/dbraw/zinc/24/71/36/528247136.db2.gz FMMTVCKQTWCRIK-NSHDSACASA-N 1 1 337.405 2.192 20 5 EEBDMO CC(C)C[C@]1(CO)CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000191651924 528622075 /nfs/dbraw/zinc/62/20/75/528622075.db2.gz VNJPNTLPCYVYRQ-KRWDZBQOSA-N 1 1 335.404 2.406 20 5 EEBDMO CN(C(=O)C[N@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000451419104 535987288 /nfs/dbraw/zinc/98/72/88/535987288.db2.gz NDXGFZIPFASGCD-ZACQAIPSSA-N 1 1 347.415 2.183 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000456352010 536133851 /nfs/dbraw/zinc/13/38/51/536133851.db2.gz MXWPPHMINDWRGZ-AWEZNQCLSA-N 1 1 335.404 2.306 20 5 EEBDMO CNc1nc(C(=O)N2CC[N@@H+](C)CC23CCCCC3)ccc1[N+](=O)[O-] ZINC000455821372 536422816 /nfs/dbraw/zinc/42/28/16/536422816.db2.gz KWGNYLGVDXAGMG-UHFFFAOYSA-N 1 1 347.419 2.122 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)cc1CN1CC[NH+]([C@H]2CCOC2)CC1 ZINC000773483118 577345972 /nfs/dbraw/zinc/34/59/72/577345972.db2.gz NTFPLEREKVWGPM-AWEZNQCLSA-N 1 1 325.796 2.155 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]CCC1(C)OCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000761225942 577679740 /nfs/dbraw/zinc/67/97/40/577679740.db2.gz NIZQBAMDFHCKAE-HNNXBMFYSA-N 1 1 346.387 2.160 20 5 EEBDMO COC(=O)C[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000754540177 577808330 /nfs/dbraw/zinc/80/83/30/577808330.db2.gz OBBBNKYATMMSCF-CYBMUJFWSA-N 1 1 346.343 2.076 20 5 EEBDMO Cc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000741724990 578123069 /nfs/dbraw/zinc/12/30/69/578123069.db2.gz PIGWXGPRSLHUEO-KOLCDFICSA-N 1 1 336.348 2.024 20 5 EEBDMO CN(CC[C@H]1CCCC[N@H+]1C)c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000821599428 599061476 /nfs/dbraw/zinc/06/14/76/599061476.db2.gz TYGBTJIEIOVRIQ-GFCCVEGCSA-N 1 1 345.407 2.086 20 5 EEBDMO O=C(N[C@H]1C[C@@H]([NH2+]Cc2cccc3ccccc32)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001022064093 676628803 /nfs/dbraw/zinc/62/88/03/676628803.db2.gz VVJWXTCRRQNALW-CYGHRXIMSA-N 1 1 339.395 2.242 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21)C1=CCCC1 ZINC001025734977 683253713 /nfs/dbraw/zinc/25/37/13/683253713.db2.gz WTZDJOOWAAZDKO-QLPKVWCKSA-N 1 1 327.384 2.252 20 5 EEBDMO C[N@@H+](CC1CC(C)(C)C1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964503 688718599 /nfs/dbraw/zinc/71/85/99/688718599.db2.gz MLRUGUWQNLLHNF-HZPDHXFCSA-N 1 1 337.464 2.258 20 5 EEBDMO C[N@H+](CC1CC(C)(C)C1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964503 688718601 /nfs/dbraw/zinc/71/86/01/688718601.db2.gz MLRUGUWQNLLHNF-HZPDHXFCSA-N 1 1 337.464 2.258 20 5 EEBDMO C[N@@H+](CC1CC(C)(C)C1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964503 688718605 /nfs/dbraw/zinc/71/86/05/688718605.db2.gz MLRUGUWQNLLHNF-HZPDHXFCSA-N 1 1 337.464 2.258 20 5 EEBDMO C[N@H+](Cc1ccccc1F)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964722 688721655 /nfs/dbraw/zinc/72/16/55/688721655.db2.gz WARFVBBVOVULIP-NVXWUHKLSA-N 1 1 349.406 2.161 20 5 EEBDMO C[N@@H+](Cc1ccccc1F)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964722 688721657 /nfs/dbraw/zinc/72/16/57/688721657.db2.gz WARFVBBVOVULIP-NVXWUHKLSA-N 1 1 349.406 2.161 20 5 EEBDMO C[N@H+](Cc1ccccc1F)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964722 688721661 /nfs/dbraw/zinc/72/16/61/688721661.db2.gz WARFVBBVOVULIP-NVXWUHKLSA-N 1 1 349.406 2.161 20 5 EEBDMO C[C@@H]1CC[N@@H+](CCNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000897454845 690561259 /nfs/dbraw/zinc/56/12/59/690561259.db2.gz LNNBORROGWPSPE-CQSZACIVSA-N 1 1 334.420 2.121 20 5 EEBDMO CC[C@H]1COCC[N@@H+]1CCNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000872773418 1198378736 /nfs/dbraw/zinc/37/87/36/1198378736.db2.gz KWYPNYJDHAJSFS-JTQLQIEISA-N 1 1 337.405 2.122 20 5 EEBDMO CC[C@H]1COCC[N@H+]1CCNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000872773418 1198378743 /nfs/dbraw/zinc/37/87/43/1198378743.db2.gz KWYPNYJDHAJSFS-JTQLQIEISA-N 1 1 337.405 2.122 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)CC[N@H+]1C ZINC000826077309 1200714849 /nfs/dbraw/zinc/71/48/49/1200714849.db2.gz ZAYUUTVGZQQSTR-QWRGUYRKSA-N 1 1 338.383 2.012 20 5 EEBDMO C[C@]([NH3+])(C(=O)N1CCC([C@H]2CCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000870925932 1200960193 /nfs/dbraw/zinc/96/01/93/1200960193.db2.gz VMQQISNBLLLEFT-SJLPKXTDSA-N 1 1 347.415 2.186 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](CF)C1 ZINC000880296915 1201450166 /nfs/dbraw/zinc/45/01/66/1201450166.db2.gz GRXYHPOFBZDCSF-LLVKDONJSA-N 1 1 325.340 2.223 20 5 EEBDMO CC(C)OC1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1 ZINC000867943571 1201711015 /nfs/dbraw/zinc/71/10/15/1201711015.db2.gz ZDANPJLYBNJZPN-QGZVFWFLSA-N 1 1 335.404 2.185 20 5 EEBDMO C[N@@H+](CCCn1ccnc1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000130637561 1201989250 /nfs/dbraw/zinc/98/92/50/1201989250.db2.gz KAXQYFRMTSKLBC-UHFFFAOYSA-N 1 1 341.375 2.029 20 5 EEBDMO C[N@@H+]1CC[C@@H]1CNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000928555978 1206398787 /nfs/dbraw/zinc/39/87/87/1206398787.db2.gz MDGFGWOISODZFD-CYBMUJFWSA-N 1 1 326.356 2.091 20 5 EEBDMO C[N@H+]1CC[C@@H]1CNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000928555978 1206398789 /nfs/dbraw/zinc/39/87/89/1206398789.db2.gz MDGFGWOISODZFD-CYBMUJFWSA-N 1 1 326.356 2.091 20 5 EEBDMO COc1ccc(NC(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000930768497 1206581467 /nfs/dbraw/zinc/58/14/67/1206581467.db2.gz HXIYEWMQVPDHAG-GWCFXTLKSA-N 1 1 334.376 2.208 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC[N@@H+]1C ZINC000159109761 1208429440 /nfs/dbraw/zinc/42/94/40/1208429440.db2.gz YZSRDBNYLLNSAN-SECBINFHSA-N 1 1 342.193 2.133 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000159109761 1208429443 /nfs/dbraw/zinc/42/94/43/1208429443.db2.gz YZSRDBNYLLNSAN-SECBINFHSA-N 1 1 342.193 2.133 20 5 EEBDMO CCCc1[nH]nc(C(=O)OCCCCn2cc[nH+]c2C)c1[N+](=O)[O-] ZINC000796264730 1215660440 /nfs/dbraw/zinc/66/04/40/1215660440.db2.gz BNMUKLBJGPHKLR-UHFFFAOYSA-N 1 1 335.364 2.413 20 5 EEBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796588624 1221450281 /nfs/dbraw/zinc/45/02/81/1221450281.db2.gz VEJNWLLRLQAMFN-HOCLYGCPSA-N 1 1 335.404 2.009 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCCNS(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119360032 1229495198 /nfs/dbraw/zinc/49/51/98/1229495198.db2.gz UAZHQAPFTCMLMU-NSHDSACASA-N 1 1 347.462 2.199 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)N[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C)n2)C1 ZINC001097050054 1243624724 /nfs/dbraw/zinc/62/47/24/1243624724.db2.gz BSPHNHRSPMMDTM-HDJSIYSDSA-N 1 1 349.435 2.089 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)N[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001097078627 1243674919 /nfs/dbraw/zinc/67/49/19/1243674919.db2.gz UMTMFCCPYNQMRE-HDJSIYSDSA-N 1 1 334.420 2.384 20 5 EEBDMO Cc1cc(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c(N)c([N+](=O)[O-])c1 ZINC000855162401 1293094235 /nfs/dbraw/zinc/09/42/35/1293094235.db2.gz XNZUSTZNUHETOD-LBPRGKRZSA-N 1 1 334.420 2.336 20 5 EEBDMO Cc1ccc(Nc2cc(N3CC[NH+](C)CC3)ncn2)cc1[N+](=O)[O-] ZINC001213661732 1296127580 /nfs/dbraw/zinc/12/75/80/1296127580.db2.gz UYGDIBGYJXKGRK-UHFFFAOYSA-N 1 1 328.376 2.189 20 5 EEBDMO CCCSc1nc(O[C@H]2CCC[NH2+]C[C@@H]2F)c([N+](=O)[O-])c(=O)[nH]1 ZINC001217953032 1297534848 /nfs/dbraw/zinc/53/48/48/1297534848.db2.gz ZDAGRDXKSOFEEN-IUCAKERBSA-N 1 1 346.384 2.061 20 5 EEBDMO C[N@@H+]1[C@@H]2C[C@@H](Oc3ncc(C(F)(F)F)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001225843137 1301172246 /nfs/dbraw/zinc/17/22/46/1301172246.db2.gz CVGGPCXLHBYBGV-MKPLZMMCSA-N 1 1 345.277 2.192 20 5 EEBDMO C[N@H+]1[C@@H]2C[C@@H](Oc3ncc(C(F)(F)F)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001225843137 1301172249 /nfs/dbraw/zinc/17/22/49/1301172249.db2.gz CVGGPCXLHBYBGV-MKPLZMMCSA-N 1 1 345.277 2.192 20 5 EEBDMO C[C@@H](c1ccccn1)[N@H+]1CCC[C@@H](Oc2ncc([N+](=O)[O-])cn2)C1 ZINC001226733022 1301531755 /nfs/dbraw/zinc/53/17/55/1301531755.db2.gz FBVYCVYNIWWEQS-GXTWGEPZSA-N 1 1 329.360 2.384 20 5 EEBDMO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C2 ZINC001228661923 1302367993 /nfs/dbraw/zinc/36/79/93/1302367993.db2.gz RAIOVLSOMQFRLO-GDNZZTSVSA-N 1 1 340.401 2.002 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2CC[C@H]([NH+](C)C)CC2)cc1O ZINC001228813873 1302463601 /nfs/dbraw/zinc/46/36/01/1302463601.db2.gz HTMVSAIBIAMZBZ-XYPYZODXSA-N 1 1 338.360 2.339 20 5 EEBDMO O=[N+]([O-])c1cccc(F)c1N1CC[C@H](Oc2[nH+][nH]cc3nncc2-3)C1 ZINC001230900741 1303534632 /nfs/dbraw/zinc/53/46/32/1303534632.db2.gz KSTOCFISEXNMKS-VIFPVBQESA-N 1 1 344.306 2.058 20 5 EEBDMO Cc1cc(NC2(CNC(=O)C[N@H+](C)C(C)C)CCC2)ncc1[N+](=O)[O-] ZINC001111815722 1303933550 /nfs/dbraw/zinc/93/35/50/1303933550.db2.gz UZBOYYQVVQQWLM-UHFFFAOYSA-N 1 1 349.435 2.089 20 5 EEBDMO O=C1CC2(CCCC2)CN1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000782859479 1304136193 /nfs/dbraw/zinc/13/61/93/1304136193.db2.gz CLEHVWMAAUIDEC-UHFFFAOYSA-N 1 1 347.419 2.178 20 5 EEBDMO C[N@H+](CCCNC(=O)COCC1CC1)Cc1csc([N+](=O)[O-])c1 ZINC001234333630 1304878881 /nfs/dbraw/zinc/87/88/81/1304878881.db2.gz OXUCCLRALCDRIX-UHFFFAOYSA-N 1 1 341.433 2.021 20 5 EEBDMO C[N@@H+](CCCNC(=O)COCC1CC1)Cc1csc([N+](=O)[O-])c1 ZINC001234333630 1304878885 /nfs/dbraw/zinc/87/88/85/1304878885.db2.gz OXUCCLRALCDRIX-UHFFFAOYSA-N 1 1 341.433 2.021 20 5 EEBDMO CC(=O)Nc1ccc(C(C)=O)c(O[C@H]2C[NH+]3CCC2CC3)c1[N+](=O)[O-] ZINC001234681276 1305006112 /nfs/dbraw/zinc/00/61/12/1305006112.db2.gz ISTJYYFJJHYXEO-HNNXBMFYSA-N 1 1 347.371 2.229 20 5 EEBDMO CO[C@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000840121479 1315300975 /nfs/dbraw/zinc/30/09/75/1315300975.db2.gz ADNQOQANBZBMKF-DOMZBBRYSA-N 1 1 331.376 2.168 20 5 EEBDMO Cc1nn(C[N@@H+]2CC3(C[C@H]2C)CCOCC3)c2ncc([N+](=O)[O-])cc12 ZINC000842639599 1315741712 /nfs/dbraw/zinc/74/17/12/1315741712.db2.gz REFKEERZETZDGI-GFCCVEGCSA-N 1 1 345.403 2.496 20 5 EEBDMO CCOC(=O)C1=C(O)CC[N@@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254563589 1318122915 /nfs/dbraw/zinc/12/29/15/1318122915.db2.gz ZBNPVIGAPBLGRY-HIFRSBDPSA-N 1 1 348.399 2.370 20 5 EEBDMO CCOC(=O)C1=C(O)CC[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254563589 1318122922 /nfs/dbraw/zinc/12/29/22/1318122922.db2.gz ZBNPVIGAPBLGRY-HIFRSBDPSA-N 1 1 348.399 2.370 20 5 EEBDMO O=C(N1CCCC1)C12CC(C1)C[N@@H+]2[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254596930 1318138461 /nfs/dbraw/zinc/13/84/61/1318138461.db2.gz SMGQJKCFBXMEKJ-KZGIRGLMSA-N 1 1 341.411 2.149 20 5 EEBDMO Cc1ccc(-c2ccc(N3CC[N@H+]4CC[C@@H]4C3)nn2)cc1[N+](=O)[O-] ZINC001158435264 1319238045 /nfs/dbraw/zinc/23/80/45/1319238045.db2.gz XHHDQGHLOOURHO-CQSZACIVSA-N 1 1 325.372 2.255 20 5 EEBDMO O=C(NCCC1=CC[N@@H+](Cc2ccc(F)cc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160098197 1320069735 /nfs/dbraw/zinc/06/97/35/1320069735.db2.gz WSLFNNFGFBZEOM-IAGOWNOFSA-N 1 1 347.390 2.129 20 5 EEBDMO O=C(NCCC1=CC[N@H+](Cc2ccc(F)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160098197 1320069739 /nfs/dbraw/zinc/06/97/39/1320069739.db2.gz WSLFNNFGFBZEOM-IAGOWNOFSA-N 1 1 347.390 2.129 20 5 EEBDMO O=C(NCCC1=CC[N@@H+](Cc2ccc(F)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160098197 1320069743 /nfs/dbraw/zinc/06/97/43/1320069743.db2.gz WSLFNNFGFBZEOM-IAGOWNOFSA-N 1 1 347.390 2.129 20 5 EEBDMO Cc1cc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cs1 ZINC001160106887 1320071489 /nfs/dbraw/zinc/07/14/89/1320071489.db2.gz GJYZSAGUINZLCE-HZPDHXFCSA-N 1 1 349.456 2.360 20 5 EEBDMO Cc1cc(C[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1 ZINC001160106887 1320071495 /nfs/dbraw/zinc/07/14/95/1320071495.db2.gz GJYZSAGUINZLCE-HZPDHXFCSA-N 1 1 349.456 2.360 20 5 EEBDMO Cc1cc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1 ZINC001160106887 1320071500 /nfs/dbraw/zinc/07/15/00/1320071500.db2.gz GJYZSAGUINZLCE-HZPDHXFCSA-N 1 1 349.456 2.360 20 5 EEBDMO C[NH+](C)/C=C/c1cc(NCCO[C@@H]2CCCCO2)ncc1[N+](=O)[O-] ZINC001160923805 1320317853 /nfs/dbraw/zinc/31/78/53/1320317853.db2.gz RETCCUMKDFKCJB-IQIBNGDESA-N 1 1 336.392 2.477 20 5 EEBDMO COc1cnc(N2CCN(c3cccc(C)[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC001163660983 1321184550 /nfs/dbraw/zinc/18/45/50/1321184550.db2.gz XBYXHNPTDVMHGB-UHFFFAOYSA-N 1 1 329.360 2.028 20 5 EEBDMO Cc1ncc([N+](=O)[O-])c(N2CC3(C2)C[NH+](Cc2ccccc2)C3)n1 ZINC001165122568 1321458716 /nfs/dbraw/zinc/45/87/16/1321458716.db2.gz DFKLOZSCZAZVMC-UHFFFAOYSA-N 1 1 325.372 2.015 20 5 EEBDMO COc1ccc([C@H]2CN(C(=O)c3ccccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001262636428 1322336430 /nfs/dbraw/zinc/33/64/30/1322336430.db2.gz RXVWWSMHPVGLSP-MRXNPFEDSA-N 1 1 341.367 2.390 20 5 EEBDMO Cc1ccc(C[N@H+]2CC[C@H](c3cc(=O)[nH]c(=O)[nH]3)C2)cc1[N+](=O)[O-] ZINC001307890827 1331553884 /nfs/dbraw/zinc/55/38/84/1331553884.db2.gz NIYWTOXIMGSSML-LBPRGKRZSA-N 1 1 330.344 2.094 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001319253466 1332671401 /nfs/dbraw/zinc/67/14/01/1332671401.db2.gz IGXDEKQNCVLJTF-BZNIZROVSA-N 1 1 330.388 2.103 20 5 EEBDMO Cc1ccc(NCCNC(=O)Cc2cccc([N+](=O)[O-])c2C)[nH+]c1 ZINC001333874155 1336159177 /nfs/dbraw/zinc/15/91/77/1336159177.db2.gz QTDZMZYBDBBTDY-UHFFFAOYSA-N 1 1 328.372 2.377 20 5 EEBDMO C[N@H+]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC001336763082 1336591299 /nfs/dbraw/zinc/59/12/99/1336591299.db2.gz CEXKVGVIFDAKJK-AWEZNQCLSA-N 1 1 332.404 2.383 20 5 EEBDMO CN(C)c1cc(F)c(C(=O)NC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC001337479734 1336707269 /nfs/dbraw/zinc/70/72/69/1336707269.db2.gz JXYURVJIRZIUIQ-LLVKDONJSA-N 1 1 338.383 2.014 20 5 EEBDMO COc1ccc(NC(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC001345717866 1337462379 /nfs/dbraw/zinc/46/23/79/1337462379.db2.gz CQGWTOOBNABNQF-KBPBESRZSA-N 1 1 334.376 2.352 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H]2CC[C@@]21CN ZINC001579642873 1344402182 /nfs/dbraw/zinc/40/21/82/1344402182.db2.gz ZWOXYVUKONXYQB-CXAGYDPISA-N 1 1 332.404 2.045 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H]2CC[C@@]21CN ZINC001579642873 1344402186 /nfs/dbraw/zinc/40/21/86/1344402186.db2.gz ZWOXYVUKONXYQB-CXAGYDPISA-N 1 1 332.404 2.045 20 5 EEBDMO CC(C)[N@@H+](C)CCCNc1cc(F)c(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001589679016 1349020924 /nfs/dbraw/zinc/02/09/24/1349020924.db2.gz WNFFKSCSTRVADJ-UHFFFAOYSA-N 1 1 337.359 2.056 20 5 EEBDMO CC(C)[N@H+]1CCC[C@H](CNc2cccc(-c3nn[nH]n3)c2[N+](=O)[O-])C1 ZINC001589714807 1349023511 /nfs/dbraw/zinc/02/35/11/1349023511.db2.gz LRLXHUHGZLCQJJ-GFCCVEGCSA-N 1 1 345.407 2.307 20 5 EEBDMO CC[C@@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(-c2nn[nH]n2)c1 ZINC001590512047 1349362658 /nfs/dbraw/zinc/36/26/58/1349362658.db2.gz BZIRGGSCLSEYAV-CYBMUJFWSA-N 1 1 345.407 2.451 20 5 EEBDMO Cc1cc(N[C@H]2CC[N@H+]3CCCC[C@@H]23)c(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001605722848 1351218325 /nfs/dbraw/zinc/21/83/25/1351218325.db2.gz COVCLEXSBKLKOC-JSGCOSHPSA-N 1 1 343.391 2.122 20 5 EEBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](CO)Cc1ccccc1 ZINC000852288159 1369258332 /nfs/dbraw/zinc/25/83/32/1369258332.db2.gz SFZNHEJBBNOCKP-QZTJIDSGSA-N 1 1 330.384 2.164 20 5 EEBDMO CCCC[N@@H+](C)CCNS(=O)(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC000777995485 1369891077 /nfs/dbraw/zinc/89/10/77/1369891077.db2.gz PNHODXXZJGGGEA-UHFFFAOYSA-N 1 1 347.412 2.053 20 5 EEBDMO C[C@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000888092307 1371273696 /nfs/dbraw/zinc/27/36/96/1371273696.db2.gz UGULNNOYZWEEES-YVEFUNNKSA-N 1 1 332.356 2.172 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CCOCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000839544271 1372909693 /nfs/dbraw/zinc/90/96/93/1372909693.db2.gz QTRGKCGUCCKSKQ-LBPRGKRZSA-N 1 1 337.376 2.043 20 5 EEBDMO CCN(CCNC(=O)Cn1cc[nH+]c1C)c1cc(C)ccc1[N+](=O)[O-] ZINC001100534393 1373069467 /nfs/dbraw/zinc/06/94/67/1373069467.db2.gz DGKIPNHRXNJVKO-UHFFFAOYSA-N 1 1 345.403 2.051 20 5 EEBDMO O=[N+]([O-])c1ccc2nc(N3CC4(C3)CC[N@@H+](CC3CC3)C4)cnc2c1 ZINC001164768973 721282647 /nfs/dbraw/zinc/28/26/47/721282647.db2.gz MDWGDDOXUNGTBB-UHFFFAOYSA-N 1 1 339.399 2.460 20 5 EEBDMO CCN(CCNc1nc(C)ccc1[N+](=O)[O-])C(=O)C[N@@H+](C)C1CCC1 ZINC001106979853 782761626 /nfs/dbraw/zinc/76/16/26/782761626.db2.gz YJQMQRMKGLZPBR-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO C[C@@H]1CC[N@@H+](CCNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000893603208 774534911 /nfs/dbraw/zinc/53/49/11/774534911.db2.gz VHFJNTIMLAPKOZ-LLVKDONJSA-N 1 1 340.811 2.389 20 5 EEBDMO CN(C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CCC[N@@H+](C)C1 ZINC000893603200 774535297 /nfs/dbraw/zinc/53/52/97/774535297.db2.gz UVFCJNLFSTUNQM-ZDUSSCGKSA-N 1 1 340.811 2.484 20 5 EEBDMO Cn1cc([C@@H]2C[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC2(C)C)cn1 ZINC000846933180 790736749 /nfs/dbraw/zinc/73/67/49/790736749.db2.gz WDCUIAAAMYHGCW-IRXDYDNUSA-N 1 1 344.415 2.487 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NC/C=C\CNc1nc(C)ccc1[N+](=O)[O-] ZINC001107391655 787105716 /nfs/dbraw/zinc/10/57/16/787105716.db2.gz LACZFUYRCHCKCB-FPLPWBNLSA-N 1 1 349.435 2.113 20 5 EEBDMO C[N@@H+]1CCc2c(N[C@@H]3NC(=O)c4ccccc43)ccc([N+](=O)[O-])c2C1 ZINC001171129005 789154179 /nfs/dbraw/zinc/15/41/79/789154179.db2.gz HZZISWKMQWYNEK-QGZVFWFLSA-N 1 1 338.367 2.437 20 5 EEBDMO C[N@H+]1CCc2c(N[C@@H]3NC(=O)c4ccccc43)ccc([N+](=O)[O-])c2C1 ZINC001171129005 789154185 /nfs/dbraw/zinc/15/41/85/789154185.db2.gz HZZISWKMQWYNEK-QGZVFWFLSA-N 1 1 338.367 2.437 20 5 EEBDMO Cc1[nH+]ccn1CCCC(=O)NCCNc1ccc(C)cc1[N+](=O)[O-] ZINC001093729396 795635786 /nfs/dbraw/zinc/63/57/86/795635786.db2.gz QPBQKGIZGCGANI-UHFFFAOYSA-N 1 1 345.403 2.417 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@@H](F)[C@H](O)C2)c1F ZINC001173178905 797278081 /nfs/dbraw/zinc/27/80/81/797278081.db2.gz BZYCOCWSMMZEHI-UFGOTCBOSA-N 1 1 330.331 2.078 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H](F)[C@H](O)C2)c1F ZINC001173178905 797278084 /nfs/dbraw/zinc/27/80/84/797278084.db2.gz BZYCOCWSMMZEHI-UFGOTCBOSA-N 1 1 330.331 2.078 20 5 EEBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2CN(CC3CC3)C(=O)[C@H]2C1 ZINC001173228898 797311194 /nfs/dbraw/zinc/31/11/94/797311194.db2.gz ZYJNSCRXYCTLTF-OWQGQXMQSA-N 1 1 343.427 2.326 20 5 EEBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](NC(=O)N(C)C)C1 ZINC001173237170 797322572 /nfs/dbraw/zinc/32/25/72/797322572.db2.gz IQFLXRHDJSEHGD-UKRRQHHQSA-N 1 1 334.420 2.261 20 5 EEBDMO COc1ccc(CC[N@@H+](C[C@H](C)O)[C@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001169007232 803568474 /nfs/dbraw/zinc/56/84/74/803568474.db2.gz LZKKPCHJQYVHPJ-UAGQMJEPSA-N 1 1 336.432 2.366 20 5 EEBDMO C[C@H]1CN(C(=O)OC(C)(C)C)CC[N@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169011541 803571086 /nfs/dbraw/zinc/57/10/86/803571086.db2.gz KTZWKGBDSJLFPI-MELADBBJSA-N 1 1 327.425 2.373 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)C1 ZINC001169034917 803579092 /nfs/dbraw/zinc/57/90/92/803579092.db2.gz IPGCPYHSHPFUOL-AKHDSKFASA-N 1 1 329.444 2.496 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)C1 ZINC001169034917 803579094 /nfs/dbraw/zinc/57/90/94/803579094.db2.gz IPGCPYHSHPFUOL-AKHDSKFASA-N 1 1 329.444 2.496 20 5 EEBDMO C[N@H+](C1CCOCC1)C1CCN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169034906 803579474 /nfs/dbraw/zinc/57/94/74/803579474.db2.gz IMJYDRFKINIQLE-RHSMWYFYSA-N 1 1 325.453 2.007 20 5 EEBDMO C[N@@H+](C1CCOCC1)C1CCN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169034906 803579479 /nfs/dbraw/zinc/57/94/79/803579479.db2.gz IMJYDRFKINIQLE-RHSMWYFYSA-N 1 1 325.453 2.007 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)C1 ZINC001169034919 803579488 /nfs/dbraw/zinc/57/94/88/803579488.db2.gz IPGCPYHSHPFUOL-XWSJACJDSA-N 1 1 329.444 2.496 20 5 EEBDMO CC(C)(C)OC(=O)N1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169018027 803586609 /nfs/dbraw/zinc/58/66/09/803586609.db2.gz BIOFWDBLZKTWDB-UONOGXRCSA-N 1 1 327.425 2.375 20 5 EEBDMO Cc1noc([C@@H]2CC[C@@H]3[C@@H](CC[N@H+]3[C@H]3CC[C@@H](C[N+](=O)[O-])C3)O2)n1 ZINC001169020106 803587551 /nfs/dbraw/zinc/58/75/51/803587551.db2.gz IGMXJVXTQYWZJV-KHMAMNHCSA-N 1 1 336.392 2.118 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)N(C)CCCNc1cc(C)ccc1[N+](=O)[O-] ZINC001109455512 805493941 /nfs/dbraw/zinc/49/39/41/805493941.db2.gz AXWQAAWEIJZCHC-UHFFFAOYSA-N 1 1 345.403 2.369 20 5 EEBDMO C[C@@H]1CC[N@@H+](CCNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000791130891 809066611 /nfs/dbraw/zinc/06/66/11/809066611.db2.gz DNRFWOZCMOFTOE-SNVBAGLBSA-N 1 1 343.786 2.388 20 5 EEBDMO COC(=O)[C@H]1C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CC12CC2 ZINC001170356147 809903537 /nfs/dbraw/zinc/90/35/37/809903537.db2.gz YNWQHGHFWZQBIC-SWLSCSKDSA-N 1 1 348.399 2.419 20 5 EEBDMO C[C@H](OC(=O)C(C)(C)[NH+]1CCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000805611568 811393429 /nfs/dbraw/zinc/39/34/29/811393429.db2.gz XRIXOODHORDUAW-LBPRGKRZSA-N 1 1 349.387 2.339 20 5 EEBDMO CC[C@]1(CO)CCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000189672688 529431260 /nfs/dbraw/zinc/43/12/60/529431260.db2.gz IUSFPKDQBICPKA-OAHLLOKOSA-N 1 1 341.795 2.424 20 5 EEBDMO CN(CC[N@@H+](C)C1CC1)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000186785474 529903313 /nfs/dbraw/zinc/90/33/13/529903313.db2.gz AIYNNVKMGQOIQB-UHFFFAOYSA-N 1 1 331.376 2.171 20 5 EEBDMO CCC[N@@H+](CC)C[C@H](C)NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000352574483 283186798 /nfs/dbraw/zinc/18/67/98/283186798.db2.gz HRDBWNNBBUCYKN-ZDUSSCGKSA-N 1 1 343.449 2.135 20 5 EEBDMO O=[N+]([O-])c1cnc(NCc2cccc(C[NH+]3CCOCC3)c2)s1 ZINC000190318158 238384916 /nfs/dbraw/zinc/38/49/16/238384916.db2.gz AKFDMOMIYSKLFB-UHFFFAOYSA-N 1 1 334.401 2.496 20 5 EEBDMO Cc1c(CC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000133206157 223396543 /nfs/dbraw/zinc/39/65/43/223396543.db2.gz JVNMPINAGLKOCI-NVXWUHKLSA-N 1 1 331.416 2.388 20 5 EEBDMO CO[C@@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C[C@H]1C ZINC000451561587 243159738 /nfs/dbraw/zinc/15/97/38/243159738.db2.gz IUSODQVMMMENEN-IUODEOHRSA-N 1 1 349.387 2.250 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2C[C@H](O)CC[C@H]2C1 ZINC000451691729 243208017 /nfs/dbraw/zinc/20/80/17/243208017.db2.gz CNYGTMLZGPNUEP-VWPFQQQWSA-N 1 1 347.415 2.405 20 5 EEBDMO O=C(CC[N@H+]1CC[C@@H]2C[C@H](O)CC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000451700631 243215129 /nfs/dbraw/zinc/21/51/29/243215129.db2.gz YBOCSNKENDVOPX-RBSFLKMASA-N 1 1 347.415 2.406 20 5 EEBDMO Cc1ccc([C@H](C)NC(=O)N2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000247087397 243370246 /nfs/dbraw/zinc/37/02/46/243370246.db2.gz PPAVKGSIQKPIIM-ZFWWWQNUSA-N 1 1 332.404 2.454 20 5 EEBDMO CN(C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000491687198 246111758 /nfs/dbraw/zinc/11/17/58/246111758.db2.gz UWLIZJBCNIPFHJ-FTWHOSCRSA-N 1 1 333.363 2.442 20 5 EEBDMO C[C@H](c1cc(F)ccc1F)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266410008 248286289 /nfs/dbraw/zinc/28/62/89/248286289.db2.gz GISPNORVRPBBIZ-MFKMUULPSA-N 1 1 340.330 2.123 20 5 EEBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CNCCCO1 ZINC000415033263 285161512 /nfs/dbraw/zinc/16/15/12/285161512.db2.gz GUWOALXRIWKCMH-USXIJHARSA-N 1 1 333.432 2.274 20 5 EEBDMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000270484129 256140313 /nfs/dbraw/zinc/14/03/13/256140313.db2.gz IUASDGRARHRSCE-NVXWUHKLSA-N 1 1 346.431 2.406 20 5 EEBDMO CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H]1CCC[N@@H+](C)C1 ZINC000118841881 221195330 /nfs/dbraw/zinc/19/53/30/221195330.db2.gz YDCODGWJSLUUGB-ZDUSSCGKSA-N 1 1 345.403 2.418 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000270524873 256144551 /nfs/dbraw/zinc/14/45/51/256144551.db2.gz NJPIZXMBKQFJSK-MRXNPFEDSA-N 1 1 332.404 2.017 20 5 EEBDMO C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cnn(C)c1 ZINC000273269972 256282592 /nfs/dbraw/zinc/28/25/92/256282592.db2.gz GCRSRXIJNIWGFQ-SECBINFHSA-N 1 1 337.767 2.271 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H](CO)c2c(F)cccc2F)c1 ZINC000273127467 256267800 /nfs/dbraw/zinc/26/78/00/256267800.db2.gz QRXSIVHJPGDKAW-GJZGRUSLSA-N 1 1 338.310 2.230 20 5 EEBDMO CC(C)OCCOC[C@H](O)C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000274265312 256368938 /nfs/dbraw/zinc/36/89/38/256368938.db2.gz YIYFMBCPMTYPIS-WMLDXEAASA-N 1 1 340.420 2.390 20 5 EEBDMO CCO[C@H]1C[C@H](O)C12CC[NH+](Cc1ccc([N+](=O)[O-])c(F)c1)CC2 ZINC000276330268 256422857 /nfs/dbraw/zinc/42/28/57/256422857.db2.gz QXXCUCDQRIQTGU-HOTGVXAUSA-N 1 1 338.379 2.486 20 5 EEBDMO Cc1nccn1CCC[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000130350356 292372047 /nfs/dbraw/zinc/37/20/47/292372047.db2.gz FHZQHLOFLGCEHO-UHFFFAOYSA-N 1 1 345.403 2.369 20 5 EEBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H](CN2CCOCC2)C1 ZINC000069805408 159031197 /nfs/dbraw/zinc/03/11/97/159031197.db2.gz CJZJNHHLIDVPNY-INIZCTEOSA-N 1 1 349.431 2.018 20 5 EEBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000246587878 160285876 /nfs/dbraw/zinc/28/58/76/160285876.db2.gz WOROAJSMFKRHCM-KBRIMQKVSA-N 1 1 330.388 2.030 20 5 EEBDMO C[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1cccc(N2CCCC2=O)c1 ZINC000341803137 161014849 /nfs/dbraw/zinc/01/48/49/161014849.db2.gz BZNFEEZMBBHHSD-GFCCVEGCSA-N 1 1 343.387 2.306 20 5 EEBDMO C[C@@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CCC[N@H+]1C ZINC000343572180 161147683 /nfs/dbraw/zinc/14/76/83/161147683.db2.gz VGJGCFHFWXWKRO-RISCZKNCSA-N 1 1 328.372 2.356 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(C(=O)CCOc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000345975067 161346684 /nfs/dbraw/zinc/34/66/84/161346684.db2.gz XTKOQMGHZBFTDE-KBPBESRZSA-N 1 1 335.404 2.305 20 5 EEBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000352635525 162221434 /nfs/dbraw/zinc/22/14/34/162221434.db2.gz CPUIZONKFLKITK-VHSXEESVSA-N 1 1 343.330 2.361 20 5 EEBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000352635525 162221435 /nfs/dbraw/zinc/22/14/35/162221435.db2.gz CPUIZONKFLKITK-VHSXEESVSA-N 1 1 343.330 2.361 20 5 EEBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000352638739 162223085 /nfs/dbraw/zinc/22/30/85/162223085.db2.gz VCSSUSRYXMIHDL-VHSXEESVSA-N 1 1 343.330 2.361 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000352638739 162223087 /nfs/dbraw/zinc/22/30/87/162223087.db2.gz VCSSUSRYXMIHDL-VHSXEESVSA-N 1 1 343.330 2.361 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000355377547 163168597 /nfs/dbraw/zinc/16/85/97/163168597.db2.gz CLMHTXHRHNAJEY-MRXNPFEDSA-N 1 1 343.383 2.203 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)nc1 ZINC000355712574 163278600 /nfs/dbraw/zinc/27/86/00/163278600.db2.gz CBUQXLKSVCJDQC-KRWDZBQOSA-N 1 1 328.372 2.039 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2cnn(CC[N@@H+]3C[C@H]4CC[C@@H](C3)O4)c2)c1 ZINC000359750041 164165285 /nfs/dbraw/zinc/16/52/85/164165285.db2.gz XLXIYADTYWPBKR-CALCHBBNSA-N 1 1 328.372 2.322 20 5 EEBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCOC3(CCOCC3)CC2)cc1 ZINC000364246701 165068553 /nfs/dbraw/zinc/06/85/53/165068553.db2.gz YWHFGVVWUKSKKI-UHFFFAOYSA-N 1 1 336.388 2.245 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000369068968 166183383 /nfs/dbraw/zinc/18/33/83/166183383.db2.gz YFMKNWHEKOPTRU-LBPRGKRZSA-N 1 1 333.388 2.350 20 5 EEBDMO CCOc1ccc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000374871958 167057140 /nfs/dbraw/zinc/05/71/40/167057140.db2.gz CSBPIKMMBQEDHD-DOMZBBRYSA-N 1 1 333.388 2.160 20 5 EEBDMO O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCc1c[nH+]c2n1CCCC2 ZINC000376716771 167380256 /nfs/dbraw/zinc/38/02/56/167380256.db2.gz OJHBMHOBNJMHOZ-RMKNXTFCSA-N 1 1 326.356 2.457 20 5 EEBDMO CCOC(=O)[C@H](C)[C@H](C)[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000274114256 269024432 /nfs/dbraw/zinc/02/44/32/269024432.db2.gz WDLORGODKDNYGV-MNOVXSKESA-N 1 1 348.359 2.322 20 5 EEBDMO C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCn1ccc([N+](=O)[O-])n1 ZINC000274871034 269067271 /nfs/dbraw/zinc/06/72/71/269067271.db2.gz XBAJPDIVSSPIGD-DOTOQJQBSA-N 1 1 343.431 2.292 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](O)C(C)(C)C1 ZINC000275438757 269115917 /nfs/dbraw/zinc/11/59/17/269115917.db2.gz KAKGEKFMNQEVAZ-HNNXBMFYSA-N 1 1 335.404 2.325 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000277747767 269178152 /nfs/dbraw/zinc/17/81/52/269178152.db2.gz BURCILHIRBPQJC-AWEZNQCLSA-N 1 1 333.388 2.350 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)cc1Cl ZINC000278297764 269221889 /nfs/dbraw/zinc/22/18/89/269221889.db2.gz DFVJDHWEMZKDEK-AOOOYVTPSA-N 1 1 339.779 2.033 20 5 EEBDMO C[C@@H]1CCSCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000279361296 269274214 /nfs/dbraw/zinc/27/42/14/269274214.db2.gz WIQBEDBLVSBFCW-TZMCWYRMSA-N 1 1 326.418 2.162 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](O)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000275429819 274247950 /nfs/dbraw/zinc/24/79/50/274247950.db2.gz IXIRRXITFGPGMR-IUODEOHRSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](O)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000275429819 274247951 /nfs/dbraw/zinc/24/79/51/274247951.db2.gz IXIRRXITFGPGMR-IUODEOHRSA-N 1 1 335.404 2.323 20 5 EEBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(NCC23CCC[NH+]2CCC3)s1 ZINC000286143593 274841364 /nfs/dbraw/zinc/84/13/64/274841364.db2.gz ADIOPTXOSIARRF-UHFFFAOYSA-N 1 1 345.446 2.100 20 5 EEBDMO CN(C)C(=O)[C@@H]1CCC[N@H+]1CCCNc1c(F)cccc1[N+](=O)[O-] ZINC000287988091 275012588 /nfs/dbraw/zinc/01/25/88/275012588.db2.gz RPMAAXNHVKCDRP-AWEZNQCLSA-N 1 1 338.383 2.089 20 5 EEBDMO O=C(NCC[NH+]1CCSCC1)Nc1cccc([N+](=O)[O-])c1Cl ZINC000289542831 275125956 /nfs/dbraw/zinc/12/59/56/275125956.db2.gz DUWJISBDKDZLBP-UHFFFAOYSA-N 1 1 344.824 2.419 20 5 EEBDMO Cc1cnn([C@@H]2CC[N@@H+]([C@@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])C2)c1 ZINC000289756392 275145826 /nfs/dbraw/zinc/14/58/26/275145826.db2.gz FRHFTERESUPDJP-UONOGXRCSA-N 1 1 343.387 2.374 20 5 EEBDMO Cc1cnn([C@@H]2CC[N@H+]([C@@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])C2)c1 ZINC000289756392 275145827 /nfs/dbraw/zinc/14/58/27/275145827.db2.gz FRHFTERESUPDJP-UONOGXRCSA-N 1 1 343.387 2.374 20 5 EEBDMO CSC1(C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000289998014 275169035 /nfs/dbraw/zinc/16/90/35/275169035.db2.gz KWXOUUMMFNJLDU-UHFFFAOYSA-N 1 1 335.429 2.248 20 5 EEBDMO CS(=O)(=O)C[C@@H]1CCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000451663690 278106863 /nfs/dbraw/zinc/10/68/63/278106863.db2.gz XHYXMEUYWCIIPB-HNNXBMFYSA-N 1 1 326.418 2.036 20 5 EEBDMO CS(=O)(=O)C[C@@H]1CCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000451663690 278106865 /nfs/dbraw/zinc/10/68/65/278106865.db2.gz XHYXMEUYWCIIPB-HNNXBMFYSA-N 1 1 326.418 2.036 20 5 EEBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)[C@H](C)C[S@@](C)=O ZINC000362073488 279247071 /nfs/dbraw/zinc/24/70/71/279247071.db2.gz XBGFILVXYLJPNG-VXEWELBQSA-N 1 1 341.433 2.011 20 5 EEBDMO C[C@H]1CN(C(=O)Nc2ccncc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000297892146 294367519 /nfs/dbraw/zinc/36/75/19/294367519.db2.gz WVHSQHSVNAMJNO-GFCCVEGCSA-N 1 1 333.392 2.328 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)NCCc3ccccc3[N+](=O)[O-])C2)C1 ZINC000298026250 294399920 /nfs/dbraw/zinc/39/99/20/294399920.db2.gz RXIWOWMASTYSMU-SFHVURJKSA-N 1 1 346.431 2.265 20 5 EEBDMO COc1cc(C(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000160230801 311351249 /nfs/dbraw/zinc/35/12/49/311351249.db2.gz MIIJNYIGUNIGSP-OLZOCXBDSA-N 1 1 335.404 2.454 20 5 EEBDMO COc1cc(Cc2noc([C@@H]3CC[N@@H+](C)C3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000350314545 312320990 /nfs/dbraw/zinc/32/09/90/312320990.db2.gz CIEAPVQFIQWVQI-SNVBAGLBSA-N 1 1 348.359 2.005 20 5 EEBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H](O)[C@H](CO)C2)s1 ZINC000414552298 313040485 /nfs/dbraw/zinc/04/04/85/313040485.db2.gz DEGKWRRNWQSBAC-BLLLJJGKSA-N 1 1 348.424 2.498 20 5 EEBDMO Cc1sc(S(=O)(=O)NCCCC[N@H+](C)C2CC2)cc1[N+](=O)[O-] ZINC000416506352 313241651 /nfs/dbraw/zinc/24/16/51/313241651.db2.gz ICPCYSWFEPNATR-UHFFFAOYSA-N 1 1 347.462 2.117 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)C[C@@H]1CCC[N@H+]1C ZINC000421013042 314024605 /nfs/dbraw/zinc/02/46/05/314024605.db2.gz UPAPDELBJTXOHW-HNNXBMFYSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)C[C@@H]1CCCN1C ZINC000421013042 314024610 /nfs/dbraw/zinc/02/46/10/314024610.db2.gz UPAPDELBJTXOHW-HNNXBMFYSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C[C@@H]1CCCN1C ZINC000421013042 314024614 /nfs/dbraw/zinc/02/46/14/314024614.db2.gz UPAPDELBJTXOHW-HNNXBMFYSA-N 1 1 334.420 2.258 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000527044943 317145413 /nfs/dbraw/zinc/14/54/13/317145413.db2.gz TXWSMXYMIJUWLZ-LBPRGKRZSA-N 1 1 341.433 2.141 20 5 EEBDMO COc1ccsc1C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000535785731 317982451 /nfs/dbraw/zinc/98/24/51/317982451.db2.gz ORORCTVRFFQYIL-UHFFFAOYSA-N 1 1 334.401 2.382 20 5 EEBDMO C[C@@H](C(=O)N(C)C(C)(C)C[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000575151016 320091573 /nfs/dbraw/zinc/09/15/73/320091573.db2.gz BCSONGYYBKPZIX-CQSZACIVSA-N 1 1 349.431 2.268 20 5 EEBDMO CCCC[N@@H+](C)CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000134421476 463037173 /nfs/dbraw/zinc/03/71/73/463037173.db2.gz RQYHOQJWZLLGBP-UHFFFAOYSA-N 1 1 332.404 2.467 20 5 EEBDMO CCN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000354793582 465158008 /nfs/dbraw/zinc/15/80/08/465158008.db2.gz QZXXKKAQFFUSRG-AWEZNQCLSA-N 1 1 343.387 2.055 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CCO[C@H](C)[C@H]2C)c([N+](=O)[O-])c1 ZINC000298363021 465374817 /nfs/dbraw/zinc/37/48/17/465374817.db2.gz GBNMOHOHJTVAGL-VXGBXAGGSA-N 1 1 337.376 2.041 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H]([C@@H](C)O)C2)cccc1[N+](=O)[O-] ZINC000089929413 462744785 /nfs/dbraw/zinc/74/47/85/462744785.db2.gz FTGCUDHCNHKNFN-KGLIPLIRSA-N 1 1 335.404 2.325 20 5 EEBDMO CCOc1ccc(NC(=O)C[N@H+](C)[C@@H]2CCSC2)c([N+](=O)[O-])c1 ZINC000089935437 462746342 /nfs/dbraw/zinc/74/63/42/462746342.db2.gz FBEVCYBTDFHIIC-LLVKDONJSA-N 1 1 339.417 2.369 20 5 EEBDMO CCOc1ccc(NC(=O)C[N@@H+](C)[C@@H]2CCSC2)c([N+](=O)[O-])c1 ZINC000089935437 462746348 /nfs/dbraw/zinc/74/63/48/462746348.db2.gz FBEVCYBTDFHIIC-LLVKDONJSA-N 1 1 339.417 2.369 20 5 EEBDMO CCC(CC)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])o1)[NH+]1CCOCC1 ZINC000047459626 462786701 /nfs/dbraw/zinc/78/67/01/462786701.db2.gz NRVGOFYVMYFAJW-CYBMUJFWSA-N 1 1 339.392 2.055 20 5 EEBDMO C[C@@H](Nc1ccc(Br)cc1[N+](=O)[O-])[C@@H]1C[N@H+](C)CCO1 ZINC000154770157 462807110 /nfs/dbraw/zinc/80/71/10/462807110.db2.gz LVBYJWOFGXIYHC-RNCFNFMXSA-N 1 1 344.209 2.488 20 5 EEBDMO C[C@@H](Nc1ccc(Br)cc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCO1 ZINC000154770157 462807114 /nfs/dbraw/zinc/80/71/14/462807114.db2.gz LVBYJWOFGXIYHC-RNCFNFMXSA-N 1 1 344.209 2.488 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000065674896 462818433 /nfs/dbraw/zinc/81/84/33/462818433.db2.gz VWHMCGQEHKWCBA-KGLIPLIRSA-N 1 1 335.404 2.210 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](OC)C1 ZINC000076348147 462846803 /nfs/dbraw/zinc/84/68/03/462846803.db2.gz HFHMKDPGRQJIJY-CYBMUJFWSA-N 1 1 337.376 2.043 20 5 EEBDMO CCC[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000091857950 462911164 /nfs/dbraw/zinc/91/11/64/462911164.db2.gz WRYKNAJHLMVVQF-OAHLLOKOSA-N 1 1 337.420 2.233 20 5 EEBDMO CCC[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000091857950 462911170 /nfs/dbraw/zinc/91/11/70/462911170.db2.gz WRYKNAJHLMVVQF-OAHLLOKOSA-N 1 1 337.420 2.233 20 5 EEBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000119694621 462924261 /nfs/dbraw/zinc/92/42/61/462924261.db2.gz FQFFWBVYZDAJLF-OAHLLOKOSA-N 1 1 348.447 2.491 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CC[C@H](c3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000579226569 468328001 /nfs/dbraw/zinc/32/80/01/468328001.db2.gz SQJQXTTWPCCWHJ-AWEZNQCLSA-N 1 1 326.356 2.078 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000049992636 462983033 /nfs/dbraw/zinc/98/30/33/462983033.db2.gz DSOKRZKIQAOMGO-CYBMUJFWSA-N 1 1 348.359 2.122 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000067703574 463039870 /nfs/dbraw/zinc/03/98/70/463039870.db2.gz GFVGUSKSYCGWHA-CQSZACIVSA-N 1 1 344.415 2.162 20 5 EEBDMO Cc1nn(C)c(NC[C@H](C)[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000051854016 463050619 /nfs/dbraw/zinc/05/06/19/463050619.db2.gz SZNHYENZABZOOS-LBPRGKRZSA-N 1 1 329.404 2.495 20 5 EEBDMO Cc1ccc([C@H](C)[NH2+]C[C@H](C)CN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000120897824 463052396 /nfs/dbraw/zinc/05/23/96/463052396.db2.gz NZQNIVADCCNIHS-HOCLYGCPSA-N 1 1 334.464 2.437 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000135445516 463157447 /nfs/dbraw/zinc/15/74/47/463157447.db2.gz DNQCMVNFHYUHQK-KRWDZBQOSA-N 1 1 344.415 2.417 20 5 EEBDMO CCC[N@H+]1CC[C@@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000053583373 463176964 /nfs/dbraw/zinc/17/69/64/463176964.db2.gz NEOKWSZDORUFHY-LBPRGKRZSA-N 1 1 341.433 2.142 20 5 EEBDMO COc1ccc(C(=O)NCC[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000054281575 463223615 /nfs/dbraw/zinc/22/36/15/463223615.db2.gz AJKBLMFESMILNX-UHFFFAOYSA-N 1 1 343.383 2.465 20 5 EEBDMO C[N@H+]1CC[C@@H](CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000079682377 463239865 /nfs/dbraw/zinc/23/98/65/463239865.db2.gz VLEGRQVQUQPUHP-VIFPVBQESA-N 1 1 331.294 2.295 20 5 EEBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)[C@H]1CCC[N@@H+](C)C1 ZINC000151143972 463483276 /nfs/dbraw/zinc/48/32/76/463483276.db2.gz CRVFKHQZAXOAAU-HNNXBMFYSA-N 1 1 346.431 2.361 20 5 EEBDMO NC(=O)c1ccc(N2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000082116886 463516274 /nfs/dbraw/zinc/51/62/74/463516274.db2.gz FRJPCODIZFFDIH-UHFFFAOYSA-N 1 1 340.383 2.016 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000058300177 463574288 /nfs/dbraw/zinc/57/42/88/463574288.db2.gz YVOQNENHXLNBCJ-TZMCWYRMSA-N 1 1 328.372 2.433 20 5 EEBDMO C[C@H](NC(=O)N[C@H]1CC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000108559068 463615563 /nfs/dbraw/zinc/61/55/63/463615563.db2.gz PXTANXFWUVWGNM-WFASDCNBSA-N 1 1 332.404 2.439 20 5 EEBDMO COc1ccc(C[N@@H+]2CCC[C@@H](N3CCCC3=O)C2)cc1[N+](=O)[O-] ZINC000111294151 463674941 /nfs/dbraw/zinc/67/49/41/463674941.db2.gz OJAWHXPZFOKEGM-CQSZACIVSA-N 1 1 333.388 2.190 20 5 EEBDMO COc1ccc(C[N@H+]2CCC[C@@H](N3CCCC3=O)C2)cc1[N+](=O)[O-] ZINC000111294151 463674946 /nfs/dbraw/zinc/67/49/46/463674946.db2.gz OJAWHXPZFOKEGM-CQSZACIVSA-N 1 1 333.388 2.190 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000269397966 463976489 /nfs/dbraw/zinc/97/64/89/463976489.db2.gz NEQLFIAEOOJNBG-VXGBXAGGSA-N 1 1 337.424 2.292 20 5 EEBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)C[C@H]1CCCO1 ZINC000172172266 464007687 /nfs/dbraw/zinc/00/76/87/464007687.db2.gz PQKMQKFIKIBXGS-CYBMUJFWSA-N 1 1 337.376 2.043 20 5 EEBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)C[C@H]1CCCO1 ZINC000172172266 464007693 /nfs/dbraw/zinc/00/76/93/464007693.db2.gz PQKMQKFIKIBXGS-CYBMUJFWSA-N 1 1 337.376 2.043 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]2COC[C@@H]21 ZINC000590972432 468387531 /nfs/dbraw/zinc/38/75/31/468387531.db2.gz TUCFWWMVVCOSTA-CJNGLKHVSA-N 1 1 333.388 2.343 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCCN(CC(F)(F)F)CC2)c1 ZINC000269643089 464044869 /nfs/dbraw/zinc/04/48/69/464044869.db2.gz JUSMOIYFYPPUGB-AWEZNQCLSA-N 1 1 347.337 2.198 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCN(CC(F)(F)F)CC2)c1 ZINC000269643089 464044870 /nfs/dbraw/zinc/04/48/70/464044870.db2.gz JUSMOIYFYPPUGB-AWEZNQCLSA-N 1 1 347.337 2.198 20 5 EEBDMO COc1cc(C[N@@H+]2CC[C@@](C)(O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180244522 464272232 /nfs/dbraw/zinc/27/22/32/464272232.db2.gz FIDNBOKUUDUTHW-OAHLLOKOSA-N 1 1 346.330 2.204 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@@](C)(O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180244522 464272236 /nfs/dbraw/zinc/27/22/36/464272236.db2.gz 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COc1cc(C[NH2+]C[C@H](C)N(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000272262677 464541783 /nfs/dbraw/zinc/54/17/83/464541783.db2.gz AVMOFLFAKGIYLU-JTQLQIEISA-N 1 1 347.362 2.287 20 5 EEBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@H]1CCN(CC(F)(F)F)C1=O ZINC000285425788 464559664 /nfs/dbraw/zinc/55/96/64/464559664.db2.gz WCBFORLGYBPRRA-ZDUSSCGKSA-N 1 1 345.321 2.232 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+](Cc1ccncc1)C1CC1 ZINC000182269386 464616422 /nfs/dbraw/zinc/61/64/22/464616422.db2.gz VNUYZTFFSYSPHY-INIZCTEOSA-N 1 1 343.383 2.394 20 5 EEBDMO CC(C)c1ccc(C(=O)N2CCO[C@H]3CC[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-] ZINC000285613639 464627879 /nfs/dbraw/zinc/62/78/79/464627879.db2.gz DDJRDNFDZZNUSS-SJORKVTESA-N 1 1 347.415 2.263 20 5 EEBDMO COC(=O)Cc1ccc(N2CC[N@H+](C3CC3)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000295049624 464689431 /nfs/dbraw/zinc/68/94/31/464689431.db2.gz XYBOITNWYZHMGX-CYBMUJFWSA-N 1 1 347.415 2.231 20 5 EEBDMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2ccccn2)c([N+](=O)[O-])c1 ZINC000295205851 464744520 /nfs/dbraw/zinc/74/45/20/464744520.db2.gz TXEUWEKRTLSHET-UHFFFAOYSA-N 1 1 344.371 2.459 20 5 EEBDMO COc1cc(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1F ZINC000295268842 464769116 /nfs/dbraw/zinc/76/91/16/464769116.db2.gz OHTPLIPMGBYVTO-LLVKDONJSA-N 1 1 339.367 2.156 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@H]([C@H](C)O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000183151817 464809913 /nfs/dbraw/zinc/80/99/13/464809913.db2.gz TXSFXQRRNITQFZ-UWVGGRQHSA-N 1 1 346.330 2.408 20 5 EEBDMO C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCS1 ZINC000249086903 464838131 /nfs/dbraw/zinc/83/81/31/464838131.db2.gz SIKYZTXDEYPARA-TZMCWYRMSA-N 1 1 326.418 2.162 20 5 EEBDMO C[N@@H+](CC(=O)[O-])[C@@H]1CCC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000192005803 464846982 /nfs/dbraw/zinc/84/69/82/464846982.db2.gz BTRPCWZNJDWWJM-OAHLLOKOSA-N 1 1 335.404 2.008 20 5 EEBDMO C[NH+](CC(=O)[O-])[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000192005803 464846990 /nfs/dbraw/zinc/84/69/90/464846990.db2.gz BTRPCWZNJDWWJM-OAHLLOKOSA-N 1 1 335.404 2.008 20 5 EEBDMO C[NH+](CC(=O)[O-])[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000192005803 464846998 /nfs/dbraw/zinc/84/69/98/464846998.db2.gz BTRPCWZNJDWWJM-OAHLLOKOSA-N 1 1 335.404 2.008 20 5 EEBDMO Cc1n[nH]c(C(=O)NCC[C@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000266923989 464872445 /nfs/dbraw/zinc/87/24/45/464872445.db2.gz LURMEKUBHCFRLC-LBPRGKRZSA-N 1 1 345.403 2.267 20 5 EEBDMO Cc1ccnc([C@H](C)[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000286332740 464882893 /nfs/dbraw/zinc/88/28/93/464882893.db2.gz YMMCIEGSNPPMOB-ZDUSSCGKSA-N 1 1 349.412 2.423 20 5 EEBDMO CCc1nn(C)c(N(C)CCC[N@@H+](C)Cc2ccco2)c1[N+](=O)[O-] ZINC000286558133 464959942 /nfs/dbraw/zinc/95/99/42/464959942.db2.gz PILLGDVUNYXBNW-UHFFFAOYSA-N 1 1 335.408 2.442 20 5 EEBDMO COCCC[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000358802042 465331352 /nfs/dbraw/zinc/33/13/52/465331352.db2.gz CUTVQABEQJIOLX-UHFFFAOYSA-N 1 1 333.392 2.020 20 5 EEBDMO NC(=O)c1ccc(NCC[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000298279677 465353304 /nfs/dbraw/zinc/35/33/04/465353304.db2.gz QZAFJEDQUWXFEV-UHFFFAOYSA-N 1 1 340.383 2.164 20 5 EEBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000337551013 465428252 /nfs/dbraw/zinc/42/82/52/465428252.db2.gz PNKUTVAYDVCMMN-LSDHHAIUSA-N 1 1 332.404 2.363 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000298770595 465499842 /nfs/dbraw/zinc/49/98/42/465499842.db2.gz OLTXTUZYMYJHDW-YOEHRIQHSA-N 1 1 331.372 2.500 20 5 EEBDMO O=[N+]([O-])c1cccc(CNC[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000344547050 465662109 /nfs/dbraw/zinc/66/21/09/465662109.db2.gz ZOCRUNNHYCSMQB-IBGZPJMESA-N 1 1 341.411 2.321 20 5 EEBDMO O=[N+]([O-])c1cccc(C[NH2+]C[C@@]2(O)CCN(Cc3ccccc3)C2)c1 ZINC000344547050 465662116 /nfs/dbraw/zinc/66/21/16/465662116.db2.gz ZOCRUNNHYCSMQB-IBGZPJMESA-N 1 1 341.411 2.321 20 5 EEBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1OC ZINC000353194529 465707652 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NJTQBVOSMVUXKI-HEHGZKQESA-N 1 1 347.415 2.406 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]C[C@@H]1CC[C@H](O)C1)c1cccc([N+](=O)[O-])c1 ZINC000353681758 466063139 /nfs/dbraw/zinc/06/31/39/466063139.db2.gz BOGJYJGHZLACBK-UHOFOFEASA-N 1 1 330.388 2.168 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]C[C@@H]1CC[C@@H](O)C1)c1cccc([N+](=O)[O-])c1 ZINC000353681757 466063689 /nfs/dbraw/zinc/06/36/89/466063689.db2.gz BOGJYJGHZLACBK-DAXOMENPSA-N 1 1 330.388 2.168 20 5 EEBDMO CCOc1cc(C(=O)NCC[N@@H+](C)C(C)C)c([N+](=O)[O-])cc1OC ZINC000338424254 466114089 /nfs/dbraw/zinc/11/40/89/466114089.db2.gz KJSJZTIPFZGCIU-UHFFFAOYSA-N 1 1 339.392 2.072 20 5 EEBDMO O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000363150823 466249598 /nfs/dbraw/zinc/24/95/98/466249598.db2.gz WQQFQDMRQTYKCG-CYBMUJFWSA-N 1 1 333.388 2.107 20 5 EEBDMO C[C@@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC[C@H]1c1ccccc1 ZINC000304273433 466273601 /nfs/dbraw/zinc/27/36/01/466273601.db2.gz CFOFSMCPBZKOGI-ZTFGCOKTSA-N 1 1 344.415 2.278 20 5 EEBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000353994190 466308068 /nfs/dbraw/zinc/30/80/68/466308068.db2.gz DWTCQYQORRFXLZ-CQSZACIVSA-N 1 1 334.420 2.340 20 5 EEBDMO CCOC[C@@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000357922373 466321454 /nfs/dbraw/zinc/32/14/54/466321454.db2.gz BOWHTZKWXBCFNQ-CYBMUJFWSA-N 1 1 349.387 2.251 20 5 EEBDMO C[C@@H]1C[N@H+]2CCCC[C@H]2CN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000332054209 466365351 /nfs/dbraw/zinc/36/53/51/466365351.db2.gz VDWQUEVSBLSTPE-PBHICJAKSA-N 1 1 346.431 2.482 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N(C)C(C)(C)C[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000416333271 466730044 /nfs/dbraw/zinc/73/00/44/466730044.db2.gz KVJIEHGDXDIFHK-UHFFFAOYSA-N 1 1 337.424 2.388 20 5 EEBDMO C[C@@H]1CC[C@H]([N@@H+](CCO)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000411654484 466867648 /nfs/dbraw/zinc/86/76/48/466867648.db2.gz XVWHFNFJCGFRCH-CJNGLKHVSA-N 1 1 335.404 2.406 20 5 EEBDMO O=C1CCCN1[C@@H]1CCC[N@H+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000412057349 466986371 /nfs/dbraw/zinc/98/63/71/466986371.db2.gz QVVXSPSSQUXMRM-OAHLLOKOSA-N 1 1 347.415 2.451 20 5 EEBDMO C[C@@H](NC(=O)N1CCC[C@H]2C[N@@H+](C)C[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000425656379 467119836 /nfs/dbraw/zinc/11/98/36/467119836.db2.gz SPECXAOPAHVLLA-IVMMDQJWSA-N 1 1 332.404 2.391 20 5 EEBDMO COc1ccc2c(c1)C1(CC1)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C2 ZINC000377731583 467128723 /nfs/dbraw/zinc/12/87/23/467128723.db2.gz GCRXSQPYNUQFLB-UHFFFAOYSA-N 1 1 328.372 2.347 20 5 EEBDMO COc1ccc2c(c1)C1(CC1)C[N@H+](CCn1ccc([N+](=O)[O-])n1)C2 ZINC000377731583 467128725 /nfs/dbraw/zinc/12/87/25/467128725.db2.gz GCRXSQPYNUQFLB-UHFFFAOYSA-N 1 1 328.372 2.347 20 5 EEBDMO COCC[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413129942 467175662 /nfs/dbraw/zinc/17/56/62/467175662.db2.gz GAYRDTZVYYGULY-SECBINFHSA-N 1 1 334.298 2.141 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000413949140 467347734 /nfs/dbraw/zinc/34/77/34/467347734.db2.gz 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EEBDMO C[N@@H+](CCCCNC(=O)NCCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000454607414 467603907 /nfs/dbraw/zinc/60/39/07/467603907.db2.gz YNNVGUYEEXBTRT-UHFFFAOYSA-N 1 1 334.420 2.311 20 5 EEBDMO COC[C@@]1(C(=O)OC)CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000449460818 467649036 /nfs/dbraw/zinc/64/90/36/467649036.db2.gz ZWEKZXMIWDTQKT-XTKXOIQPSA-N 1 1 334.372 2.120 20 5 EEBDMO C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)[N@@H+]1CCO ZINC000449533400 467658492 /nfs/dbraw/zinc/65/84/92/467658492.db2.gz KPOFVTAXFWKXCG-TXEJJXNPSA-N 1 1 327.812 2.135 20 5 EEBDMO CC[N@@H+]1C[C@H](C)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000450315464 467824760 /nfs/dbraw/zinc/82/47/60/467824760.db2.gz DMNYXQDXRCCZDA-KBPBESRZSA-N 1 1 347.415 2.499 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000450315464 467824764 /nfs/dbraw/zinc/82/47/64/467824764.db2.gz DMNYXQDXRCCZDA-KBPBESRZSA-N 1 1 347.415 2.499 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@@H+]2CCCO)cc1OC(F)F 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C[C@@H]([NH2+]CC[N+](=O)[O-])c1ccc(Br)cc1OCCCO ZINC000930531405 1206565194 /nfs/dbraw/zinc/56/51/94/1206565194.db2.gz JVEJWASMZGOYLY-SNVBAGLBSA-N 1 1 347.209 2.138 20 5 EEBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000932901633 1207697360 /nfs/dbraw/zinc/69/73/60/1207697360.db2.gz ATLURFXDOAJNDH-XKQJLSEDSA-N 1 1 331.416 2.499 20 5 EEBDMO CCc1ccccc1C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001017544858 1227507470 /nfs/dbraw/zinc/50/74/70/1227507470.db2.gz BMEIGJCNRRVFPO-XMTFNYHQSA-N 1 1 343.427 2.089 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000119886534 1229623361 /nfs/dbraw/zinc/62/33/61/1229623361.db2.gz VSIWBEBCHDBFQF-NSHDSACASA-N 1 1 347.462 2.009 20 5 EEBDMO O=C(N[C@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000900371464 1234284585 /nfs/dbraw/zinc/28/45/85/1234284585.db2.gz DRBJQLIBPSWXBP-VIFPVBQESA-N 1 1 327.743 2.354 20 5 EEBDMO 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ZINC001233862968 1304619441 /nfs/dbraw/zinc/61/94/41/1304619441.db2.gz DWNRMWWNGMLASU-UHFFFAOYSA-N 1 1 332.360 2.143 20 5 EEBDMO CC[C@H](C)[N@@H+](CCO)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839603624 1315219320 /nfs/dbraw/zinc/21/93/20/1315219320.db2.gz GFKQDTULSYWFPJ-JTQLQIEISA-N 1 1 329.784 2.280 20 5 EEBDMO C[N@H+]1CC[C@H](C(=O)N[C@@H](c2cccc([N+](=O)[O-])c2F)C(F)(F)F)C1 ZINC000839863754 1315256281 /nfs/dbraw/zinc/25/62/81/1315256281.db2.gz KCHHXLLIEOIAGT-UFBFGSQYSA-N 1 1 349.284 2.405 20 5 EEBDMO COC[C@@]1(C)CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000840107542 1315296883 /nfs/dbraw/zinc/29/68/83/1315296883.db2.gz ZKINGJPZFNNYFX-INIZCTEOSA-N 1 1 331.376 2.169 20 5 EEBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CC[C@H](c2cccnc2)C1 ZINC000842626440 1315736933 /nfs/dbraw/zinc/73/69/33/1315736933.db2.gz KZRPBQFEPBPIRO-ZDUSSCGKSA-N 1 1 340.339 2.345 20 5 EEBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000842626440 1315736936 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1 337.464 2.498 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(N2CCC(C[N@H+](CCO)C(C)C)CC2)n1 ZINC001262706387 1322354310 /nfs/dbraw/zinc/35/43/10/1322354310.db2.gz MHJKMSYVDJNVJS-UHFFFAOYSA-N 1 1 336.436 2.217 20 5 EEBDMO CC[N@@H+](C)[C@H]1CCN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001308175682 1331569338 /nfs/dbraw/zinc/56/93/38/1331569338.db2.gz FJGXHTCGBUBQON-LBPRGKRZSA-N 1 1 340.811 2.213 20 5 EEBDMO COC(=O)[C@H]1CCC[C@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC001320947439 1332984691 /nfs/dbraw/zinc/98/46/91/1332984691.db2.gz YHDFKUVNTOLUQM-QWHCGFSZSA-N 1 1 346.343 2.076 20 5 EEBDMO Cc1nc(N2CC[C@H]([N@@H+](C)CCc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC001330692390 1334887819 /nfs/dbraw/zinc/88/78/19/1334887819.db2.gz MENMDWXIEIONMF-INIZCTEOSA-N 1 1 341.415 2.446 20 5 EEBDMO O=[N+]([O-])c1c(N2CC[N@@H+]3CCOC[C@@H]3C2)cccc1C(F)(F)F ZINC001331589729 1335041453 /nfs/dbraw/zinc/04/14/53/1335041453.db2.gz JVTLLRWANDMJRV-JTQLQIEISA-N 1 1 331.294 2.134 20 5 EEBDMO O=[N+]([O-])c1c(N2CC[N@H+]3CCOC[C@@H]3C2)cccc1C(F)(F)F ZINC001331589729 1335041455 /nfs/dbraw/zinc/04/14/55/1335041455.db2.gz JVTLLRWANDMJRV-JTQLQIEISA-N 1 1 331.294 2.134 20 5 EEBDMO O=[N+]([O-])c1c(N2CC[N@@H+]3CCOC[C@H]3C2)cccc1C(F)(F)F ZINC001331589731 1335041653 /nfs/dbraw/zinc/04/16/53/1335041653.db2.gz JVTLLRWANDMJRV-SNVBAGLBSA-N 1 1 331.294 2.134 20 5 EEBDMO O=[N+]([O-])c1c(N2CC[N@H+]3CCOC[C@H]3C2)cccc1C(F)(F)F ZINC001331589731 1335041657 /nfs/dbraw/zinc/04/16/57/1335041657.db2.gz JVTLLRWANDMJRV-SNVBAGLBSA-N 1 1 331.294 2.134 20 5 EEBDMO [NH3+]Cc1nc(C(=O)N2CCCCc3ccc([N+](=O)[O-])cc32)cs1 ZINC001580352352 1344512319 /nfs/dbraw/zinc/51/23/19/1344512319.db2.gz XSWFRHJOWKTKJG-UHFFFAOYSA-N 1 1 332.385 2.493 20 5 EEBDMO C[C@H](CNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC001590258909 1349236404 /nfs/dbraw/zinc/23/64/04/1349236404.db2.gz FOYNSIOUNSAPLF-NWDGAFQWSA-N 1 1 345.407 2.307 20 5 EEBDMO CN(C)c1cc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)ccn1 ZINC000782175186 1371268168 /nfs/dbraw/zinc/26/81/68/1371268168.db2.gz QJJXUFROLRTULD-UHFFFAOYSA-N 1 1 341.415 2.378 20 5 EEBDMO O=[N+]([O-])c1cn(C[NH+]2CCC3(CCO3)CC2)nc1-c1ccncc1 ZINC000799957361 1371685881 /nfs/dbraw/zinc/68/58/81/1371685881.db2.gz LIMYMOQEBSMXCF-UHFFFAOYSA-N 1 1 329.360 2.066 20 5 EEBDMO O=[N+]([O-])c1ccc2nc(NCC[N@@H+]3C[C@H]4CC[C@@H](C3)O4)sc2c1 ZINC000829010201 1372260819 /nfs/dbraw/zinc/26/08/19/1372260819.db2.gz KWOATMQVDABORB-TXEJJXNPSA-N 1 1 334.401 2.480 20 5 EEBDMO CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1C[NH+](CC2CCC(C)(C)CC2)C1 ZINC000950055673 775877767 /nfs/dbraw/zinc/87/77/67/775877767.db2.gz KLYCNRYPEPGICC-HZPDHXFCSA-N 1 1 337.464 2.401 20 5 EEBDMO C[C@H](CNC(=O)N[C@H]1C[N@H+](C2CC2)C[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000893626014 776274105 /nfs/dbraw/zinc/27/41/05/776274105.db2.gz HRFZGFYSPCBOIL-IOASZLSFSA-N 1 1 346.431 2.480 20 5 EEBDMO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCN(Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 ZINC000846225938 790094321 /nfs/dbraw/zinc/09/43/21/790094321.db2.gz ROKHKFKVZWXJQC-XGWLTEMNSA-N 1 1 337.395 2.452 20 5 EEBDMO COC(=O)[C@]1(F)CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172907762 797133298 /nfs/dbraw/zinc/13/32/98/797133298.db2.gz HZJNBBGVSHRELJ-PBHICJAKSA-N 1 1 336.363 2.429 20 5 EEBDMO CC(=O)N(C)[C@H]1CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172913548 797172194 /nfs/dbraw/zinc/17/21/94/797172194.db2.gz RORGHEZIZJXKJO-WMZOPIPTSA-N 1 1 331.416 2.395 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N(C)[C@@H]2CC[N@@H+](C)C2)c1F ZINC001173190511 797281767 /nfs/dbraw/zinc/28/17/67/797281767.db2.gz ULDKJCQHFMWJNS-NWDGAFQWSA-N 1 1 325.384 2.309 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](C)[C@@H]2CCN(C)C2)c1F ZINC001173190511 797281775 /nfs/dbraw/zinc/28/17/75/797281775.db2.gz ULDKJCQHFMWJNS-NWDGAFQWSA-N 1 1 325.384 2.309 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)[C@@H]2CCN(C)C2)c1F ZINC001173190511 797281780 /nfs/dbraw/zinc/28/17/80/797281780.db2.gz ULDKJCQHFMWJNS-NWDGAFQWSA-N 1 1 325.384 2.309 20 5 EEBDMO Cc1ccccc1CCC[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001002787167 798609520 /nfs/dbraw/zinc/60/95/20/798609520.db2.gz HGPXFMSNIIPRBT-QZTJIDSGSA-N 1 1 345.443 2.173 20 5 EEBDMO CC(C)(C)OC(=O)N1C[C@H]([NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)C(F)(F)C1 ZINC001169001285 803566519 /nfs/dbraw/zinc/56/65/19/803566519.db2.gz FGUGAHMHVCRYMZ-WOPDTQHZSA-N 1 1 349.378 2.276 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CC[C@H]3[C@H]2CCN3Cc2cccnc2)C1 ZINC001169018999 803587757 /nfs/dbraw/zinc/58/77/57/803587757.db2.gz FYGIIMCYXRMEMC-XOYOTBSWSA-N 1 1 330.432 2.176 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CC[C@]3(C[C@H](Oc4ccccn4)CO3)C2)C1 ZINC001169025154 803590768 /nfs/dbraw/zinc/59/07/68/803590768.db2.gz SNIMZVFJFUTYAS-DFGXFYAUSA-N 1 1 347.415 2.139 20 5 EEBDMO O=C(c1ccsc1)N1C[C@@H]2C[N@@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]2C1 ZINC001169026457 803592403 /nfs/dbraw/zinc/59/24/03/803592403.db2.gz XGLRYJCWWNHJAZ-ARLBYUKCSA-N 1 1 349.456 2.197 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CC[C@@H](n3cc(Br)cn3)C2)C1 ZINC001169054371 803596487 /nfs/dbraw/zinc/59/64/87/803596487.db2.gz LPVMQKUDXSRIMZ-CYZMBNFOSA-N 1 1 343.225 2.338 20 5 EEBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC([C@H](O)c2ncc[nH]2)CC1 ZINC000788470466 807539906 /nfs/dbraw/zinc/53/99/06/807539906.db2.gz HEPPHSREAGZSPP-HNNXBMFYSA-N 1 1 334.351 2.403 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H](n3cncn3)C2)c([N+](=O)[O-])c1 ZINC001170344413 809916361 /nfs/dbraw/zinc/91/63/61/809916361.db2.gz BUZABINFALJLBQ-ZFWWWQNUSA-N 1 1 345.403 2.463 20 5 EEBDMO CN(C)CC[N@@H+](C)CCCN(C)c1c(F)cc([N+](=O)[O-])cc1F ZINC000808131640 812467443 /nfs/dbraw/zinc/46/74/43/812467443.db2.gz PZBJDAYIQXLZBG-UHFFFAOYSA-N 1 1 330.379 2.193 20 5 EEBDMO CN(CCCN(C)c1c(F)cc([N+](=O)[O-])cc1F)CC[NH+](C)C ZINC000808131640 812467450 /nfs/dbraw/zinc/46/74/50/812467450.db2.gz PZBJDAYIQXLZBG-UHFFFAOYSA-N 1 1 330.379 2.193 20 5 EEBDMO C[N@@H+](CCCOc1ccccc1)CCn1cc([N+](=O)[O-])ccc1=O ZINC000159716427 529896244 /nfs/dbraw/zinc/89/62/44/529896244.db2.gz WJOBPOHHZJVMLN-UHFFFAOYSA-N 1 1 331.372 2.157 20 5 EEBDMO CCC[N@@H+]1Cc2cccc(NC(=O)Cn3ccc([N+](=O)[O-])n3)c2C1 ZINC000066514294 215049814 /nfs/dbraw/zinc/04/98/14/215049814.db2.gz UHFNAEWDMDEDFE-UHFFFAOYSA-N 1 1 329.360 2.156 20 5 EEBDMO CCC[N@H+]1Cc2cccc(NC(=O)Cn3ccc([N+](=O)[O-])n3)c2C1 ZINC000066514294 215049821 /nfs/dbraw/zinc/04/98/21/215049821.db2.gz UHFNAEWDMDEDFE-UHFFFAOYSA-N 1 1 329.360 2.156 20 5 EEBDMO C[C@@H]1[C@H](C)OCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128935041 223002440 /nfs/dbraw/zinc/00/24/40/223002440.db2.gz STLAVGBTXBKCJI-MNOVXSKESA-N 1 1 325.340 2.172 20 5 EEBDMO C[C@@H]1[C@H](C)OCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128935041 223002441 /nfs/dbraw/zinc/00/24/41/223002441.db2.gz STLAVGBTXBKCJI-MNOVXSKESA-N 1 1 325.340 2.172 20 5 EEBDMO CN(C)C1(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])CCC1 ZINC000186993398 236089478 /nfs/dbraw/zinc/08/94/78/236089478.db2.gz XQXCKCSHFKEYCD-UHFFFAOYSA-N 1 1 334.420 2.340 20 5 EEBDMO CN(CCC(=O)Nc1ccccc1[N+](=O)[O-])CC1([NH+](C)C)CCC1 ZINC000186993398 236089481 /nfs/dbraw/zinc/08/94/81/236089481.db2.gz XQXCKCSHFKEYCD-UHFFFAOYSA-N 1 1 334.420 2.340 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC[C@H]1[C@@H](C)O ZINC000106864928 219711076 /nfs/dbraw/zinc/71/10/76/219711076.db2.gz KZFLMFSQIMOBBB-CJNGLKHVSA-N 1 1 335.404 2.467 20 5 EEBDMO O=c1c(Br)cn(CC[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000132635381 223350170 /nfs/dbraw/zinc/35/01/70/223350170.db2.gz ONRIAWLJDDALTO-UHFFFAOYSA-N 1 1 330.182 2.005 20 5 EEBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000438280815 242001694 /nfs/dbraw/zinc/00/16/94/242001694.db2.gz IROPBGYDCWJOMW-DDJMYBDESA-N 1 1 333.432 2.385 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@]3(CCSC3)C2)c([N+](=O)[O-])c1 ZINC000451959394 243324675 /nfs/dbraw/zinc/32/46/75/243324675.db2.gz AVQSSFVOJAZYBO-INIZCTEOSA-N 1 1 335.429 2.413 20 5 EEBDMO COc1cccc([C@@H](C)[NH+]2CCN(c3c([N+](=O)[O-])ncn3C)CC2)c1 ZINC000264256251 246250640 /nfs/dbraw/zinc/25/06/40/246250640.db2.gz ZEUZXNSIZFUWBI-CYBMUJFWSA-N 1 1 345.403 2.220 20 5 EEBDMO C[C@@H](Cn1cccn1)[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000265098674 247202185 /nfs/dbraw/zinc/20/21/85/247202185.db2.gz WJEKFFHYTVDJDE-NSHDSACASA-N 1 1 328.332 2.020 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCO[C@H]3CCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000265144931 247245675 /nfs/dbraw/zinc/24/56/75/247245675.db2.gz RHPLVLATDCDRHQ-HOTGVXAUSA-N 1 1 333.388 2.485 20 5 EEBDMO CC[N@H+](Cc1cccc(Cl)c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266480917 248323126 /nfs/dbraw/zinc/32/31/26/248323126.db2.gz TUIIDWHVZWHONG-HNNXBMFYSA-N 1 1 338.795 2.328 20 5 EEBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 ZINC000266588195 248373095 /nfs/dbraw/zinc/37/30/95/248373095.db2.gz KWXIJOVVCKPDSZ-CSMYWGQOSA-N 1 1 348.378 2.374 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CC(C)(C)O1 ZINC000117336659 221055800 /nfs/dbraw/zinc/05/58/00/221055800.db2.gz ZUKLQBGRMUFNAC-GFCCVEGCSA-N 1 1 349.387 2.392 20 5 EEBDMO CC(=O)NCC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000267582310 256070468 /nfs/dbraw/zinc/07/04/68/256070468.db2.gz GQKQJZRTEQYVBP-UHFFFAOYSA-N 1 1 332.360 2.084 20 5 EEBDMO CCCCC[N@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000118825629 221190902 /nfs/dbraw/zinc/19/09/02/221190902.db2.gz WXOMBQFRODFRRF-UHFFFAOYSA-N 1 1 339.392 2.026 20 5 EEBDMO CCCCC[N@@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000118825629 221190904 /nfs/dbraw/zinc/19/09/04/221190904.db2.gz WXOMBQFRODFRRF-UHFFFAOYSA-N 1 1 339.392 2.026 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H]([C@H](C)O)C1 ZINC000248544208 160350016 /nfs/dbraw/zinc/35/00/16/160350016.db2.gz IVSAVWMNFQHNJT-MDZLAQPJSA-N 1 1 332.360 2.409 20 5 EEBDMO CC[N@H+]1CCC[C@H](CNC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000359440734 153363874 /nfs/dbraw/zinc/36/38/74/153363874.db2.gz PPVMMTDZNZMDFA-CYBMUJFWSA-N 1 1 335.404 2.374 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1CN1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000374320155 154051447 /nfs/dbraw/zinc/05/14/47/154051447.db2.gz GCKAHWXCCCHCKR-ZDUSSCGKSA-N 1 1 344.419 2.241 20 5 EEBDMO COC(=O)c1cnc(N[C@@H]2CC[N@H+](C3CCCC3)C2)c([N+](=O)[O-])c1 ZINC000377195385 154081870 /nfs/dbraw/zinc/08/18/70/154081870.db2.gz FAKVZZKYMCQPQM-GFCCVEGCSA-N 1 1 334.376 2.205 20 5 EEBDMO Cc1cc(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)c(N)c([N+](=O)[O-])c1 ZINC000068510052 159020506 /nfs/dbraw/zinc/02/05/06/159020506.db2.gz QLHQCMCGSMCFHD-ZDUSSCGKSA-N 1 1 332.360 2.111 20 5 EEBDMO CC[N@@H+](CCNC(=O)NCCNc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000102549491 159265890 /nfs/dbraw/zinc/26/58/90/159265890.db2.gz YGTBNEUJFMOPMA-UHFFFAOYSA-N 1 1 337.424 2.036 20 5 EEBDMO CC[N@H+]1CCC[C@H](CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000105177096 159298785 /nfs/dbraw/zinc/29/87/85/159298785.db2.gz KXVVUGVPUPMWLV-OAHLLOKOSA-N 1 1 334.420 2.168 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2[C@@H](C)CCC[C@H]2CO)cccc1[N+](=O)[O-] ZINC000245711789 160249369 /nfs/dbraw/zinc/24/93/69/160249369.db2.gz ZOGKDFBHFUOBDA-JSGCOSHPSA-N 1 1 335.404 2.467 20 5 EEBDMO NC(=O)[C@@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000342456019 161066893 /nfs/dbraw/zinc/06/68/93/161066893.db2.gz RHCUPGPKEVKVLU-OAHLLOKOSA-N 1 1 333.775 2.434 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000342499981 161070178 /nfs/dbraw/zinc/07/01/78/161070178.db2.gz OSHRQNAHIPURON-MLGOLLRUSA-N 1 1 342.399 2.148 20 5 EEBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000344403926 161223895 /nfs/dbraw/zinc/22/38/95/161223895.db2.gz WZCCVDLZLFOXOZ-LLVKDONJSA-N 1 1 325.796 2.343 20 5 EEBDMO COC(=O)CC1CC[NH+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000345324658 161292159 /nfs/dbraw/zinc/29/21/59/161292159.db2.gz HFCGSYKBSCNRLC-LBPRGKRZSA-N 1 1 349.387 2.197 20 5 EEBDMO CC(C)c1ccc(C(=O)NCC[NH+]2CCSCC2)cc1[N+](=O)[O-] ZINC000352361245 162103714 /nfs/dbraw/zinc/10/37/14/162103714.db2.gz QLCPTTDXXBKASH-UHFFFAOYSA-N 1 1 337.445 2.497 20 5 EEBDMO COc1c(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000356268995 163386764 /nfs/dbraw/zinc/38/67/64/163386764.db2.gz STZJSDJVEZWUBW-CQSZACIVSA-N 1 1 347.415 2.407 20 5 EEBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c1 ZINC000360859979 164391941 /nfs/dbraw/zinc/39/19/41/164391941.db2.gz XCYDKSOYNHQAHU-UHFFFAOYSA-N 1 1 344.346 2.400 20 5 EEBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000364062186 165012880 /nfs/dbraw/zinc/01/28/80/165012880.db2.gz QZEQWDIKEFDNQO-QGZVFWFLSA-N 1 1 346.431 2.484 20 5 EEBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@H+]2Cc2c([N+](=O)[O-])ncn2C)C1 ZINC000368267711 166079440 /nfs/dbraw/zinc/07/94/40/166079440.db2.gz SGROSSBPQQHIHE-KQTLUZQSSA-N 1 1 336.436 2.480 20 5 EEBDMO COc1ccnc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1OC ZINC000365122383 165384960 /nfs/dbraw/zinc/38/49/60/165384960.db2.gz LCELWXHQMAYDCP-UHFFFAOYSA-N 1 1 347.375 2.041 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(n2cccn2)CC1 ZINC000365159655 165394633 /nfs/dbraw/zinc/39/46/33/165394633.db2.gz KIYRSBFRNHLZMF-CYBMUJFWSA-N 1 1 343.387 2.455 20 5 EEBDMO Cc1cc(OCC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000369785052 166329525 /nfs/dbraw/zinc/32/95/25/166329525.db2.gz UMIRCMVTYWEMAZ-RHSMWYFYSA-N 1 1 347.415 2.225 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC2(CCC[N@H+]2C)CC1 ZINC000374986091 167079276 /nfs/dbraw/zinc/07/92/76/167079276.db2.gz IBSRVQOAZKLXKP-CQSZACIVSA-N 1 1 346.431 2.482 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1c[nH+]c2n1CCCC2 ZINC000375477450 167143355 /nfs/dbraw/zinc/14/33/55/167143355.db2.gz BHTHGLSDBGARFK-UHFFFAOYSA-N 1 1 345.359 2.458 20 5 EEBDMO C[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC[S@@](=O)C1 ZINC000375934379 167229323 /nfs/dbraw/zinc/22/93/23/167229323.db2.gz VOHFBQYNHHKNII-WHEQGISXSA-N 1 1 326.418 2.064 20 5 EEBDMO C[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC[S@@](=O)C1 ZINC000375934379 167229324 /nfs/dbraw/zinc/22/93/24/167229324.db2.gz VOHFBQYNHHKNII-WHEQGISXSA-N 1 1 326.418 2.064 20 5 EEBDMO CC[N@H+]1CCC[C@H](CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000122181238 222032032 /nfs/dbraw/zinc/03/20/32/222032032.db2.gz ICORSAMKCGPHSO-GFCCVEGCSA-N 1 1 341.433 2.142 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1C[C@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC000278691336 269240335 /nfs/dbraw/zinc/24/03/35/269240335.db2.gz ZKIQSGVSUIRJDD-QGZVFWFLSA-N 1 1 343.383 2.048 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])[nH]1)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000280732079 269387903 /nfs/dbraw/zinc/38/79/03/269387903.db2.gz YWKYTYBYKLTDLM-GASCZTMLSA-N 1 1 340.383 2.127 20 5 EEBDMO CO[C@@H]1C[C@@H](CN(C)Cc2c(Cl)cccc2[N+](=O)[O-])[N@@H+](C)C1 ZINC000345129591 274069185 /nfs/dbraw/zinc/06/91/85/274069185.db2.gz GRTBXYAJKIRVIV-NWDGAFQWSA-N 1 1 327.812 2.399 20 5 EEBDMO C[NH+]1CCC([C@@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)CC1 ZINC000272711151 274179115 /nfs/dbraw/zinc/17/91/15/274179115.db2.gz XQXBIYRPRORNCP-CYBMUJFWSA-N 1 1 333.388 2.104 20 5 EEBDMO O=C(CNc1ccccc1[N+](=O)[O-])NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000277393914 274287822 /nfs/dbraw/zinc/28/78/22/274287822.db2.gz ASNHRYFDVGUJII-CQSZACIVSA-N 1 1 332.404 2.140 20 5 EEBDMO O=C1[C@H]([N@H+]2CC[C@@H]([C@H]3CCOC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000374412645 275029705 /nfs/dbraw/zinc/02/97/05/275029705.db2.gz VFHUZHVSAMDVQM-JKIFEVAISA-N 1 1 345.399 2.059 20 5 EEBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000288362354 275050523 /nfs/dbraw/zinc/05/05/23/275050523.db2.gz HDRXDJNXVHDMPU-INIZCTEOSA-N 1 1 343.431 2.483 20 5 EEBDMO C[C@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000288451416 275059819 /nfs/dbraw/zinc/05/98/19/275059819.db2.gz ZACBZZPDTMWTFQ-JSGCOSHPSA-N 1 1 328.372 2.316 20 5 EEBDMO CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)[C@H](C)C1 ZINC000288480260 275062542 /nfs/dbraw/zinc/06/25/42/275062542.db2.gz PGQDLTDSOOBLIB-GFCCVEGCSA-N 1 1 328.372 2.309 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](N2CCOCC2)[C@H]1C ZINC000289762704 275146524 /nfs/dbraw/zinc/14/65/24/275146524.db2.gz KURQBEZJUMXVNX-RHSMWYFYSA-N 1 1 349.431 2.289 20 5 EEBDMO NC(=O)c1ccnc(NC[C@@H]2CCC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000291005183 275260206 /nfs/dbraw/zinc/26/02/06/275260206.db2.gz VPCMTNFKHBBPHA-ZDUSSCGKSA-N 1 1 347.419 2.298 20 5 EEBDMO C[C@@H]1[C@H]([NH+]2CCOCC2)CCN1c1ccc([N+](=O)[O-])c2cccnc21 ZINC000291069615 275266970 /nfs/dbraw/zinc/26/69/70/275266970.db2.gz GWIMUHDSHGGMRK-UKRRQHHQSA-N 1 1 342.399 2.442 20 5 EEBDMO CNS(=O)(=O)c1cccc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000089512190 277037478 /nfs/dbraw/zinc/03/74/78/277037478.db2.gz FQYYVHARWNUILW-GFCCVEGCSA-N 1 1 349.412 2.354 20 5 EEBDMO C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000362843916 288084885 /nfs/dbraw/zinc/08/48/85/288084885.db2.gz SJPIIVWFBNCZCG-WPGHFRTFSA-N 1 1 335.429 2.367 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000293109098 293127817 /nfs/dbraw/zinc/12/78/17/293127817.db2.gz YILBICJHNRKTBD-KBXCAEBGSA-N 1 1 346.431 2.340 20 5 EEBDMO C[C@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000293738009 293283237 /nfs/dbraw/zinc/28/32/37/293283237.db2.gz QZKVNGNHKJDXCM-GFCCVEGCSA-N 1 1 332.404 2.123 20 5 EEBDMO C[C@@]1(F)C[NH2+]CCN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000295180223 293638479 /nfs/dbraw/zinc/63/84/79/293638479.db2.gz HINMBVHBHBGMFP-CYBMUJFWSA-N 1 1 349.284 2.387 20 5 EEBDMO COc1ccc(NC(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-] ZINC000296970872 294116493 /nfs/dbraw/zinc/11/64/93/294116493.db2.gz XCIQJPZZTUXWKY-YHWZYXNKSA-N 1 1 334.376 2.350 20 5 EEBDMO C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCC[C@H]1c1ccccc1 ZINC000297405435 294235162 /nfs/dbraw/zinc/23/51/62/294235162.db2.gz CMXXXHNFBSSMJM-BZSNNMDCSA-N 1 1 344.415 2.420 20 5 EEBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000159859714 311347514 /nfs/dbraw/zinc/34/75/14/311347514.db2.gz KQOBHLSHKUVHIY-TZMCWYRMSA-N 1 1 325.434 2.363 20 5 EEBDMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000332640221 312039127 /nfs/dbraw/zinc/03/91/27/312039127.db2.gz QUGIQVJZUNDCAJ-OLZOCXBDSA-N 1 1 333.388 2.302 20 5 EEBDMO C[C@@H]1C[C@H](CO)C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000420947134 314005709 /nfs/dbraw/zinc/00/57/09/314005709.db2.gz SXFBUUIAGWMLMX-NEPJUHHUSA-N 1 1 332.360 2.095 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000439217448 315070326 /nfs/dbraw/zinc/07/03/26/315070326.db2.gz RSVXEZHIKQDVDC-CYBMUJFWSA-N 1 1 341.433 2.008 20 5 EEBDMO Cc1cc(S(=O)(=O)N2CC[NH2+]Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000440350170 315125471 /nfs/dbraw/zinc/12/54/71/315125471.db2.gz AEZUVIUNJLOINO-UHFFFAOYSA-N 1 1 347.396 2.202 20 5 EEBDMO Cc1ccccc1C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000441280538 315178224 /nfs/dbraw/zinc/17/82/24/315178224.db2.gz SGGKCLXVUSOFMQ-KRWDZBQOSA-N 1 1 330.388 2.125 20 5 EEBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N=c1cc[nH]c2cc[nH+]cc21 ZINC000443919503 315264434 /nfs/dbraw/zinc/26/44/34/315264434.db2.gz IPXOQUMLWUXMGT-UHFFFAOYSA-N 1 1 344.352 2.069 20 5 EEBDMO CCOC(=O)C[C@@H](C)[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000182662397 323382860 /nfs/dbraw/zinc/38/28/60/323382860.db2.gz VHVXRZYPUGYEOZ-GFCCVEGCSA-N 1 1 337.376 2.115 20 5 EEBDMO CCOC(=O)C[C@@H](C)[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000182662397 323382863 /nfs/dbraw/zinc/38/28/63/323382863.db2.gz VHVXRZYPUGYEOZ-GFCCVEGCSA-N 1 1 337.376 2.115 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000581047999 324173482 /nfs/dbraw/zinc/17/34/82/324173482.db2.gz DLXLGGQJIPCWHR-NSHDSACASA-N 1 1 337.376 2.174 20 5 EEBDMO C[C@@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000358388476 465095444 /nfs/dbraw/zinc/09/54/44/465095444.db2.gz DRLNPOPPVYIBNN-IUODEOHRSA-N 1 1 335.379 2.362 20 5 EEBDMO Cc1n[nH]c(C(=O)N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000354735632 465122182 /nfs/dbraw/zinc/12/21/82/465122182.db2.gz SFGFQHNSVQNSKF-JSGCOSHPSA-N 1 1 343.387 2.192 20 5 EEBDMO CC(=O)NCC[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000347658569 465153324 /nfs/dbraw/zinc/15/33/24/465153324.db2.gz WDBCCWGMNMOVFA-HNNXBMFYSA-N 1 1 335.404 2.212 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000339433371 465271350 /nfs/dbraw/zinc/27/13/50/465271350.db2.gz PCHGZPSRJXPZJZ-GOSISDBHSA-N 1 1 346.431 2.259 20 5 EEBDMO CN1CCC[C@]2(CC[N@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000339440250 465275471 /nfs/dbraw/zinc/27/54/71/465275471.db2.gz PGGZFCZSEUWJKI-SFHVURJKSA-N 1 1 346.431 2.341 20 5 EEBDMO CN1CCC[C@]2(CC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000339440250 465275475 /nfs/dbraw/zinc/27/54/75/465275475.db2.gz PGGZFCZSEUWJKI-SFHVURJKSA-N 1 1 346.431 2.341 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2ccccc2)CC2(CO)CC2)n1 ZINC000341931253 465276943 /nfs/dbraw/zinc/27/69/43/465276943.db2.gz DFKLHKOXBZADAO-UHFFFAOYSA-N 1 1 330.388 2.066 20 5 EEBDMO CCNc1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000356384224 465351195 /nfs/dbraw/zinc/35/11/95/465351195.db2.gz DELBFVUAYJBVBC-IUODEOHRSA-N 1 1 334.420 2.439 20 5 EEBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2ccc([N+](=O)[O-])s2)C[C@H](C)O1 ZINC000085455787 462547460 /nfs/dbraw/zinc/54/74/60/462547460.db2.gz AEAXLMQJKUWNQU-TXEJJXNPSA-N 1 1 341.433 2.276 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087086231 462588858 /nfs/dbraw/zinc/58/88/58/462588858.db2.gz SLYCTGBKJABPAU-IAGOWNOFSA-N 1 1 344.415 2.289 20 5 EEBDMO O=C(C[N@@H+]1CC[C@@]2(CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000153813662 462695372 /nfs/dbraw/zinc/69/53/72/462695372.db2.gz FYNHEIRRGCNVDF-OAHLLOKOSA-N 1 1 339.779 2.299 20 5 EEBDMO O=C(C[N@H+]1CC[C@@]2(CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000153813662 462695375 /nfs/dbraw/zinc/69/53/75/462695375.db2.gz FYNHEIRRGCNVDF-OAHLLOKOSA-N 1 1 339.779 2.299 20 5 EEBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@]3(CCOC3)C2)c([N+](=O)[O-])c1 ZINC000153851774 462700950 /nfs/dbraw/zinc/70/09/50/462700950.db2.gz FBRCSYGHYCZDRG-SJCJKPOMSA-N 1 1 349.387 2.043 20 5 EEBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@]3(CCOC3)C2)c([N+](=O)[O-])c1 ZINC000153851774 462700954 /nfs/dbraw/zinc/70/09/54/462700954.db2.gz FBRCSYGHYCZDRG-SJCJKPOMSA-N 1 1 349.387 2.043 20 5 EEBDMO C[C@@H]1C[N@@H+](C[C@H](O)COc2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000153933590 462710454 /nfs/dbraw/zinc/71/04/54/462710454.db2.gz NIOUVGXKSKOESZ-TUAOUCFPSA-N 1 1 344.795 2.097 20 5 EEBDMO C[C@@H]1C[N@H+](C[C@H](O)COc2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000153933590 462710457 /nfs/dbraw/zinc/71/04/57/462710457.db2.gz NIOUVGXKSKOESZ-TUAOUCFPSA-N 1 1 344.795 2.097 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000089807783 462722544 /nfs/dbraw/zinc/72/25/44/462722544.db2.gz YVOQNENHXLNBCJ-GXTWGEPZSA-N 1 1 328.372 2.433 20 5 EEBDMO CCOc1ccc(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000075849165 462763836 /nfs/dbraw/zinc/76/38/36/462763836.db2.gz JVAWVUWDFKLBCC-GFCCVEGCSA-N 1 1 333.388 2.208 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+](Cc1cccc(O)c1)CC1CC1 ZINC000090549126 462796641 /nfs/dbraw/zinc/79/66/41/462796641.db2.gz KTSQJUVWOMKWFP-UHFFFAOYSA-N 1 1 343.383 2.374 20 5 EEBDMO C[C@@H]1C[N@H+](C[C@H](O)COc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000120228449 462975540 /nfs/dbraw/zinc/97/55/40/462975540.db2.gz YVQPJXUNIRMMAH-LOWVWBTDSA-N 1 1 344.795 2.097 20 5 EEBDMO C[C@@H]1C[N@@H+](C[C@H](O)COc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000120228449 462975534 /nfs/dbraw/zinc/97/55/34/462975534.db2.gz YVQPJXUNIRMMAH-LOWVWBTDSA-N 1 1 344.795 2.097 20 5 EEBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC(C)(CO)CO ZINC000093502684 463040016 /nfs/dbraw/zinc/04/00/16/463040016.db2.gz CYRYRIVMKGSUBB-UHFFFAOYSA-N 1 1 334.372 2.278 20 5 EEBDMO C[C@@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC000068202362 463103438 /nfs/dbraw/zinc/10/34/38/463103438.db2.gz XLYHLMFAUNPEHZ-KBPBESRZSA-N 1 1 334.420 2.386 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000026156496 463152391 /nfs/dbraw/zinc/15/23/91/463152391.db2.gz JWOVGSMICPFNPS-TXEJJXNPSA-N 1 1 337.376 2.041 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000139933845 463334053 /nfs/dbraw/zinc/33/40/53/463334053.db2.gz UNDXIPWHPLETFQ-UHFFFAOYSA-N 1 1 333.367 2.180 20 5 EEBDMO C[C@H]1c2cccn2CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000032489418 463379766 /nfs/dbraw/zinc/37/97/66/463379766.db2.gz FLQOVNLPALOZED-DZGCQCFKSA-N 1 1 331.372 2.213 20 5 EEBDMO C[C@H]1c2cccn2CC[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000032489418 463379772 /nfs/dbraw/zinc/37/97/72/463379772.db2.gz FLQOVNLPALOZED-DZGCQCFKSA-N 1 1 331.372 2.213 20 5 EEBDMO CC(C)[C@H]1C[N@H+](C)CCN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000151266980 463502796 /nfs/dbraw/zinc/50/27/96/463502796.db2.gz DBNLCOQUZOZKNQ-CQSZACIVSA-N 1 1 337.445 2.486 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000151266980 463502801 /nfs/dbraw/zinc/50/28/01/463502801.db2.gz DBNLCOQUZOZKNQ-CQSZACIVSA-N 1 1 337.445 2.486 20 5 EEBDMO C[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000125329972 463531696 /nfs/dbraw/zinc/53/16/96/463531696.db2.gz UXMBREJHZFHOPS-UHFFFAOYSA-N 1 1 331.294 2.391 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000126130798 463608221 /nfs/dbraw/zinc/60/82/21/463608221.db2.gz DIDDDTZGESUTFI-OLZOCXBDSA-N 1 1 337.445 2.486 20 5 EEBDMO Cc1c(Br)c(NC[C@H]2CC[N@H+](C)C2)ncc1[N+](=O)[O-] ZINC000165725346 463646529 /nfs/dbraw/zinc/64/65/29/463646529.db2.gz GRJCMDONESYJFG-SECBINFHSA-N 1 1 329.198 2.424 20 5 EEBDMO Cn1cc[nH+]c1N1CCC(Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000170613077 463683899 /nfs/dbraw/zinc/68/38/99/463683899.db2.gz VAGZLMRJLGTEDW-UHFFFAOYSA-N 1 1 346.347 2.317 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000286846978 463723182 /nfs/dbraw/zinc/72/31/82/463723182.db2.gz BDJRSKYCFZUOJW-CZUORRHYSA-N 1 1 346.431 2.261 20 5 EEBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000269288338 463942092 /nfs/dbraw/zinc/94/20/92/463942092.db2.gz SGVIREVGSMECOR-HOCLYGCPSA-N 1 1 330.388 2.274 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000198354968 464088934 /nfs/dbraw/zinc/08/89/34/464088934.db2.gz GKMHDRFFMUGVME-ZDUSSCGKSA-N 1 1 333.344 2.229 20 5 EEBDMO C[N@H+](CCN1CCOC(C)(C)C1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000279699570 464130660 /nfs/dbraw/zinc/13/06/60/464130660.db2.gz ISHKGYXZTUDYBH-UHFFFAOYSA-N 1 1 348.403 2.279 20 5 EEBDMO C[N@@H+](CCN1CCOC(C)(C)C1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000279699570 464130664 /nfs/dbraw/zinc/13/06/64/464130664.db2.gz ISHKGYXZTUDYBH-UHFFFAOYSA-N 1 1 348.403 2.279 20 5 EEBDMO Cc1cccc(CC[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)n1 ZINC000579706066 468398748 /nfs/dbraw/zinc/39/87/48/468398748.db2.gz QSFQBMRRONACLG-UHFFFAOYSA-N 1 1 327.388 2.058 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC[N@@H+](C)CC1 ZINC000263835439 464210493 /nfs/dbraw/zinc/21/04/93/464210493.db2.gz BEPMJTJQUKAQHV-GFCCVEGCSA-N 1 1 331.376 2.343 20 5 EEBDMO COc1cc(C[N@@H+]2CC[C@H](CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180026077 464225974 /nfs/dbraw/zinc/22/59/74/464225974.db2.gz PQQSIOSBUFITTJ-JTQLQIEISA-N 1 1 346.330 2.062 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@H](CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180026077 464225980 /nfs/dbraw/zinc/22/59/80/464225980.db2.gz PQQSIOSBUFITTJ-JTQLQIEISA-N 1 1 346.330 2.062 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@H]1C ZINC000264345029 464295199 /nfs/dbraw/zinc/29/51/99/464295199.db2.gz QTBCGCZMFNVABI-OLZOCXBDSA-N 1 1 330.388 2.034 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1 ZINC000281236181 464381973 /nfs/dbraw/zinc/38/19/73/464381973.db2.gz SPZCZBAQRRHNOK-LLVKDONJSA-N 1 1 331.376 2.022 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)c1 ZINC000174832356 464456105 /nfs/dbraw/zinc/45/61/05/464456105.db2.gz AAMBNQOCBALKNU-KRWDZBQOSA-N 1 1 330.388 2.473 20 5 EEBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCc1cccs1 ZINC000285293534 464513689 /nfs/dbraw/zinc/51/36/89/464513689.db2.gz KMJDBHWSDXMJEN-UHFFFAOYSA-N 1 1 333.413 2.447 20 5 EEBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCc1cccs1 ZINC000285293534 464513691 /nfs/dbraw/zinc/51/36/91/464513691.db2.gz KMJDBHWSDXMJEN-UHFFFAOYSA-N 1 1 333.413 2.447 20 5 EEBDMO C[C@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000175382069 464537326 /nfs/dbraw/zinc/53/73/26/464537326.db2.gz STZUOVCTKOVHLJ-SPSFWMDKSA-N 1 1 336.417 2.222 20 5 EEBDMO O=[N+]([O-])c1cnc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)s1 ZINC000281728011 464561212 /nfs/dbraw/zinc/56/12/12/464561212.db2.gz AOARLOPPHQZAMO-KGLIPLIRSA-N 1 1 348.428 2.346 20 5 EEBDMO Cn1cc(C[N@@H+](C)CC(C)(C)CO)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000294677587 464571895 /nfs/dbraw/zinc/57/18/95/464571895.db2.gz BJVJKXCZWOZQKZ-UHFFFAOYSA-N 1 1 332.404 2.446 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272349182 464573879 /nfs/dbraw/zinc/57/38/79/464573879.db2.gz OGLCVGQCPCFXTA-IINYFYTJSA-N 1 1 339.342 2.286 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000247500806 464686874 /nfs/dbraw/zinc/68/68/74/464686874.db2.gz UZEOOMWCAYFAGV-SWLSCSKDSA-N 1 1 337.445 2.486 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3ccc(Cl)cc3)CC2)n1 ZINC000176218605 464723440 /nfs/dbraw/zinc/72/34/40/464723440.db2.gz FPXNLTHKMJFVLY-UHFFFAOYSA-N 1 1 335.795 2.267 20 5 EEBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000265917101 464732162 /nfs/dbraw/zinc/73/21/62/464732162.db2.gz ASHGIHSTSIBVHL-LLVKDONJSA-N 1 1 339.392 2.072 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH2+]Cc1nc(C2CC2)cs1 ZINC000579824792 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SQVJPKZAGDMDOE-CQSZACIVSA-N 1 1 343.387 2.055 20 5 EEBDMO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)NCCF ZINC000282543608 464858870 /nfs/dbraw/zinc/85/88/70/464858870.db2.gz CHVSJRYEWNWTAN-LLVKDONJSA-N 1 1 335.335 2.419 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000249456411 464876391 /nfs/dbraw/zinc/87/63/91/464876391.db2.gz YBWRVEPDJKJVFN-NEPJUHHUSA-N 1 1 327.812 2.135 20 5 EEBDMO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C(=O)NCCF ZINC000282829517 464964682 /nfs/dbraw/zinc/96/46/82/464964682.db2.gz ZFCWIVDBPCHIAZ-LLVKDONJSA-N 1 1 335.335 2.419 20 5 EEBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000286606244 464975093 /nfs/dbraw/zinc/97/50/93/464975093.db2.gz RISSATXPSDPGEB-XNHOIOAFSA-N 1 1 333.344 2.358 20 5 EEBDMO CC[N@H+]1CCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000286642785 464989642 /nfs/dbraw/zinc/98/96/42/464989642.db2.gz TXASXOAJFUTGOB-LLVKDONJSA-N 1 1 340.811 2.213 20 5 EEBDMO COC(=O)[C@@]1(C)CC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000177416610 465008685 /nfs/dbraw/zinc/00/86/85/465008685.db2.gz SHPOKUZWFDQZKE-KRWDZBQOSA-N 1 1 349.387 2.117 20 5 EEBDMO O=C1C[C@H]([N@@H+]2CCCC3(CCC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000358832444 465349403 /nfs/dbraw/zinc/34/94/03/465349403.db2.gz REKBDAALKGWDBK-HNNXBMFYSA-N 1 1 343.383 2.493 20 5 EEBDMO O=C1C[C@H]([N@H+]2CCCC3(CCC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000358832444 465349408 /nfs/dbraw/zinc/34/94/08/465349408.db2.gz REKBDAALKGWDBK-HNNXBMFYSA-N 1 1 343.383 2.493 20 5 EEBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000351943394 465455729 /nfs/dbraw/zinc/45/57/29/465455729.db2.gz LQBLMKIRKQQTAD-SNVBAGLBSA-N 1 1 343.330 2.362 20 5 EEBDMO COc1cc(C(=O)N[C@@H](C)C[N@@H+](C)C(C)C)cc([N+](=O)[O-])c1OC ZINC000356750179 465519095 /nfs/dbraw/zinc/51/90/95/465519095.db2.gz ZWOUXYIGDZAUCJ-NSHDSACASA-N 1 1 339.392 2.071 20 5 EEBDMO CC(C)[N@H+](C)C[C@H](C)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000356757682 465523253 /nfs/dbraw/zinc/52/32/53/465523253.db2.gz AHTNIFZTPGYSKR-ZDUSSCGKSA-N 1 1 345.403 2.239 20 5 EEBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCC[NH+]1CCC1 ZINC000339961780 465638407 /nfs/dbraw/zinc/63/84/07/465638407.db2.gz WKLRYYYRGYVQCV-UHFFFAOYSA-N 1 1 342.193 2.101 20 5 EEBDMO CCOc1ccc(NC(=O)CO[C@@H](C)Cc2[nH]cc[nH+]2)c([N+](=O)[O-])c1 ZINC000360949435 465655184 /nfs/dbraw/zinc/65/51/84/465655184.db2.gz KXBVLNMDHUZBBB-NSHDSACASA-N 1 1 348.359 2.303 20 5 EEBDMO Cc1c(NC(=O)CCN2CC[N@H+](C)[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000356980238 465675980 /nfs/dbraw/zinc/67/59/80/465675980.db2.gz OTWVWEMDIPWESO-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCN(C)[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000356980238 465675991 /nfs/dbraw/zinc/67/59/91/465675991.db2.gz OTWVWEMDIPWESO-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCN(C)[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000356980238 465675997 /nfs/dbraw/zinc/67/59/97/465675997.db2.gz OTWVWEMDIPWESO-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000330590582 465719765 /nfs/dbraw/zinc/71/97/65/465719765.db2.gz OAAPUZVQIFLUEP-VXGBXAGGSA-N 1 1 331.376 2.169 20 5 EEBDMO C[N@H+]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000371353316 465738764 /nfs/dbraw/zinc/73/87/64/465738764.db2.gz IICUPTKHAKGWFC-SJORKVTESA-N 1 1 325.368 2.422 20 5 EEBDMO C[C@@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000338027511 465761328 /nfs/dbraw/zinc/76/13/28/465761328.db2.gz JEBJZBNWQAWZFT-MJBXVCDLSA-N 1 1 334.420 2.384 20 5 EEBDMO CC(C)[C@@H](CO)[N@H+](Cc1c([N+](=O)[O-])ncn1C)Cc1ccccc1 ZINC000357101436 465773687 /nfs/dbraw/zinc/77/36/87/465773687.db2.gz ZBAJJIQPSLVJNT-MRXNPFEDSA-N 1 1 332.404 2.347 20 5 EEBDMO CC(C)[C@@H](CO)[N@@H+](Cc1c([N+](=O)[O-])ncn1C)Cc1ccccc1 ZINC000357101436 465773699 /nfs/dbraw/zinc/77/36/99/465773699.db2.gz ZBAJJIQPSLVJNT-MRXNPFEDSA-N 1 1 332.404 2.347 20 5 EEBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000340146534 465814103 /nfs/dbraw/zinc/81/41/03/465814103.db2.gz GJJDFERATOJLIX-GFCCVEGCSA-N 1 1 330.388 2.171 20 5 EEBDMO CC(C)C[N@H+]1CC[C@@H](CNc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000362559373 465830616 /nfs/dbraw/zinc/83/06/16/465830616.db2.gz DKUGZSDPIPIVIR-ZDUSSCGKSA-N 1 1 345.403 3.035 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(N2CCCC2=O)CC1 ZINC000366607948 465831178 /nfs/dbraw/zinc/83/11/78/465831178.db2.gz KNOUSOOQEOWLSO-UHFFFAOYSA-N 1 1 333.388 2.190 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c1 ZINC000346181174 465968648 /nfs/dbraw/zinc/96/86/48/465968648.db2.gz HWKFJEBLHJHXMT-OGHNNQOOSA-N 1 1 347.415 2.406 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](C)C[C@H]1[C@H](C)O ZINC000331306842 466022989 /nfs/dbraw/zinc/02/29/89/466022989.db2.gz ZTMARBTWMXYNBT-WHOFXGATSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](C)C[C@H]1[C@H](C)O ZINC000331306842 466022999 /nfs/dbraw/zinc/02/29/99/466022999.db2.gz ZTMARBTWMXYNBT-WHOFXGATSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)C[C@@H]1[C@H](C)O ZINC000331307000 466023217 /nfs/dbraw/zinc/02/32/17/466023217.db2.gz ZZPHXTSHMJYHDL-DETPVDSQSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)C[C@@H]1[C@H](C)O ZINC000331307000 466023227 /nfs/dbraw/zinc/02/32/27/466023227.db2.gz ZZPHXTSHMJYHDL-DETPVDSQSA-N 1 1 335.404 2.323 20 5 EEBDMO COc1ccc(NC(=O)CC[NH2+][C@H](C)c2ccon2)c([N+](=O)[O-])c1 ZINC000349235831 466029545 /nfs/dbraw/zinc/02/95/45/466029545.db2.gz GPCSCRKUBXTVQI-SNVBAGLBSA-N 1 1 334.332 2.271 20 5 EEBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000366953865 466038214 /nfs/dbraw/zinc/03/82/14/466038214.db2.gz HFZUXWVQHVEDRP-QGZVFWFLSA-N 1 1 341.367 2.277 20 5 EEBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000366953865 466038217 /nfs/dbraw/zinc/03/82/17/466038217.db2.gz HFZUXWVQHVEDRP-QGZVFWFLSA-N 1 1 341.367 2.277 20 5 EEBDMO C[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccncc1F ZINC000338345406 466046365 /nfs/dbraw/zinc/04/63/65/466046365.db2.gz IZUHIIDIYPCYIO-NSHDSACASA-N 1 1 332.335 2.443 20 5 EEBDMO Cc1cc(C(=O)N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000371993187 466108479 /nfs/dbraw/zinc/10/84/79/466108479.db2.gz SEDPGJDERXDAFX-RDJZCZTQSA-N 1 1 347.415 2.276 20 5 EEBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000338425098 466116978 /nfs/dbraw/zinc/11/69/78/466116978.db2.gz PWFUDWWGPUDBJF-GFCCVEGCSA-N 1 1 336.392 2.080 20 5 EEBDMO CCOc1cc(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000302487287 466145858 /nfs/dbraw/zinc/14/58/58/466145858.db2.gz IRIQTUMRYGRZAB-CYBMUJFWSA-N 1 1 337.420 2.275 20 5 EEBDMO CC(=O)c1ccc(N2CC[N@H+](CC(C)(C)O)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000302521432 466148740 /nfs/dbraw/zinc/14/87/40/466148740.db2.gz XQJYOVIGIYNYQV-GFCCVEGCSA-N 1 1 335.404 2.079 20 5 EEBDMO CC(=O)c1ccc(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000302521432 466148747 /nfs/dbraw/zinc/14/87/47/466148747.db2.gz XQJYOVIGIYNYQV-GFCCVEGCSA-N 1 1 335.404 2.079 20 5 EEBDMO Cn1nccc1[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000372170808 466202802 /nfs/dbraw/zinc/20/28/02/466202802.db2.gz WGDLJERTFYRKJP-YOEHRIQHSA-N 1 1 330.388 2.241 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[N@@H+](CC)C2)c1 ZINC000338552982 466216280 /nfs/dbraw/zinc/21/62/80/466216280.db2.gz ZBCIRNBHOKCXAB-CYBMUJFWSA-N 1 1 335.404 2.455 20 5 EEBDMO O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000363150824 466249016 /nfs/dbraw/zinc/24/90/16/466249016.db2.gz WQQFQDMRQTYKCG-ZDUSSCGKSA-N 1 1 333.388 2.107 20 5 EEBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CNC(=O)C2)cc1[N+](=O)[O-] ZINC000331879415 466287689 /nfs/dbraw/zinc/28/76/89/466287689.db2.gz IGNQWLHVMKOKBE-UONOGXRCSA-N 1 1 333.388 2.094 20 5 EEBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)n1 ZINC000331911029 466302656 /nfs/dbraw/zinc/30/26/56/466302656.db2.gz YHQIKKQDLWDHHU-MJBXVCDLSA-N 1 1 349.435 2.289 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2C(C)(C)O)cccc1[N+](=O)[O-] ZINC000305439852 466408973 /nfs/dbraw/zinc/40/89/73/466408973.db2.gz LQMZRLJVEYDBFH-HNNXBMFYSA-N 1 1 335.404 2.467 20 5 EEBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@](O)(C(F)(F)F)C1 ZINC000354397621 466537846 /nfs/dbraw/zinc/53/78/46/466537846.db2.gz DULUMOAPRSOARR-CYBMUJFWSA-N 1 1 334.294 2.363 20 5 EEBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@](O)(C(F)(F)F)C1 ZINC000354397621 466537855 /nfs/dbraw/zinc/53/78/55/466537855.db2.gz DULUMOAPRSOARR-CYBMUJFWSA-N 1 1 334.294 2.363 20 5 EEBDMO CCN1C[C@H](C)N(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](C)C1 ZINC000410855365 466751347 /nfs/dbraw/zinc/75/13/47/466751347.db2.gz VYXDUOFIOPAEOQ-QWRGUYRKSA-N 1 1 331.376 2.026 20 5 EEBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCC(CO)CC1 ZINC000411400026 466819643 /nfs/dbraw/zinc/81/96/43/466819643.db2.gz MQIRHYMOCXKQSW-UHFFFAOYSA-N 1 1 335.404 2.406 20 5 EEBDMO CCOC(=O)c1cc(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)ccc1[N+](=O)[O-] ZINC000373676368 466884724 /nfs/dbraw/zinc/88/47/24/466884724.db2.gz WEMRIIRJPKHNKS-UONOGXRCSA-N 1 1 349.387 2.047 20 5 EEBDMO C[C@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCCOC2)O1 ZINC000373809808 466927197 /nfs/dbraw/zinc/92/71/97/466927197.db2.gz KFWNZFMELOVHLR-WMLDXEAASA-N 1 1 336.388 2.244 20 5 EEBDMO C[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCCOC2)O1 ZINC000373809808 466927200 /nfs/dbraw/zinc/92/72/00/466927200.db2.gz KFWNZFMELOVHLR-WMLDXEAASA-N 1 1 336.388 2.244 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+]C[C@@H]1c1ccncc1 ZINC000423963583 466930740 /nfs/dbraw/zinc/93/07/40/466930740.db2.gz GFEIWZNGEZKEDH-OAHLLOKOSA-N 1 1 346.774 2.430 20 5 EEBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000411966420 466950318 /nfs/dbraw/zinc/95/03/18/466950318.db2.gz LKNAGUIVFWTOKI-GOSISDBHSA-N 1 1 343.358 2.363 20 5 EEBDMO C[C@H]1[C@H](CO)CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000412088435 467002504 /nfs/dbraw/zinc/00/25/04/467002504.db2.gz PLEMMTLTMHCIFJ-AAEUAGOBSA-N 1 1 332.360 2.238 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000427408729 467155891 /nfs/dbraw/zinc/15/58/91/467155891.db2.gz WKOCSXOZMNELKB-CQSZACIVSA-N 1 1 331.376 2.931 20 5 EEBDMO COCCCC[N@@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000419377890 467194631 /nfs/dbraw/zinc/19/46/31/467194631.db2.gz BVUSHEZJLDYWLE-GFCCVEGCSA-N 1 1 339.392 2.289 20 5 EEBDMO CC[N@@H+]1CCO[C@@H](C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000452851716 467431247 /nfs/dbraw/zinc/43/12/47/467431247.db2.gz MYKDCOALCAESJF-NVXWUHKLSA-N 1 1 347.415 2.022 20 5 EEBDMO CC[N@H+]1CCO[C@@H](C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000452851716 467431252 /nfs/dbraw/zinc/43/12/52/467431252.db2.gz 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ZINC000430958824 314599696 /nfs/dbraw/zinc/59/96/96/314599696.db2.gz UOBUXOZMLRTBLQ-OLZOCXBDSA-N 1 1 334.420 2.289 20 5 EEBDMO C[N@H+](Cc1cccc(O)c1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000541348388 318097260 /nfs/dbraw/zinc/09/72/60/318097260.db2.gz CUZZSCXORSYOTC-HNNXBMFYSA-N 1 1 332.356 2.172 20 5 EEBDMO CNc1cc2c(nn1)CC[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000609258038 449986191 /nfs/dbraw/zinc/98/61/91/449986191.db2.gz JDOUOQAEHMMATD-UHFFFAOYSA-N 1 1 343.387 2.254 20 5 EEBDMO CNc1cc2c(nn1)CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000609258038 449986198 /nfs/dbraw/zinc/98/61/98/449986198.db2.gz JDOUOQAEHMMATD-UHFFFAOYSA-N 1 1 343.387 2.254 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000192818054 465003595 /nfs/dbraw/zinc/00/35/95/465003595.db2.gz TVAKKWQLRKPXFL-VXGBXAGGSA-N 1 1 327.812 2.135 20 5 EEBDMO CC[C@@](C)([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])C(N)=O ZINC000336810713 465046419 /nfs/dbraw/zinc/04/64/19/465046419.db2.gz IZQROHWECROKNU-GFCCVEGCSA-N 1 1 330.182 2.101 20 5 EEBDMO Cc1c(CNC(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-] ZINC000358682605 465262044 /nfs/dbraw/zinc/26/20/44/465262044.db2.gz LSDPQWDMTFFYLJ-HOCLYGCPSA-N 1 1 332.404 2.329 20 5 EEBDMO CO[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128492958 462645096 /nfs/dbraw/zinc/64/50/96/462645096.db2.gz QNXHGWVALCQNSK-LBPRGKRZSA-N 1 1 325.340 2.173 20 5 EEBDMO C[NH+](C)CCN(c1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000063864368 462679788 /nfs/dbraw/zinc/67/97/88/462679788.db2.gz HYHOUZLFCVSXBX-UHFFFAOYSA-N 1 1 349.412 2.352 20 5 EEBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000115442293 462715247 /nfs/dbraw/zinc/71/52/47/462715247.db2.gz NRYARMOICHERSX-CYBMUJFWSA-N 1 1 334.420 2.075 20 5 EEBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)c1 ZINC000130139238 462742658 /nfs/dbraw/zinc/74/26/58/462742658.db2.gz KIDIQYPERPMKDW-UHFFFAOYSA-N 1 1 344.371 2.077 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H]([C@@H](C)O)C1 ZINC000089932618 462746464 /nfs/dbraw/zinc/74/64/64/462746464.db2.gz ZDITZVNBGYSTKY-KGLIPLIRSA-N 1 1 335.404 2.325 20 5 EEBDMO O=[N+]([O-])c1cc(C[NH2+][C@H](CO)c2ccccc2)c2c(c1)COCO2 ZINC000116345164 462756268 /nfs/dbraw/zinc/75/62/68/462756268.db2.gz IQRQRVQQOUYBKN-MRXNPFEDSA-N 1 1 330.340 2.285 20 5 EEBDMO C[N@@H+](CCCOc1ccc(F)cc1)CCn1cc([N+](=O)[O-])ccc1=O ZINC000090516931 462794878 /nfs/dbraw/zinc/79/48/78/462794878.db2.gz DQRRCTPEAZBVRL-UHFFFAOYSA-N 1 1 349.362 2.297 20 5 EEBDMO CC(C)CO[C@@H]1CC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000119901757 462939338 /nfs/dbraw/zinc/93/93/38/462939338.db2.gz WCBVKTWRTJTGQS-IAGOWNOFSA-N 1 1 347.415 2.447 20 5 EEBDMO CC(C)CO[C@@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000119901757 462939341 /nfs/dbraw/zinc/93/93/41/462939341.db2.gz WCBVKTWRTJTGQS-IAGOWNOFSA-N 1 1 347.415 2.447 20 5 EEBDMO Cc1nn(C)c(NCC2([NH+]3CCOCC3)CCCCC2)c1[N+](=O)[O-] ZINC000051232514 463026877 /nfs/dbraw/zinc/02/68/77/463026877.db2.gz VCVMQGLONLCEEU-UHFFFAOYSA-N 1 1 337.424 2.084 20 5 EEBDMO Cc1c(C[NH+]2CCC(CN3CCOCC3)CC2)cccc1[N+](=O)[O-] ZINC000051959971 463055185 /nfs/dbraw/zinc/05/51/85/463055185.db2.gz YMZIGJOODCCBOQ-UHFFFAOYSA-N 1 1 333.432 2.447 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H](C)CC[NH+]1CCOCC1 ZINC000094133946 463061667 /nfs/dbraw/zinc/06/16/67/463061667.db2.gz BOIKQGIUKNVPMQ-CQSZACIVSA-N 1 1 349.431 2.361 20 5 EEBDMO Cc1cc(N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)nc(C)[nH+]1 ZINC000052103107 463062807 /nfs/dbraw/zinc/06/28/07/463062807.db2.gz KLJPGVRYSFSSAE-UHFFFAOYSA-N 1 1 347.400 2.026 20 5 EEBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1 ZINC000590776656 468336058 /nfs/dbraw/zinc/33/60/58/468336058.db2.gz YESSFWOTJIKNHS-SLEUVZQESA-N 1 1 335.429 2.238 20 5 EEBDMO COc1cccc([C@H](C)[NH+]2CCN(c3ncc([N+](=O)[O-])cn3)CC2)c1 ZINC000095940390 463109982 /nfs/dbraw/zinc/10/99/82/463109982.db2.gz FWUXOUCTLMBDAC-ZDUSSCGKSA-N 1 1 343.387 2.277 20 5 EEBDMO Cc1c(C(=O)NC[C@H](CC(C)C)[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000026063567 463149112 /nfs/dbraw/zinc/14/91/12/463149112.db2.gz VPYSJEMXGPOMDP-HNNXBMFYSA-N 1 1 349.431 2.380 20 5 EEBDMO CC(C)[N@H+]1CCCN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000068778031 463172868 /nfs/dbraw/zinc/17/28/68/463172868.db2.gz VDTJTUFNDRCGSO-UHFFFAOYSA-N 1 1 335.404 2.306 20 5 EEBDMO CNC(=O)c1ccc(N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000080606272 463335855 /nfs/dbraw/zinc/33/58/55/463335855.db2.gz CAYFRMJGFWDAEG-CQSZACIVSA-N 1 1 346.431 2.123 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000140346067 463340447 /nfs/dbraw/zinc/34/04/47/463340447.db2.gz KHIZYZJTAAMQGS-RDTXWAMCSA-N 1 1 347.415 2.469 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000140346067 463340450 /nfs/dbraw/zinc/34/04/50/463340450.db2.gz KHIZYZJTAAMQGS-RDTXWAMCSA-N 1 1 347.415 2.469 20 5 EEBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NCCC[N@H+]1CCc2ccccc2C1 ZINC000032400699 463375083 /nfs/dbraw/zinc/37/50/83/463375083.db2.gz VUPLZRIZOWLFST-UHFFFAOYSA-N 1 1 342.399 2.112 20 5 EEBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@H]3CN3CCOCC3)nc2c1 ZINC000083213867 463540839 /nfs/dbraw/zinc/54/08/39/463540839.db2.gz IUGWUYCALPSOBZ-CQSZACIVSA-N 1 1 346.387 2.033 20 5 EEBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]3CN3CCOCC3)nc2c1 ZINC000083213867 463540842 /nfs/dbraw/zinc/54/08/42/463540842.db2.gz IUGWUYCALPSOBZ-CQSZACIVSA-N 1 1 346.387 2.033 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CC(C)(C)OC ZINC000568615784 468362730 /nfs/dbraw/zinc/36/27/30/468362730.db2.gz OFDUGGUFNOYZFO-UHFFFAOYSA-N 1 1 339.392 2.289 20 5 EEBDMO C[N@H+]1CCC[C@H](CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000108330463 463598112 /nfs/dbraw/zinc/59/81/12/463598112.db2.gz GJVTWEWNJSXRSQ-CQSZACIVSA-N 1 1 346.431 2.267 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000126130993 463607984 /nfs/dbraw/zinc/60/79/84/463607984.db2.gz DIDDDTZGESUTFI-STQMWFEESA-N 1 1 337.445 2.486 20 5 EEBDMO Cc1nn(C)c(C(=O)NCCCC[N@@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000126461722 463637942 /nfs/dbraw/zinc/63/79/42/463637942.db2.gz XZOFDXKLVSVGRK-LBPRGKRZSA-N 1 1 337.424 2.021 20 5 EEBDMO CCOCC[N@@H+]1CCN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000255423628 463725753 /nfs/dbraw/zinc/72/57/53/463725753.db2.gz ZMYHYSPMZFLZJI-CDNLZTBQSA-N 1 1 347.415 2.177 20 5 EEBDMO CCOCC[N@H+]1CCN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000255423628 463725759 /nfs/dbraw/zinc/72/57/59/463725759.db2.gz ZMYHYSPMZFLZJI-CDNLZTBQSA-N 1 1 347.415 2.177 20 5 EEBDMO CC(C)OCC[NH+]1CCN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000255561972 463733965 /nfs/dbraw/zinc/73/39/65/463733965.db2.gz ILTRTZDUIOUFAL-SREVYHEPSA-N 1 1 347.415 2.177 20 5 EEBDMO CCOc1cc(CN2CCN(c3[nH+]ccn3C)CC2)ccc1[N+](=O)[O-] ZINC000276902355 463800080 /nfs/dbraw/zinc/80/00/80/463800080.db2.gz LVDWDNGIQFZLDN-UHFFFAOYSA-N 1 1 345.403 2.049 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000287184695 463826302 /nfs/dbraw/zinc/82/63/02/463826302.db2.gz TYUJLDUJDCNBEP-ZFWWWQNUSA-N 1 1 346.431 2.404 20 5 EEBDMO C[NH2+]CCC1CCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000262018499 463927235 /nfs/dbraw/zinc/92/72/35/463927235.db2.gz WVWBPQSFPSECOL-KRWDZBQOSA-N 1 1 346.431 2.022 20 5 EEBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000178985193 464030430 /nfs/dbraw/zinc/03/04/30/464030430.db2.gz QEDGDABRXOYIEU-UHFFFAOYSA-N 1 1 341.433 2.087 20 5 EEBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000269771092 464088275 /nfs/dbraw/zinc/08/82/75/464088275.db2.gz BAFNBXHMBKCXOF-RISCZKNCSA-N 1 1 332.360 2.380 20 5 EEBDMO O=C(Cc1cccc([N+](=O)[O-])c1)NCC[N@H+]1CCc2ccccc2C1 ZINC000172745175 464137350 /nfs/dbraw/zinc/13/73/50/464137350.db2.gz ODFQPCCYZAGRBU-UHFFFAOYSA-N 1 1 339.395 2.312 20 5 EEBDMO C[C@@H]1OCC[C@@]12C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@@H](C)O2 ZINC000279837503 464153958 /nfs/dbraw/zinc/15/39/58/464153958.db2.gz RJSOVQRVBYCMBY-JKIFEVAISA-N 1 1 336.388 2.242 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+](C)C[C@@H]2CCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000270046754 464169679 /nfs/dbraw/zinc/16/96/79/464169679.db2.gz FAWCFJUOVBTGLJ-BBRMVZONSA-N 1 1 335.404 2.325 20 5 EEBDMO CSC[C@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000292276713 464182252 /nfs/dbraw/zinc/18/22/52/464182252.db2.gz BLODZKXLVMTDFR-DZGCQCFKSA-N 1 1 340.445 2.410 20 5 EEBDMO COC(=O)[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H]1C ZINC000280284486 464197012 /nfs/dbraw/zinc/19/70/12/464197012.db2.gz NQVVTCVMUVLJNX-BXKDBHETSA-N 1 1 344.314 2.437 20 5 EEBDMO COC(=O)[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H]1C ZINC000280284486 464197018 /nfs/dbraw/zinc/19/70/18/464197018.db2.gz NQVVTCVMUVLJNX-BXKDBHETSA-N 1 1 344.314 2.437 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000284855279 464367218 /nfs/dbraw/zinc/36/72/18/464367218.db2.gz RTZFPXQUQMBBED-SJORKVTESA-N 1 1 345.399 2.127 20 5 EEBDMO O=C(C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000284855279 464367225 /nfs/dbraw/zinc/36/72/25/464367225.db2.gz RTZFPXQUQMBBED-SJORKVTESA-N 1 1 345.399 2.127 20 5 EEBDMO COc1cc(C)c(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)cc1OC ZINC000174811125 464453002 /nfs/dbraw/zinc/45/30/02/464453002.db2.gz LTHIJXLPLXXYRD-UHFFFAOYSA-N 1 1 334.376 2.249 20 5 EEBDMO CCOC(=O)c1cc(N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000272138111 464493620 /nfs/dbraw/zinc/49/36/20/464493620.db2.gz ASKSJZQOHGQPCN-WBMJQRKESA-N 1 1 333.388 2.302 20 5 EEBDMO CC[C@]1(CO)CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000189665286 464537684 /nfs/dbraw/zinc/53/76/84/464537684.db2.gz MWHWCNHGHDSENB-MRXNPFEDSA-N 1 1 332.360 2.382 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]CCCn1ccnc1)c1ccc([N+](=O)[O-])cc1 ZINC000272470263 464623093 /nfs/dbraw/zinc/62/30/93/464623093.db2.gz AEEKSISXXQKUMJ-MRXNPFEDSA-N 1 1 340.387 2.294 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]CC(C)(C)CCO)c1ccc([N+](=O)[O-])cc1 ZINC000272535090 464649694 /nfs/dbraw/zinc/64/96/94/464649694.db2.gz NYEHZVJQGSGWIT-HNNXBMFYSA-N 1 1 332.404 2.416 20 5 EEBDMO O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCN(c2[nH]cc[nH+]2)CC1 ZINC000285667432 464650711 /nfs/dbraw/zinc/65/07/11/464650711.db2.gz PFNKSFCEYCQCNH-UHFFFAOYSA-N 1 1 342.281 2.058 20 5 EEBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000176000492 464678354 /nfs/dbraw/zinc/67/83/54/464678354.db2.gz GFXRAYYBBSJMBG-CYBMUJFWSA-N 1 1 334.420 2.419 20 5 EEBDMO C[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1CO ZINC000248905529 464819196 /nfs/dbraw/zinc/81/91/96/464819196.db2.gz HVDWMSZRXKFFQG-WFASDCNBSA-N 1 1 331.372 2.495 20 5 EEBDMO CC[N@H+]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000286174615 464828679 /nfs/dbraw/zinc/82/86/79/464828679.db2.gz ABZCYQFCGGTKQL-CYBMUJFWSA-N 1 1 334.420 2.263 20 5 EEBDMO Cc1[nH+]ccn1CCCN(C)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000286249697 464853125 /nfs/dbraw/zinc/85/31/25/464853125.db2.gz PDGBMVJCMWTCJO-UHFFFAOYSA-N 1 1 342.359 2.275 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC000183357203 464855724 /nfs/dbraw/zinc/85/57/24/464855724.db2.gz YYZJUNFCTHAHHA-INIZCTEOSA-N 1 1 347.346 2.049 20 5 EEBDMO COc1ccccc1O[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC000286486816 464935939 /nfs/dbraw/zinc/93/59/39/464935939.db2.gz OSVQWABJMPUVRC-CQSZACIVSA-N 1 1 346.387 2.343 20 5 EEBDMO COc1cc(C[N@@H+](C)C[C@H]2CCN(C(C)=O)C2)c([N+](=O)[O-])cc1F ZINC000184270830 464959204 /nfs/dbraw/zinc/95/92/04/464959204.db2.gz FBZIDWAIJIUWPO-GFCCVEGCSA-N 1 1 339.367 2.043 20 5 EEBDMO C[C@H](CO)[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CCCC1 ZINC000276507137 464960348 /nfs/dbraw/zinc/96/03/48/464960348.db2.gz DIRPIHDQFUDRIL-CYBMUJFWSA-N 1 1 347.415 2.109 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@H]2C)c1 ZINC000282882608 464987057 /nfs/dbraw/zinc/98/70/57/464987057.db2.gz RHIMRILIVIKAIR-DOMZBBRYSA-N 1 1 335.404 2.452 20 5 EEBDMO Cc1cc(N2CC[N@H+](C[C@@H](C)O)C[C@@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000192795711 464999037 /nfs/dbraw/zinc/99/90/37/464999037.db2.gz JYTNLKKQPJDIGY-UONOGXRCSA-N 1 1 344.415 2.343 20 5 EEBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@H](CN2CCOCC2)C1 ZINC000254991280 465021592 /nfs/dbraw/zinc/02/15/92/465021592.db2.gz GHOZQYHWDLAGPK-IMMZDGJCSA-N 1 1 331.416 2.262 20 5 EEBDMO O=[N+]([O-])c1ccccc1/C=C\CN1CC[C@H](C[NH+]2CCOCC2)C1 ZINC000254991280 465021596 /nfs/dbraw/zinc/02/15/96/465021596.db2.gz GHOZQYHWDLAGPK-IMMZDGJCSA-N 1 1 331.416 2.262 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000299106423 465606052 /nfs/dbraw/zinc/60/60/52/465606052.db2.gz VTFCIOIFHVQSDD-KBPBESRZSA-N 1 1 335.404 2.210 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 ZINC000554859252 468446412 /nfs/dbraw/zinc/44/64/12/468446412.db2.gz KFOLWBPYAANUHT-CHWSQXEVSA-N 1 1 335.408 2.045 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1[N@@H+](C)CCCC1(C)C ZINC000344628753 465733991 /nfs/dbraw/zinc/73/39/91/465733991.db2.gz ATHOGDNVOOEKDY-HNNXBMFYSA-N 1 1 335.404 2.454 20 5 EEBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccnn3CC3CC3)CC2)n1 ZINC000597118907 468449862 /nfs/dbraw/zinc/44/98/62/468449862.db2.gz NTBOHRJRINLJGR-UHFFFAOYSA-N 1 1 330.392 2.235 20 5 EEBDMO C[C@H]1C[N@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000330663963 465752540 /nfs/dbraw/zinc/75/25/40/465752540.db2.gz FNOBCJCPPZDHAJ-NSHDSACASA-N 1 1 346.412 2.494 20 5 EEBDMO C[C@H]1C[N@@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000330663963 465752547 /nfs/dbraw/zinc/75/25/47/465752547.db2.gz FNOBCJCPPZDHAJ-NSHDSACASA-N 1 1 346.412 2.494 20 5 EEBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CC[N@H+](C2CC2)C1 ZINC000338056452 465786276 /nfs/dbraw/zinc/78/62/76/465786276.db2.gz HLRJNPJDXRKSGA-AWEZNQCLSA-N 1 1 332.404 2.015 20 5 EEBDMO 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5 EEBDMO CCC[N@H+]1CC[C@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000598342568 468836861 /nfs/dbraw/zinc/83/68/61/468836861.db2.gz KZQJXNUJEWAFPT-AWEZNQCLSA-N 1 1 332.404 2.383 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C1CC1)C1(CO)CCC1 ZINC000595533016 468889948 /nfs/dbraw/zinc/88/99/48/468889948.db2.gz FAMGECAYYGJNQX-UHFFFAOYSA-N 1 1 333.388 2.221 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C1CC1)C1(CO)CCC1 ZINC000595533016 468889952 /nfs/dbraw/zinc/88/99/52/468889952.db2.gz FAMGECAYYGJNQX-UHFFFAOYSA-N 1 1 333.388 2.221 20 5 EEBDMO CC[N@H+]1CCCN(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@@H](C)C1 ZINC000595535549 468891828 /nfs/dbraw/zinc/89/18/28/468891828.db2.gz HGTSVIUDOCJANC-AWEZNQCLSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2[C@@H]3CC[C@H]2CCN(C)C3)cccc1[N+](=O)[O-] ZINC000572199704 468899450 /nfs/dbraw/zinc/89/94/50/468899450.db2.gz JNCRWSRAJDUSQD-LSDHHAIUSA-N 1 1 346.431 2.400 20 5 EEBDMO Cc1c(NC(=O)CCN2[C@@H]3CC[C@H]2CC[N@@H+](C)C3)cccc1[N+](=O)[O-] ZINC000572199704 468899454 /nfs/dbraw/zinc/89/94/54/468899454.db2.gz JNCRWSRAJDUSQD-LSDHHAIUSA-N 1 1 346.431 2.400 20 5 EEBDMO Cc1c(NC(=O)CCN2[C@@H]3CC[C@H]2CC[N@H+](C)C3)cccc1[N+](=O)[O-] ZINC000572199704 468899456 /nfs/dbraw/zinc/89/94/56/468899456.db2.gz JNCRWSRAJDUSQD-LSDHHAIUSA-N 1 1 346.431 2.400 20 5 EEBDMO CC1(C)CC[C@@H](CO)[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000598646580 468943891 /nfs/dbraw/zinc/94/38/91/468943891.db2.gz HLFXAPZRLUGMFJ-HNNXBMFYSA-N 1 1 335.404 2.406 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCCC[C@@H]1[C@H](C)CO ZINC000595674537 468949300 /nfs/dbraw/zinc/94/93/00/468949300.db2.gz LDYOUVAVFIVRNL-CZUORRHYSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@@]1(C(N)=O)CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602644074 468984205 /nfs/dbraw/zinc/98/42/05/468984205.db2.gz KHHIZERHUWVISP-CYBMUJFWSA-N 1 1 331.294 2.311 20 5 EEBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CC[N@@H+](C)C[C@@H]1Cc1ccccc1 ZINC000593505086 469008151 /nfs/dbraw/zinc/00/81/51/469008151.db2.gz TXWBEJGJAOQIRA-INIZCTEOSA-N 1 1 343.431 2.483 20 5 EEBDMO Cc1cccc(C[N@@H+]2CC[C@H](NC(=O)c3ccc([N+](=O)[O-])n3C)C2)c1 ZINC000601851569 469057499 /nfs/dbraw/zinc/05/74/99/469057499.db2.gz UFWIMNHXTYBCEB-HNNXBMFYSA-N 1 1 342.399 2.246 20 5 EEBDMO Cc1sc(S(=O)(=O)N(C)CC[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000593665172 469084218 /nfs/dbraw/zinc/08/42/18/469084218.db2.gz CAQHDWYSZYHMMG-UHFFFAOYSA-N 1 1 347.462 2.071 20 5 EEBDMO C[N@H+](CCOC(C)(C)C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000610859656 469093830 /nfs/dbraw/zinc/09/38/30/469093830.db2.gz GCQKTGCRRXHMGM-OAHLLOKOSA-N 1 1 335.404 2.447 20 5 EEBDMO C[N@@H+](CCOC(C)(C)C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000610859656 469093832 /nfs/dbraw/zinc/09/38/32/469093832.db2.gz GCQKTGCRRXHMGM-OAHLLOKOSA-N 1 1 335.404 2.447 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1C[C@@H]2COC[C@@H]2C1 ZINC000601973359 469121587 /nfs/dbraw/zinc/12/15/87/469121587.db2.gz LOJNOTQBJJSDAR-GARJFASQSA-N 1 1 339.779 2.153 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1C[C@@H]2COC[C@@H]2C1 ZINC000601973359 469121594 /nfs/dbraw/zinc/12/15/94/469121594.db2.gz LOJNOTQBJJSDAR-GARJFASQSA-N 1 1 339.779 2.153 20 5 EEBDMO C[N@H+]1CCCC[C@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000599137791 469132674 /nfs/dbraw/zinc/13/26/74/469132674.db2.gz DCOCUJKFDCJWOY-GFCCVEGCSA-N 1 1 341.433 2.142 20 5 EEBDMO CC(C)c1ccc(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-] ZINC000615204717 469180917 /nfs/dbraw/zinc/18/09/17/469180917.db2.gz AJJRYAQTKQRBRT-MLGOLLRUSA-N 1 1 335.404 2.167 20 5 EEBDMO CC(C)c1ccc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-] ZINC000615204717 469180923 /nfs/dbraw/zinc/18/09/23/469180923.db2.gz AJJRYAQTKQRBRT-MLGOLLRUSA-N 1 1 335.404 2.167 20 5 EEBDMO CC(=O)NC[C@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000599704240 469344773 /nfs/dbraw/zinc/34/47/73/469344773.db2.gz RXXBTUJTANZRTI-MRXNPFEDSA-N 1 1 335.404 2.354 20 5 EEBDMO CC(C)[C@@H]1CN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C ZINC000617101466 469593567 /nfs/dbraw/zinc/59/35/67/469593567.db2.gz BREIYMFULHQQSR-HNNXBMFYSA-N 1 1 335.404 2.138 20 5 EEBDMO C[C@@H](C(=O)N1CC[NH+](C[C@H]2CCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000617688913 469759249 /nfs/dbraw/zinc/75/92/49/469759249.db2.gz SQQXLGCDQYDKRQ-RHSMWYFYSA-N 1 1 347.415 2.022 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H](CCO)C3)n2)c1 ZINC000609204599 469902443 /nfs/dbraw/zinc/90/24/43/469902443.db2.gz YMFFCMFAWBUGAD-LBPRGKRZSA-N 1 1 332.360 2.239 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H](CCO)C3)n2)c1 ZINC000609204599 469902449 /nfs/dbraw/zinc/90/24/49/469902449.db2.gz YMFFCMFAWBUGAD-LBPRGKRZSA-N 1 1 332.360 2.239 20 5 EEBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000609383103 469923728 /nfs/dbraw/zinc/92/37/28/469923728.db2.gz JEXMCPLTJZVACC-GFCCVEGCSA-N 1 1 328.372 2.290 20 5 EEBDMO COC[C@@]1(C)CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000451203263 536824446 /nfs/dbraw/zinc/82/44/46/536824446.db2.gz PCSYHSXSDXGRAA-RDJZCZTQSA-N 1 1 333.388 2.059 20 5 EEBDMO CC[C@@H]1CCC[N@H+]1CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000727823766 576451655 /nfs/dbraw/zinc/45/16/55/576451655.db2.gz KIYFERMXSKFWCU-CXAGYDPISA-N 1 1 346.387 2.194 20 5 EEBDMO COC(=O)C[C@@H]1CCC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000771866123 577235016 /nfs/dbraw/zinc/23/50/16/577235016.db2.gz CTABXSHNNVJMAM-INIZCTEOSA-N 1 1 344.371 2.443 20 5 EEBDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776580286 577463156 /nfs/dbraw/zinc/46/31/56/577463156.db2.gz SFJJGJDLNGBKPN-WBVHZDCISA-N 1 1 349.431 2.257 20 5 EEBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H]1n1ccnc1 ZINC000776590542 577463576 /nfs/dbraw/zinc/46/35/76/577463576.db2.gz HEFKPHSKALLHOK-XYPHTWIQSA-N 1 1 330.388 2.408 20 5 EEBDMO CNc1c(C(=O)NCCn2cc[nH+]c2C(C)C)cccc1[N+](=O)[O-] ZINC000765512119 577502297 /nfs/dbraw/zinc/50/22/97/577502297.db2.gz IJNGQLFPZKNZHD-UHFFFAOYSA-N 1 1 331.376 2.386 20 5 EEBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000766145986 577513794 /nfs/dbraw/zinc/51/37/94/577513794.db2.gz DNPQUTZYDNAVHK-GFCCVEGCSA-N 1 1 328.372 2.357 20 5 EEBDMO C[C@H]1CC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1C ZINC000766372573 577518030 /nfs/dbraw/zinc/51/80/30/577518030.db2.gz CVYGCPOMWDQZCH-QWHCGFSZSA-N 1 1 346.387 2.299 20 5 EEBDMO C[C@@H]1CN(Cn2nccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC000766378518 577518204 /nfs/dbraw/zinc/51/82/04/577518204.db2.gz XJKPWFBHYRHNQI-CABCVRRESA-N 1 1 329.404 2.344 20 5 EEBDMO C[C@H]([NH2+]CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])c1cnn(C)c1 ZINC000754787538 577813058 /nfs/dbraw/zinc/81/30/58/577813058.db2.gz SQDPXOKFWMJLNO-VIFPVBQESA-N 1 1 337.767 2.271 20 5 EEBDMO Cn1ccnc1[C@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000755793359 577831614 /nfs/dbraw/zinc/83/16/14/577831614.db2.gz ZGJSIMFYVHKQBL-ZDUSSCGKSA-N 1 1 326.360 2.125 20 5 EEBDMO C[C@H]1CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[N@@H+]1C ZINC000748348939 577959848 /nfs/dbraw/zinc/95/98/48/577959848.db2.gz MILKZJGSFKCZSH-NSHDSACASA-N 1 1 346.412 2.494 20 5 EEBDMO C[C@H]1CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[N@H+]1C ZINC000748348939 577959849 /nfs/dbraw/zinc/95/98/49/577959849.db2.gz MILKZJGSFKCZSH-NSHDSACASA-N 1 1 346.412 2.494 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@H]([C@@H]4CCOC4)C3)n2)c1 ZINC000749799329 577981958 /nfs/dbraw/zinc/98/19/58/577981958.db2.gz LYGRWHNXXRHHRO-LSDHHAIUSA-N 1 1 343.387 2.169 20 5 EEBDMO C[C@H](C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741021367 578111463 /nfs/dbraw/zinc/11/14/63/578111463.db2.gz DJKBPENXHVLGLJ-FRRDWIJNSA-N 1 1 349.387 2.338 20 5 EEBDMO C[C@H](C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741021367 578111464 /nfs/dbraw/zinc/11/14/64/578111464.db2.gz DJKBPENXHVLGLJ-FRRDWIJNSA-N 1 1 349.387 2.338 20 5 EEBDMO C[C@@H](C(=O)OCc1ccc(C(N)=O)cc1[N+](=O)[O-])[NH+]1CCCCCC1 ZINC000741030468 578111735 /nfs/dbraw/zinc/11/17/35/578111735.db2.gz WKTOYJJWBCGYMV-LBPRGKRZSA-N 1 1 349.387 2.001 20 5 EEBDMO CCn1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)n1 ZINC000892079020 677978575 /nfs/dbraw/zinc/97/85/75/677978575.db2.gz WIBRWKHIZMUTLI-CQSZACIVSA-N 1 1 330.392 2.201 20 5 EEBDMO Cn1c2ccccc2c(N[C@H]2CC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1=O ZINC000892420238 679771048 /nfs/dbraw/zinc/77/10/48/679771048.db2.gz NRPMRYJPACXKRC-ZDUSSCGKSA-N 1 1 342.399 2.343 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CCCCN1CCOCC1 ZINC000892592611 681892814 /nfs/dbraw/zinc/89/28/14/681892814.db2.gz QXPWHSDGYGCCEE-UHFFFAOYSA-N 1 1 327.812 2.450 20 5 EEBDMO O=C(N[C@H]1CC[C@H]([NH2+]CCc2ccccc2F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034645982 1196467224 /nfs/dbraw/zinc/46/72/24/1196467224.db2.gz YSIVUMMCLDWSCA-KCYZZUKISA-N 1 1 349.406 2.050 20 5 EEBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC000864942132 1198010621 /nfs/dbraw/zinc/01/06/21/1198010621.db2.gz YNWCLDQQASPJKY-NSHDSACASA-N 1 1 334.351 2.234 20 5 EEBDMO C[C@H]1C[N@@H+](CCCNc2cc(F)c([N+](=O)[O-])cc2CO)CCCO1 ZINC000865730173 1198350191 /nfs/dbraw/zinc/35/01/91/1198350191.db2.gz VBHMOLOLTPYPKJ-LBPRGKRZSA-N 1 1 341.383 2.139 20 5 EEBDMO Cc1c(C[NH2+]C[C@H](C(C)C)N2CCN(C)CC2)cccc1[N+](=O)[O-] ZINC000873011234 1198473693 /nfs/dbraw/zinc/47/36/93/1198473693.db2.gz VTGGAKDGLBGYKG-GOSISDBHSA-N 1 1 334.464 2.265 20 5 EEBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000825909829 1199774506 /nfs/dbraw/zinc/77/45/06/1199774506.db2.gz JUSPVKQMEGWGRT-ZBFHGGJFSA-N 1 1 335.404 2.009 20 5 EEBDMO CCC(=O)c1ccc(N2CC[NH+](C[C@@H]3CCOC3)CC2)c([N+](=O)[O-])c1 ZINC000795105118 1200563379 /nfs/dbraw/zinc/56/33/79/1200563379.db2.gz CSDMGFCPOPFVOC-AWEZNQCLSA-N 1 1 347.415 2.346 20 5 EEBDMO COC(=O)CC[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000880041118 1201361271 /nfs/dbraw/zinc/36/12/71/1201361271.db2.gz HAAGDRHUEWVODF-XJKSGUPXSA-N 1 1 336.388 2.293 20 5 EEBDMO CN(CCOc1ccccc1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867957560 1201715019 /nfs/dbraw/zinc/71/50/19/1201715019.db2.gz QGOICYVDINSLOM-SFHVURJKSA-N 1 1 343.383 2.306 20 5 EEBDMO CCOCCC[N@H+]1CC[C@@H](NCc2cccnc2[N+](=O)[O-])[C@H](C)C1 ZINC000886140955 1202476796 /nfs/dbraw/zinc/47/67/96/1202476796.db2.gz SWOHRHJOQGRRGU-GDBMZVCRSA-N 1 1 336.436 2.216 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@@H]4[C@H](O)CC[C@@H]4C3)co2)cc1 ZINC000886575280 1202525835 /nfs/dbraw/zinc/52/58/35/1202525835.db2.gz NDRJKEKROGIXGQ-UHOFOFEASA-N 1 1 329.356 2.453 20 5 EEBDMO COCCC[N@H+](CCO)Cc1cc([N+](=O)[O-])ccc1Br ZINC000930250668 1206544277 /nfs/dbraw/zinc/54/42/77/1206544277.db2.gz QDMISEZEPDXNNX-UHFFFAOYSA-N 1 1 347.209 2.188 20 5 EEBDMO COCCC[N@@H+](CCO)Cc1cc([N+](=O)[O-])ccc1Br ZINC000930250668 1206544278 /nfs/dbraw/zinc/54/42/78/1206544278.db2.gz QDMISEZEPDXNNX-UHFFFAOYSA-N 1 1 347.209 2.188 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCc2c(=O)[nH]n(C)c2C1 ZINC000931200288 1206614942 /nfs/dbraw/zinc/61/49/42/1206614942.db2.gz OOYMQEVGYWCTBW-UHFFFAOYSA-N 1 1 346.387 2.379 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCc2c(=O)[nH]n(C)c2C1 ZINC000931200288 1206614944 /nfs/dbraw/zinc/61/49/44/1206614944.db2.gz OOYMQEVGYWCTBW-UHFFFAOYSA-N 1 1 346.387 2.379 20 5 EEBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000931718491 1207447962 /nfs/dbraw/zinc/44/79/62/1207447962.db2.gz SVGBOVFFHFBPKS-QWHCGFSZSA-N 1 1 343.387 2.313 20 5 EEBDMO CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1C[NH+](CC2CCC3(CC3)CC2)C1 ZINC000950056135 1210001582 /nfs/dbraw/zinc/00/15/82/1210001582.db2.gz UIQIRLHFGAGAGF-HZPDHXFCSA-N 1 1 335.448 2.155 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1O[C@@H]1CCc2[nH+]ccn2C1 ZINC001229959219 1302996953 /nfs/dbraw/zinc/99/69/53/1302996953.db2.gz BFHOIZWYAWNHCF-LLVKDONJSA-N 1 1 331.328 2.280 20 5 EEBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000825550036 1292705423 /nfs/dbraw/zinc/70/54/23/1292705423.db2.gz XWVFPCXDTRLSNV-DLBZAZTESA-N 1 1 349.431 2.399 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)N(C)CCNc1ccc([N+](=O)[O-])cc1F ZINC001101712978 1299743177 /nfs/dbraw/zinc/74/31/77/1299743177.db2.gz VVRKZCHNJBWPRJ-UHFFFAOYSA-N 1 1 340.399 2.336 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N1C[C@H]2CC[C@@H](C1)N2c1ccc([N+](=O)[O-])cc1 ZINC001102200132 1300552499 /nfs/dbraw/zinc/55/24/99/1300552499.db2.gz XTKHWMOHKQCVRN-CALCHBBNSA-N 1 1 346.431 2.116 20 5 EEBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2OCC(=O)OCc1ccc([N+](=O)[O-])cc1 ZINC001224990185 1300814120 /nfs/dbraw/zinc/81/41/20/1300814120.db2.gz VMODZVTUDHNECT-JLVBRIDZSA-N 1 1 348.399 2.385 20 5 EEBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cc(F)ccc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001225576639 1301071668 /nfs/dbraw/zinc/07/16/68/1301071668.db2.gz BIXVSVHYQOXCRG-CAVOSLQRSA-N 1 1 338.335 2.280 20 5 EEBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cccc([N+](=O)[O-])c3C)C[C@H]1[N@H+]2C ZINC001225690174 1301125389 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LYEJXJXOKDKVGH-UHFFFAOYSA-N 1 1 336.436 2.431 20 5 EEBDMO CN1CC[NH+](Cc2cccc(Nc3ccc([N+](=O)[O-])nc3)c2)CC1 ZINC001203575977 1321915337 /nfs/dbraw/zinc/91/53/37/1321915337.db2.gz MWUMGGMAXOWWDX-UHFFFAOYSA-N 1 1 327.388 2.481 20 5 EEBDMO COC(=O)CC(C)(C)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001321371146 1333087447 /nfs/dbraw/zinc/08/74/47/1333087447.db2.gz HEEZZWVSOPRRHO-UHFFFAOYSA-N 1 1 337.376 2.197 20 5 EEBDMO O=C(NCC[NH+]1CC=CC1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC001324403804 1333675630 /nfs/dbraw/zinc/67/56/30/1333675630.db2.gz HKVWHRDAOATJDA-UHFFFAOYSA-N 1 1 329.278 2.215 20 5 EEBDMO COC(=O)C1=C(C)O[C@H](C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001325007764 1333806579 /nfs/dbraw/zinc/80/65/79/1333806579.db2.gz WRXWEBKUZRHRPX-HNNXBMFYSA-N 1 1 332.356 2.189 20 5 EEBDMO COC(=O)C1=C(C)O[C@H](C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001325007764 1333806583 /nfs/dbraw/zinc/80/65/83/1333806583.db2.gz WRXWEBKUZRHRPX-HNNXBMFYSA-N 1 1 332.356 2.189 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H]1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC001333734594 1336118605 /nfs/dbraw/zinc/11/86/05/1336118605.db2.gz QFIAHZNZNHOLPQ-INIZCTEOSA-N 1 1 346.431 2.116 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](Nc2ccc(-c3nn[nH]n3)c([N+](=O)[O-])c2)C1 ZINC001589134627 1348964565 /nfs/dbraw/zinc/96/45/65/1348964565.db2.gz FUYPIODKRUGORR-NSHDSACASA-N 1 1 331.380 2.060 20 5 EEBDMO CC1(C)C[N@@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])CCS1 ZINC001590104472 1349157188 /nfs/dbraw/zinc/15/71/88/1349157188.db2.gz NGLRLIVQXVNCGP-UHFFFAOYSA-N 1 1 334.405 2.102 20 5 EEBDMO CC[C@@H](C)[N@@H+](C)CCNc1cc(C)c([N+](=O)[O-])c(-c2nn[nH]n2)c1 ZINC001590410152 1349311031 /nfs/dbraw/zinc/31/10/31/1349311031.db2.gz NYXLFRMCNXEXLN-LLVKDONJSA-N 1 1 333.396 2.226 20 5 EEBDMO CCC[N@H+]1CC[C@H](CNc2cc(C)c([N+](=O)[O-])c(-c3nn[nH]n3)c2)C1 ZINC001604220674 1350896295 /nfs/dbraw/zinc/89/62/95/1350896295.db2.gz OLWUJAIWGHKMBL-GFCCVEGCSA-N 1 1 345.407 2.227 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC001607083803 1351410909 /nfs/dbraw/zinc/41/09/09/1351410909.db2.gz NOKUQTTVLYDMSC-LLVKDONJSA-N 1 1 340.343 2.357 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](N2CCOC2=O)C1 ZINC000852434527 1369271428 /nfs/dbraw/zinc/27/14/28/1369271428.db2.gz ZFQMHLAQNRLDRX-CQSZACIVSA-N 1 1 335.360 2.020 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](N2CCOC2=O)C1 ZINC000852434527 1369271436 /nfs/dbraw/zinc/27/14/36/1369271436.db2.gz ZFQMHLAQNRLDRX-CQSZACIVSA-N 1 1 335.360 2.020 20 5 EEBDMO COc1ccc(C(=O)N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-] ZINC000286316208 1369749148 /nfs/dbraw/zinc/74/91/48/1369749148.db2.gz UJOAKWSLJWGSJS-PBWFPOADSA-N 1 1 333.388 2.301 20 5 EEBDMO C[C@@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000888091502 1371273988 /nfs/dbraw/zinc/27/39/88/1371273988.db2.gz JVFVLWFLNQALDD-YOEHRIQHSA-N 1 1 332.356 2.172 20 5 EEBDMO C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cc(Cl)ccc1F ZINC001751975854 1406157104 /nfs/dbraw/zinc/15/71/04/1406157104.db2.gz XLANQGCKGIDLBL-TZMCWYRMSA-N 1 1 343.786 2.082 20 5 EEBDMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1cccc([N+](=O)[O-])n1)CC2 ZINC001164650021 719308281 /nfs/dbraw/zinc/30/82/81/719308281.db2.gz YURGJNPTODOQTE-UHFFFAOYSA-N 1 1 344.419 2.392 20 5 EEBDMO COc1nc(SC)nc(NCc2ccc(N)[nH+]c2C)c1[N+](=O)[O-] ZINC001167785427 770122566 /nfs/dbraw/zinc/12/25/66/770122566.db2.gz QYOAWHZTUALKDP-UHFFFAOYSA-N 1 1 336.377 2.013 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NC[C@H]1C[C@@H](Nc2ncccc2[N+](=O)[O-])C1 ZINC001091380359 790512689 /nfs/dbraw/zinc/51/26/89/790512689.db2.gz PSQQAQUHJAYIOQ-BETUJISGSA-N 1 1 349.435 2.027 20 5 EEBDMO C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1Cl)[C@H]1C[N@H+](C)CCO1 ZINC000809914048 783465343 /nfs/dbraw/zinc/46/53/43/783465343.db2.gz FVTMGWJIIICAMR-JOYOIKCWSA-N 1 1 342.783 2.089 20 5 EEBDMO C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1Cl)[C@H]1C[N@@H+](C)CCO1 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KSPFBPSZSCRPBX-UHFFFAOYSA-N 1 1 331.376 2.172 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@H]1[C@H]1CCCO1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000284855266 464366131 /nfs/dbraw/zinc/36/61/31/464366131.db2.gz RTZFPXQUQMBBED-DLBZAZTESA-N 1 1 345.399 2.127 20 5 EEBDMO O=C(C[N@H+]1CCC[C@H]1[C@H]1CCCO1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000284855266 464366135 /nfs/dbraw/zinc/36/61/35/464366135.db2.gz RTZFPXQUQMBBED-DLBZAZTESA-N 1 1 345.399 2.127 20 5 EEBDMO O=C(C[N@H+]1CCC[C@H](CO)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000293191490 464391922 /nfs/dbraw/zinc/39/19/22/464391922.db2.gz QHBOPICJAMJBKK-NSHDSACASA-N 1 1 341.795 2.281 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@H](CO)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000293191490 464391927 /nfs/dbraw/zinc/39/19/27/464391927.db2.gz QHBOPICJAMJBKK-NSHDSACASA-N 1 1 341.795 2.281 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(n2ccnc2)CC1 ZINC000264616312 464395227 /nfs/dbraw/zinc/39/52/27/464395227.db2.gz LUBDDEXNRROETO-ZDUSSCGKSA-N 1 1 343.387 2.455 20 5 EEBDMO CC(C)[C@H](CO)[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1 ZINC000174865872 464461171 /nfs/dbraw/zinc/46/11/71/464461171.db2.gz YWFOYYXCYIPZIK-KRWDZBQOSA-N 1 1 332.404 2.310 20 5 EEBDMO COC(=O)c1cnc(NC[C@H]2CC[N@@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000189349694 464482139 /nfs/dbraw/zinc/48/21/39/464482139.db2.gz NNMWYQAXZROAQT-GFCCVEGCSA-N 1 1 336.392 2.166 20 5 EEBDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000285191445 464482756 /nfs/dbraw/zinc/48/27/56/464482756.db2.gz SBMIHVUGXYQRDX-UHFFFAOYSA-N 1 1 331.376 2.088 20 5 EEBDMO CC(C)[N@@H+](C)CCCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000294474474 464510980 /nfs/dbraw/zinc/51/09/80/464510980.db2.gz MIHRDVCGVGYOCZ-UHFFFAOYSA-N 1 1 335.404 2.404 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(C(=O)NCc3cccc([N+](=O)[O-])c3)CC[C@H]21 ZINC000246749837 464618032 /nfs/dbraw/zinc/61/80/32/464618032.db2.gz HEKSCLLJTOGNGW-GOEBONIOSA-N 1 1 332.404 2.221 20 5 EEBDMO CC[C@@H](CCO)C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272484975 464627434 /nfs/dbraw/zinc/62/74/34/464627434.db2.gz CTZYRNMLJHQWRI-BBRMVZONSA-N 1 1 332.404 2.416 20 5 EEBDMO C[C@@H](CO)CCC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272497426 464633727 /nfs/dbraw/zinc/63/37/27/464633727.db2.gz GDUVCWLYYNIQRF-CJNGLKHVSA-N 1 1 332.404 2.416 20 5 EEBDMO Cc1c(C[N@H+]2CC[C@H]3[C@@H](C2)NC(=O)N3C(C)C)cccc1[N+](=O)[O-] ZINC000286082589 464797828 /nfs/dbraw/zinc/79/78/28/464797828.db2.gz UVPPVXOHCSOXLL-ZBFHGGJFSA-N 1 1 332.404 2.280 20 5 EEBDMO Cc1c(C[N@@H+]2CC[C@H]3[C@@H](C2)NC(=O)N3C(C)C)cccc1[N+](=O)[O-] ZINC000286082589 464797835 /nfs/dbraw/zinc/79/78/35/464797835.db2.gz UVPPVXOHCSOXLL-ZBFHGGJFSA-N 1 1 332.404 2.280 20 5 EEBDMO C[C@@H]1CSCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000249028703 464830765 /nfs/dbraw/zinc/83/07/65/464830765.db2.gz LTZCIUQGVYCFRP-QWHCGFSZSA-N 1 1 326.418 2.019 20 5 EEBDMO Cc1cc(OCC(=O)N2CC[N@H+](C3CC3)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000295458679 464844736 /nfs/dbraw/zinc/84/47/36/464844736.db2.gz XEUKSEGJHCYKFT-ZDUSSCGKSA-N 1 1 347.415 2.225 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000276258349 464867364 /nfs/dbraw/zinc/86/73/64/464867364.db2.gz ARUFRDFXKZWKKZ-VXGBXAGGSA-N 1 1 327.812 2.135 20 5 EEBDMO C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCS1 ZINC000192189102 464882184 /nfs/dbraw/zinc/88/21/84/464882184.db2.gz SIKYZTXDEYPARA-OCCSQVGLSA-N 1 1 326.418 2.162 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](O)CC(C)(C)C1 ZINC000295593353 464894978 /nfs/dbraw/zinc/89/49/78/464894978.db2.gz WTYVBQBREQVPLV-WFASDCNBSA-N 1 1 335.404 2.405 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](O)CC(C)(C)C1 ZINC000295593345 464895442 /nfs/dbraw/zinc/89/54/42/464895442.db2.gz WTYVBQBREQVPLV-IUODEOHRSA-N 1 1 335.404 2.405 20 5 EEBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(C4OCCO4)CC3)nc2c1 ZINC000177037665 464912743 /nfs/dbraw/zinc/91/27/43/464912743.db2.gz ZKANKJZWGJQMPK-UHFFFAOYSA-N 1 1 333.344 2.321 20 5 EEBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+]2CCC[C@H]2C1 ZINC000249820779 464918498 /nfs/dbraw/zinc/91/84/98/464918498.db2.gz GLVVZGMZCFPOIU-JSGCOSHPSA-N 1 1 335.429 2.382 20 5 EEBDMO CC[C@H](CO)[N@@H+](C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000295684623 464928166 /nfs/dbraw/zinc/92/81/66/464928166.db2.gz KUJUUSQOWBCCOW-SNVBAGLBSA-N 1 1 334.319 2.408 20 5 EEBDMO C[C@@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1 ZINC000295812768 464973185 /nfs/dbraw/zinc/97/31/85/464973185.db2.gz ULEBSINETGEUBC-CYBMUJFWSA-N 1 1 345.399 2.324 20 5 EEBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000295871793 464992643 /nfs/dbraw/zinc/99/26/43/464992643.db2.gz YWJIYFCPOFNIMP-UHFFFAOYSA-N 1 1 325.409 2.395 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000282925264 465004294 /nfs/dbraw/zinc/00/42/94/465004294.db2.gz WROVMWGMCRZXMT-SWLSCSKDSA-N 1 1 335.404 2.406 20 5 EEBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342919702 465389160 /nfs/dbraw/zinc/38/91/60/465389160.db2.gz IYQCHNZCTIUWQO-GFCCVEGCSA-N 1 1 330.388 2.490 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@H+](C)CC[C@H]2C)c1 ZINC000344776558 465789983 /nfs/dbraw/zinc/78/99/83/465789983.db2.gz SELATYBRUZYTMM-CQSZACIVSA-N 1 1 335.404 2.225 20 5 EEBDMO Cc1ccc(S(=O)(=O)N[C@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000331063936 465919477 /nfs/dbraw/zinc/91/94/77/465919477.db2.gz WLMJCVVZAATCOG-ZDUSSCGKSA-N 1 1 341.433 2.054 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C1 ZINC000301509150 465975643 /nfs/dbraw/zinc/97/56/43/465975643.db2.gz CNARTOKGYIYTAB-NSHDSACASA-N 1 1 331.376 2.022 20 5 EEBDMO CNc1c(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000346216389 466000193 /nfs/dbraw/zinc/00/01/93/466000193.db2.gz INJDWGMKRACHCX-HEHGZKQESA-N 1 1 346.431 2.439 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C[N@H+]1C1CC1 ZINC000331371064 466052537 /nfs/dbraw/zinc/05/25/37/466052537.db2.gz DNLLKHPJYNMCMS-ZJUUUORDSA-N 1 1 339.342 2.157 20 5 EEBDMO CC1(C)CN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC[N@H+]1CCO ZINC000302529491 466151478 /nfs/dbraw/zinc/15/14/78/466151478.db2.gz KVRVWQJEUZKPOT-UHFFFAOYSA-N 1 1 345.346 2.089 20 5 EEBDMO Cc1cc(N2CC[N@H+](CCO)C(C)(C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302557807 466153821 /nfs/dbraw/zinc/15/38/21/466153821.db2.gz SLWBANLEUZCVSD-UHFFFAOYSA-N 1 1 344.415 2.344 20 5 EEBDMO Cc1cc(N2CC[N@@H+](CCO)C(C)(C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302557807 466153831 /nfs/dbraw/zinc/15/38/31/466153831.db2.gz SLWBANLEUZCVSD-UHFFFAOYSA-N 1 1 344.415 2.344 20 5 EEBDMO CC(C)[N@@H+](C)C[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000349783468 466238839 /nfs/dbraw/zinc/23/88/39/466238839.db2.gz LZVKBGJZGXILFP-JTQLQIEISA-N 1 1 349.840 2.255 20 5 EEBDMO COc1ccncc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000347003035 466308723 /nfs/dbraw/zinc/30/87/23/466308723.db2.gz XHKJAPBIKRADID-CYBMUJFWSA-N 1 1 329.360 2.080 20 5 EEBDMO COc1ccncc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000347003035 466308725 /nfs/dbraw/zinc/30/87/25/466308725.db2.gz XHKJAPBIKRADID-CYBMUJFWSA-N 1 1 329.360 2.080 20 5 EEBDMO C[C@@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]1CO ZINC000305203683 466376715 /nfs/dbraw/zinc/37/67/15/466376715.db2.gz WYFQYXMRKRKPHY-RISCZKNCSA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]1CO ZINC000305203683 466376720 /nfs/dbraw/zinc/37/67/20/466376720.db2.gz WYFQYXMRKRKPHY-RISCZKNCSA-N 1 1 332.360 2.238 20 5 EEBDMO CC[C@@]1(C)COCC[N@@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000340869975 466399017 /nfs/dbraw/zinc/39/90/17/466399017.db2.gz AOFGFNMFVLAMHR-KRWDZBQOSA-N 1 1 349.387 2.394 20 5 EEBDMO CC[C@@]1(C)COCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000340869975 466399021 /nfs/dbraw/zinc/39/90/21/466399021.db2.gz AOFGFNMFVLAMHR-KRWDZBQOSA-N 1 1 349.387 2.394 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](C)[C@H]1CO ZINC000305457663 466410843 /nfs/dbraw/zinc/41/08/43/466410843.db2.gz ULTONUJWAOTMQA-CZUORRHYSA-N 1 1 335.404 2.325 20 5 EEBDMO COC(=O)[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1C ZINC000347148129 466430016 /nfs/dbraw/zinc/43/00/16/466430016.db2.gz ZEZGOIUVIIRVOG-GWCFXTLKSA-N 1 1 346.343 2.028 20 5 EEBDMO COC(=O)[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1C ZINC000347148129 466430023 /nfs/dbraw/zinc/43/00/23/466430023.db2.gz ZEZGOIUVIIRVOG-GWCFXTLKSA-N 1 1 346.343 2.028 20 5 EEBDMO COc1c(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)cccc1[N+](=O)[O-] ZINC000332229949 466458648 /nfs/dbraw/zinc/45/86/48/466458648.db2.gz PSSYHEOBRIUVQJ-TZMCWYRMSA-N 1 1 333.388 2.160 20 5 EEBDMO Cc1[nH+]ccn1CCCCNc1ncnc2cccc([N+](=O)[O-])c21 ZINC000347410390 466618835 /nfs/dbraw/zinc/61/88/35/466618835.db2.gz GMQCSUDKZBZBLS-UHFFFAOYSA-N 1 1 326.360 2.935 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[C@@H](C[NH+]3CCCCC3)C2)c1[N+](=O)[O-] ZINC000365509524 466841740 /nfs/dbraw/zinc/84/17/40/466841740.db2.gz DFOUFCFTHVSUBJ-ZDUSSCGKSA-N 1 1 349.435 2.218 20 5 EEBDMO O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H]1CCCC[C@@H]1[NH+]1CCOCC1 ZINC000370570057 466926537 /nfs/dbraw/zinc/92/65/37/466926537.db2.gz RLZDXAWNTDJDPG-HOTGVXAUSA-N 1 1 348.403 2.360 20 5 EEBDMO O=C(C[N@H+]1CC[C@](O)(C2CC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000365837378 466957993 /nfs/dbraw/zinc/95/79/93/466957993.db2.gz KTVLLQXKNUWFKY-OAHLLOKOSA-N 1 1 339.779 2.034 20 5 EEBDMO O=C(C[N@@H+]1CC[C@](O)(C2CC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000365837378 466957997 /nfs/dbraw/zinc/95/79/97/466957997.db2.gz KTVLLQXKNUWFKY-OAHLLOKOSA-N 1 1 339.779 2.034 20 5 EEBDMO C[C@H]1[C@H](CO)CCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000412088484 467002470 /nfs/dbraw/zinc/00/24/70/467002470.db2.gz PMKHKXAAWSEBSU-AAEUAGOBSA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@H]1[C@H](CO)CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000412088484 467002476 /nfs/dbraw/zinc/00/24/76/467002476.db2.gz PMKHKXAAWSEBSU-AAEUAGOBSA-N 1 1 332.360 2.238 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413174915 467184070 /nfs/dbraw/zinc/18/40/70/467184070.db2.gz UEKUBRPCWTZCLF-VVLHAWIVSA-N 1 1 329.400 2.441 20 5 EEBDMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000419344885 467191831 /nfs/dbraw/zinc/19/18/31/467191831.db2.gz SMPRDBHBHUJTQU-VXGBXAGGSA-N 1 1 327.812 2.135 20 5 EEBDMO C[N@H+]1CCO[C@@H]2CCN(c3ccc([N+](=O)[O-])c4ncccc34)C[C@H]21 ZINC000413286963 467207881 /nfs/dbraw/zinc/20/78/81/467207881.db2.gz FBQMJQGUXWEMHS-HZPDHXFCSA-N 1 1 328.372 2.052 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451430554 467256555 /nfs/dbraw/zinc/25/65/55/467256555.db2.gz XZFPTTFOROLVJZ-IIAWOOMASA-N 1 1 347.415 2.467 20 5 EEBDMO CC(C)[N@H+](C)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000451847169 467272069 /nfs/dbraw/zinc/27/20/69/467272069.db2.gz SLTTYKSJYVCPFH-ZDUSSCGKSA-N 1 1 345.403 2.239 20 5 EEBDMO CC[C@H](NC(=O)CCCN1CCC([NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000433145265 467298665 /nfs/dbraw/zinc/29/86/65/467298665.db2.gz GLLVRHMMQPGPKC-KRWDZBQOSA-N 1 1 348.447 2.365 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[NH2+][C@H](c1cccs1)C1(CO)CCC1 ZINC000452063793 467313367 /nfs/dbraw/zinc/31/33/67/467313367.db2.gz YBVNNMQYUGAOMT-CYBMUJFWSA-N 1 1 336.417 2.383 20 5 EEBDMO CN(C(=O)CCc1cccc([N+](=O)[O-])c1)C(C)(C)C[NH+]1CCOCC1 ZINC000414038734 467366310 /nfs/dbraw/zinc/36/63/10/467366310.db2.gz IEQGWCKSSIZLQK-UHFFFAOYSA-N 1 1 349.431 2.097 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H]1[C@@H](C)CCN[C@H]1C ZINC000420380216 467386751 /nfs/dbraw/zinc/38/67/51/467386751.db2.gz YFISKGNJRAODNO-GDZNZVCISA-N 1 1 334.420 2.208 20 5 EEBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCN1CCOC(C)(C)C1 ZINC000434694874 467419089 /nfs/dbraw/zinc/41/90/89/467419089.db2.gz NXORXMCTKYPYRP-UHFFFAOYSA-N 1 1 337.420 2.016 20 5 EEBDMO CN(CC[NH+]1CCCC1)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000448903999 467605044 /nfs/dbraw/zinc/60/50/44/467605044.db2.gz LRLACHOTNYTWMQ-UHFFFAOYSA-N 1 1 343.387 2.153 20 5 EEBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000450542499 467866710 /nfs/dbraw/zinc/86/67/10/467866710.db2.gz UMJXZZJAHJTTOA-VXGBXAGGSA-N 1 1 343.387 2.150 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000450542499 467866714 /nfs/dbraw/zinc/86/67/14/467866714.db2.gz UMJXZZJAHJTTOA-VXGBXAGGSA-N 1 1 343.387 2.150 20 5 EEBDMO Cc1cccc(NCCNc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])[nH+]1 ZINC000530702421 468002883 /nfs/dbraw/zinc/00/28/83/468002883.db2.gz CRLUMGVCMOFSEK-UHFFFAOYSA-N 1 1 340.343 2.471 20 5 EEBDMO COc1ccc(CC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000531726242 468071837 /nfs/dbraw/zinc/07/18/37/468071837.db2.gz SKBNJXMZGGFXQP-CABCVRRESA-N 1 1 347.415 2.089 20 5 EEBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(c2nc3sccn3c2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488752886 468102342 /nfs/dbraw/zinc/10/23/42/468102342.db2.gz YPCBXIFATSSGSG-TUAOUCFPSA-N 1 1 335.433 2.471 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CC(C)(C)OC ZINC000533024219 468163130 /nfs/dbraw/zinc/16/31/30/468163130.db2.gz FINBJQINXVRQCS-UHFFFAOYSA-N 1 1 339.392 2.289 20 5 EEBDMO CNc1ccc(C(=O)N(C)CCCn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000533341511 468193073 /nfs/dbraw/zinc/19/30/73/468193073.db2.gz UHTMZWNTEFDSPL-UHFFFAOYSA-N 1 1 331.376 2.304 20 5 EEBDMO CC(C)[C@@H](CNC(=O)/C=C\c1cccc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000490607439 468225087 /nfs/dbraw/zinc/22/50/87/468225087.db2.gz SHSLBEYIKVQGCH-JTGQJZMRSA-N 1 1 347.415 2.081 20 5 EEBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc([N+](=O)[O-])cn2C)c1 ZINC000520109622 468230054 /nfs/dbraw/zinc/23/00/54/468230054.db2.gz RSMWIDUUHGUALL-UHFFFAOYSA-N 1 1 330.388 2.315 20 5 EEBDMO CCCN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](C)C1 ZINC000591926979 468573530 /nfs/dbraw/zinc/57/35/30/468573530.db2.gz NLALAMPPTLGPLL-MRXNPFEDSA-N 1 1 334.420 2.263 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H]([NH2+]C[C@@H]2COCCN2)c2ccccc2)c1 ZINC000600712310 468629199 /nfs/dbraw/zinc/62/91/99/468629199.db2.gz WUZLXYNZBDOZOW-AEFFLSMTSA-N 1 1 327.384 2.262 20 5 EEBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1n[nH]c3ccc([N+](=O)[O-])cc31)C2 ZINC000597717010 468649172 /nfs/dbraw/zinc/64/91/72/468649172.db2.gz VWDDJWHLCWHEIK-KRWDZBQOSA-N 1 1 343.387 2.029 20 5 EEBDMO C[N@@H+]1CC[C@]2(C1)CCCN(C(=O)c1[nH]nc3ccc([N+](=O)[O-])cc31)C2 ZINC000597717010 468649174 /nfs/dbraw/zinc/64/91/74/468649174.db2.gz VWDDJWHLCWHEIK-KRWDZBQOSA-N 1 1 343.387 2.029 20 5 EEBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1[nH]nc3ccc([N+](=O)[O-])cc31)C2 ZINC000597717010 468649175 /nfs/dbraw/zinc/64/91/75/468649175.db2.gz VWDDJWHLCWHEIK-KRWDZBQOSA-N 1 1 343.387 2.029 20 5 EEBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)CCNc1ccccc1[N+](=O)[O-])C2 ZINC000597716240 468649455 /nfs/dbraw/zinc/64/94/55/468649455.db2.gz PXIQNNWGTAZUBV-SFHVURJKSA-N 1 1 346.431 2.341 20 5 EEBDMO Cc1cc(S(=O)(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000594800008 468690738 /nfs/dbraw/zinc/69/07/38/468690738.db2.gz AKFKVWMSXFYNQX-GFCCVEGCSA-N 1 1 341.433 2.054 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CC[C@@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000559640831 468750584 /nfs/dbraw/zinc/75/05/84/468750584.db2.gz SBDUJMGWPNLENU-CQSZACIVSA-N 1 1 326.356 2.078 20 5 EEBDMO CNC(=O)CC1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000601124833 468752300 /nfs/dbraw/zinc/75/23/00/468752300.db2.gz UKYVUKUAFQKQSZ-UHFFFAOYSA-N 1 1 328.372 2.496 20 5 EEBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N[C@H](CCO)C3CCOCC3)c2c1 ZINC000601144592 468758921 /nfs/dbraw/zinc/75/89/21/468758921.db2.gz VHTPOXINQHBTQX-OAHLLOKOSA-N 1 1 331.372 2.154 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CN1CCC([N@H+]2CCOC[C@@H]2C)CC1 ZINC000571242555 468759189 /nfs/dbraw/zinc/75/91/89/468759189.db2.gz SZCLRXXMNYOBHT-AWEZNQCLSA-N 1 1 349.431 2.289 20 5 EEBDMO Cc1[nH+]c2c(n1CCO)CC[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])C2 ZINC000601185715 468775379 /nfs/dbraw/zinc/77/53/79/468775379.db2.gz ZLDKKBJFGIQUCR-GFCCVEGCSA-N 1 1 334.351 2.201 20 5 EEBDMO COC(=O)CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000595322111 468812244 /nfs/dbraw/zinc/81/22/44/468812244.db2.gz LJLLULDCCDEVQC-AWEZNQCLSA-N 1 1 340.351 2.278 20 5 EEBDMO COC(=O)CC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000595322111 468812247 /nfs/dbraw/zinc/81/22/47/468812247.db2.gz LJLLULDCCDEVQC-AWEZNQCLSA-N 1 1 340.351 2.278 20 5 EEBDMO CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595390995 468836762 /nfs/dbraw/zinc/83/67/62/468836762.db2.gz AXSMFSBRTAPVKQ-UHFFFAOYSA-N 1 1 338.427 2.192 20 5 EEBDMO CN(CCN(C)C1CC[NH+](C)CC1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595390995 468836763 /nfs/dbraw/zinc/83/67/63/468836763.db2.gz AXSMFSBRTAPVKQ-UHFFFAOYSA-N 1 1 338.427 2.192 20 5 EEBDMO CCOC(=O)[C@]1(C(C)C)CC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000595462722 468862542 /nfs/dbraw/zinc/86/25/42/468862542.db2.gz WTMVIJLALBNXSE-OAHLLOKOSA-N 1 1 325.365 2.302 20 5 EEBDMO COC(=O)c1ccnc(NC[C@@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-] ZINC000598622167 468936791 /nfs/dbraw/zinc/93/67/91/468936791.db2.gz MAIGCVBKFZDSQD-LBPRGKRZSA-N 1 1 336.392 2.309 20 5 EEBDMO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000593314753 468936805 /nfs/dbraw/zinc/93/68/05/468936805.db2.gz HGILOFZQGXNKCO-VBQJREDUSA-N 1 1 337.395 2.452 20 5 EEBDMO CN(C(=O)C[N@@H+]1CC(C)(C)CC[C@H]1CO)c1ccc([N+](=O)[O-])cc1 ZINC000598650539 468945755 /nfs/dbraw/zinc/94/57/55/468945755.db2.gz ZWBFNBFJINXQAB-HNNXBMFYSA-N 1 1 335.404 2.041 20 5 EEBDMO CN(C(=O)C[N@H+]1CC(C)(C)CC[C@H]1CO)c1ccc([N+](=O)[O-])cc1 ZINC000598650539 468945758 /nfs/dbraw/zinc/94/57/58/468945758.db2.gz ZWBFNBFJINXQAB-HNNXBMFYSA-N 1 1 335.404 2.041 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](CN2CCCC2=O)C1 ZINC000595831211 469032360 /nfs/dbraw/zinc/03/23/60/469032360.db2.gz YVYZRGWDZGWXIO-CYBMUJFWSA-N 1 1 333.388 2.048 20 5 EEBDMO CC[N@H+]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@H]1C ZINC000611084782 469156593 /nfs/dbraw/zinc/15/65/93/469156593.db2.gz STFDQNVVVOPUFV-GFCCVEGCSA-N 1 1 332.404 2.017 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[NH+]1CCC(n3ccnc3)CC1)OCCO2 ZINC000611266518 469214364 /nfs/dbraw/zinc/21/43/64/469214364.db2.gz ONYMVFMWKLRQCW-UHFFFAOYSA-N 1 1 344.371 2.400 20 5 EEBDMO C[C@H](C(=O)N(C)CC[N@@H+]1CCOC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000573859519 469220382 /nfs/dbraw/zinc/22/03/82/469220382.db2.gz MGNIPXBQCMMAEU-AWEZNQCLSA-N 1 1 349.431 2.268 20 5 EEBDMO C[C@H](C(=O)N(C)CC[N@H+]1CCOC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000573859519 469220384 /nfs/dbraw/zinc/22/03/84/469220384.db2.gz MGNIPXBQCMMAEU-AWEZNQCLSA-N 1 1 349.431 2.268 20 5 EEBDMO CC1(C)CN(C(=O)C2CC2)CC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000611463181 469253913 /nfs/dbraw/zinc/25/39/13/469253913.db2.gz OKAZQMAWYHEGOB-UHFFFAOYSA-N 1 1 331.416 2.470 20 5 EEBDMO CC1(C)CN(C(=O)C2CC2)CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000611463181 469253920 /nfs/dbraw/zinc/25/39/20/469253920.db2.gz OKAZQMAWYHEGOB-UHFFFAOYSA-N 1 1 331.416 2.470 20 5 EEBDMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@H]2CCN(C3CC3)C2)n1 ZINC000616008143 469352777 /nfs/dbraw/zinc/35/27/77/469352777.db2.gz PDPGZPPDZVSSBB-FVQBIDKESA-N 1 1 333.436 2.349 20 5 EEBDMO C[N@H+](Cc1ccc2c(c1)OCO2)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271561 577456181 /nfs/dbraw/zinc/45/61/81/577456181.db2.gz LXXZBVUISYVYCI-OAHLLOKOSA-N 1 1 330.340 2.489 20 5 EEBDMO CC(C)C(=O)NC[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776581049 577463089 /nfs/dbraw/zinc/46/30/89/577463089.db2.gz CZRPIZMVRCZLLY-WMLDXEAASA-N 1 1 349.431 2.112 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2[C@H](O)C(F)(F)F)cc1 ZINC000776582530 577463199 /nfs/dbraw/zinc/46/31/99/577463199.db2.gz RPVGHJDJWZEKHZ-XQQFMLRXSA-N 1 1 334.294 2.016 20 5 EEBDMO Cc1nn(C[N@H+]2CCC[C@@H]2C2CCOCC2)c2ncc([N+](=O)[O-])cc12 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CC[C@@H](O)[C@H]1CCCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000114460266 462649493 /nfs/dbraw/zinc/64/94/93/462649493.db2.gz XZKHURBPKTUUCO-HZPDHXFCSA-N 1 1 335.404 2.183 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000046954257 462725677 /nfs/dbraw/zinc/72/56/77/462725677.db2.gz HWHIWHCIVIAXEK-OLZOCXBDSA-N 1 1 335.404 2.454 20 5 EEBDMO CCOc1ccc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000046996085 462731865 /nfs/dbraw/zinc/73/18/65/462731865.db2.gz HWMFXEAWVHRPBT-ZIAGYGMSSA-N 1 1 333.388 2.350 20 5 EEBDMO O=[N+]([O-])c1ccccc1OCC[NH+]1CCC(O)(C(F)(F)F)CC1 ZINC000089971222 462758335 /nfs/dbraw/zinc/75/83/35/462758335.db2.gz IAVZOVQWXQSMJR-UHFFFAOYSA-N 1 1 334.294 2.363 20 5 EEBDMO C[NH+](C)[C@@H](CNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000008189382 462772145 /nfs/dbraw/zinc/77/21/45/462772145.db2.gz ZWWFMSUYTUMRTO-INIZCTEOSA-N 1 1 349.412 2.176 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C[C@@H]1CCOC1)C1CC1 ZINC000047405760 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RLZDXAWNTDJDPG-HZPDHXFCSA-N 1 1 348.403 2.360 20 5 EEBDMO O=[N+]([O-])c1cnc(NCC[N@H+]2CCCOCC2)c(C(F)(F)F)c1 ZINC000413252259 467197794 /nfs/dbraw/zinc/19/77/94/467197794.db2.gz WHILVRVHCVZVBO-UHFFFAOYSA-N 1 1 334.298 2.143 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(c2ccnc3c2cccc3[N+](=O)[O-])[C@@H](C)C1 ZINC000432136682 467218781 /nfs/dbraw/zinc/21/87/81/467218781.db2.gz DNMMLUKCQYUGCP-QWHCGFSZSA-N 1 1 330.388 2.034 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@@H]1C ZINC000434238052 467384331 /nfs/dbraw/zinc/38/43/31/467384331.db2.gz UPMCYVXDORODQX-RYUDHWBXSA-N 1 1 337.424 2.386 20 5 EEBDMO CC[N@@H+]1CC[C@H](N(C)C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C[C@@H]1C ZINC000434238052 467384334 /nfs/dbraw/zinc/38/43/34/467384334.db2.gz UPMCYVXDORODQX-RYUDHWBXSA-N 1 1 337.424 2.386 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C[C@@H]1C ZINC000434238052 467384339 /nfs/dbraw/zinc/38/43/39/467384339.db2.gz UPMCYVXDORODQX-RYUDHWBXSA-N 1 1 337.424 2.386 20 5 EEBDMO COC(=O)[C@H]1CN(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC[N@@H+](C)C1 ZINC000414499700 467414835 /nfs/dbraw/zinc/41/48/35/467414835.db2.gz ZMGBETCSAREONR-OAHLLOKOSA-N 1 1 349.431 2.255 20 5 EEBDMO NC(=O)c1cccc([N+](=O)[O-])c1N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000420594117 467431358 /nfs/dbraw/zinc/43/13/58/467431358.db2.gz YZAITXYDKMPKRT-AWEZNQCLSA-N 1 1 340.383 2.380 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@H](O)C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449738338 467704225 /nfs/dbraw/zinc/70/42/25/467704225.db2.gz BDRTWGIHRBYWTH-CVEARBPZSA-N 1 1 330.388 2.168 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000456357369 467710454 /nfs/dbraw/zinc/71/04/54/467710454.db2.gz SJVOQDHKHIPKHZ-NSHDSACASA-N 1 1 331.376 2.027 20 5 EEBDMO C[N@H+]1CC[C@]2(CCN(C(=O)/C=C/c3ccc(F)cc3[N+](=O)[O-])C2)C1 ZINC000492921882 467795378 /nfs/dbraw/zinc/79/53/78/467795378.db2.gz MFLSJWSUFRXHOL-RCFWFJCLSA-N 1 1 333.363 2.301 20 5 EEBDMO Cc1nc(NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000450367646 467836888 /nfs/dbraw/zinc/83/68/88/467836888.db2.gz XTNRDRGKXKCSOO-CYBMUJFWSA-N 1 1 329.404 3.016 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000458459062 467838648 /nfs/dbraw/zinc/83/86/48/467838648.db2.gz PHIQXBHPCOHWNQ-HNNXBMFYSA-N 1 1 334.420 2.261 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000458479777 467843300 /nfs/dbraw/zinc/84/33/00/467843300.db2.gz RFBGCXPGPBLUQW-HNNXBMFYSA-N 1 1 334.420 2.263 20 5 EEBDMO COC(=O)[C@@H]([NH2+]CCCNc1c(F)cccc1[N+](=O)[O-])C(C)C ZINC000450594755 467876429 /nfs/dbraw/zinc/87/64/29/467876429.db2.gz DGRIJDWKKIRCID-ZDUSSCGKSA-N 1 1 327.356 2.323 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+](CCCO)C2)cc1OC(F)F ZINC000450610737 467879112 /nfs/dbraw/zinc/87/91/12/467879112.db2.gz HECFKRPRWPPENR-LBPRGKRZSA-N 1 1 345.346 2.455 20 5 EEBDMO CC[N@@H+](CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1C)C(C)C ZINC000494381775 468050714 /nfs/dbraw/zinc/05/07/14/468050714.db2.gz AZUQWKFGNQYCJP-UHFFFAOYSA-N 1 1 343.449 2.220 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cn2C)C[N@H+]1Cc1ccccc1 ZINC000531569457 468061447 /nfs/dbraw/zinc/06/14/47/468061447.db2.gz UFSPMVKZNJBHFI-ZFWWWQNUSA-N 1 1 342.399 2.326 20 5 EEBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@@H]3OCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000519826327 468218340 /nfs/dbraw/zinc/21/83/40/468218340.db2.gz PIYCCBNIHGTLFA-OZVIIMIRSA-N 1 1 349.387 2.041 20 5 EEBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000519826327 468218344 /nfs/dbraw/zinc/21/83/44/468218344.db2.gz PIYCCBNIHGTLFA-OZVIIMIRSA-N 1 1 349.387 2.041 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])cn2C)C1 ZINC000520363416 468245481 /nfs/dbraw/zinc/24/54/81/468245481.db2.gz KUBHLCPJTPMZIJ-BETUJISGSA-N 1 1 336.436 2.420 20 5 EEBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594212104 468514608 /nfs/dbraw/zinc/51/46/08/468514608.db2.gz SLPRQSBTQPRKHW-JKSUJKDBSA-N 1 1 332.404 2.411 20 5 EEBDMO CNc1c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-] ZINC000594418835 468579458 /nfs/dbraw/zinc/57/94/58/468579458.db2.gz MFMHRGDZZQDXLU-UONOGXRCSA-N 1 1 332.404 2.383 20 5 EEBDMO COc1ccc(CC(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000597860960 468697071 /nfs/dbraw/zinc/69/70/71/468697071.db2.gz QGZSWYYNFFXYKF-CQSZACIVSA-N 1 1 349.431 2.383 20 5 EEBDMO O=C(NCc1c[nH+]c2n1CCCC2)NCc1ccc([N+](=O)[O-])cc1 ZINC000560065065 468764276 /nfs/dbraw/zinc/76/42/76/468764276.db2.gz FLLBJCHJJNOKJM-UHFFFAOYSA-N 1 1 329.360 2.127 20 5 EEBDMO C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccnc2ccc([N+](=O)[O-])cc21 ZINC000601165395 468767474 /nfs/dbraw/zinc/76/74/74/468767474.db2.gz NTFCOSPSOZYRQK-ZFWWWQNUSA-N 1 1 342.399 2.442 20 5 EEBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000560363495 468790915 /nfs/dbraw/zinc/79/09/15/468790915.db2.gz LEBCFSJNDOPCBB-GFCCVEGCSA-N 1 1 328.372 2.215 20 5 EEBDMO C[C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@@H]1CCC[NH3+] ZINC000595258523 468795300 /nfs/dbraw/zinc/79/53/00/468795300.db2.gz PHUJVTBZNXNHRM-IAQYHMDHSA-N 1 1 345.403 2.451 20 5 EEBDMO CCn1nc(C)c([N+](=O)[O-])c1N1CC[NH+](Cc2ccc(O)cc2)CC1 ZINC000601257074 468801091 /nfs/dbraw/zinc/80/10/91/468801091.db2.gz LPNALDNRVMRJDR-UHFFFAOYSA-N 1 1 345.403 2.147 20 5 EEBDMO CCC[N@H+]1CC[C@@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000598342282 468836669 /nfs/dbraw/zinc/83/66/69/468836669.db2.gz LQPKKHFOTSBISI-CYBMUJFWSA-N 1 1 330.388 2.219 20 5 EEBDMO CC[C@H]1COC(C)(C)C[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000593056352 468854916 /nfs/dbraw/zinc/85/49/16/468854916.db2.gz GWAMCILTLZJKNY-DZGCQCFKSA-N 1 1 338.404 2.224 20 5 EEBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000584386472 468857961 /nfs/dbraw/zinc/85/79/61/468857961.db2.gz GSVOFAXTNNKLKN-ZQIUZPCESA-N 1 1 346.431 2.467 20 5 EEBDMO CC[N@H+]1CCCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)[C@H](C)C1 ZINC000601439883 468874733 /nfs/dbraw/zinc/87/47/33/468874733.db2.gz XCNNRHQJKSSSAV-CYBMUJFWSA-N 1 1 341.433 2.008 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC000595504432 468879135 /nfs/dbraw/zinc/87/91/35/468879135.db2.gz JAVNYKACVFGJLJ-SFHVURJKSA-N 1 1 346.431 2.259 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C1CC1)C1(CO)CCC1 ZINC000595534935 468891727 /nfs/dbraw/zinc/89/17/27/468891727.db2.gz ZHZRTOATTKAEAR-UHFFFAOYSA-N 1 1 333.388 2.221 20 5 EEBDMO C[C@@H]1[C@H](C)N(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](C)C[N@H+]1C ZINC000593188880 468899004 /nfs/dbraw/zinc/89/90/04/468899004.db2.gz DRZWSLBRZUPQGN-AXFHLTTASA-N 1 1 331.376 2.024 20 5 EEBDMO COC(=O)c1ccnc(NC[C@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-] ZINC000598591548 468925260 /nfs/dbraw/zinc/92/52/60/468925260.db2.gz CIVVDZWJHJPQJI-GFCCVEGCSA-N 1 1 336.392 2.309 20 5 EEBDMO C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]1CCO ZINC000595701168 468960770 /nfs/dbraw/zinc/96/07/70/468960770.db2.gz QVLVPGBAMOHPJO-CZUORRHYSA-N 1 1 335.404 2.406 20 5 EEBDMO C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1CCO ZINC000595701166 468961230 /nfs/dbraw/zinc/96/12/30/468961230.db2.gz QVLVPGBAMOHPJO-BBRMVZONSA-N 1 1 335.404 2.406 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000595784847 469009065 /nfs/dbraw/zinc/00/90/65/469009065.db2.gz BXXRTSBYHSTRGP-GOEBONIOSA-N 1 1 335.404 2.038 20 5 EEBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000585718768 469021183 /nfs/dbraw/zinc/02/11/83/469021183.db2.gz XFMLMGPEOPNKFP-CQSZACIVSA-N 1 1 337.395 2.421 20 5 EEBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000585718768 469021189 /nfs/dbraw/zinc/02/11/89/469021189.db2.gz XFMLMGPEOPNKFP-CQSZACIVSA-N 1 1 337.395 2.421 20 5 EEBDMO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)c3ccc([N+](=O)[O-])[nH]3)C2)c1 ZINC000601851621 469058200 /nfs/dbraw/zinc/05/82/00/469058200.db2.gz ULZVHGCMGFEHSX-AWEZNQCLSA-N 1 1 328.372 2.236 20 5 EEBDMO C[C@@H]1CCCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1CCC[NH3+] ZINC000595904630 469073108 /nfs/dbraw/zinc/07/31/08/469073108.db2.gz JFWNBGFXHYEMLJ-UKRRQHHQSA-N 1 1 334.420 2.373 20 5 EEBDMO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCN(Cc3c(F)cccc3[N+](=O)[O-])C2)C1 ZINC000593736128 469116869 /nfs/dbraw/zinc/11/68/69/469116869.db2.gz GSZUQADLRZZGFG-XNJGSVPQSA-N 1 1 337.395 2.452 20 5 EEBDMO Cc1cc(NCCC[N@@H+]2CCC[C@H]2C(=O)N(C)C)c([N+](=O)[O-])s1 ZINC000596110812 469159608 /nfs/dbraw/zinc/15/96/08/469159608.db2.gz TWFCIOOLVAPWQV-ZDUSSCGKSA-N 1 1 340.449 2.319 20 5 EEBDMO COc1ccc(OCC[N@H+]2CC[C@@H](c3nccn3C)C2)c([N+](=O)[O-])c1 ZINC000573574032 469164334 /nfs/dbraw/zinc/16/43/34/469164334.db2.gz INNPFCLHAMHYNB-CYBMUJFWSA-N 1 1 346.387 2.205 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+](C[C@H]1CCOC1)C1CC1)OCCO2 ZINC000611254254 469210201 /nfs/dbraw/zinc/21/02/01/469210201.db2.gz GLNZBBOOWZPFGY-GFCCVEGCSA-N 1 1 334.372 2.367 20 5 EEBDMO 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341.415 2.400 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H](CCO)C2)cccc1[N+](=O)[O-] ZINC000609848416 469966165 /nfs/dbraw/zinc/96/61/65/469966165.db2.gz HQFLIOPYTACBMP-CQSZACIVSA-N 1 1 335.404 2.326 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000174962356 527836482 /nfs/dbraw/zinc/83/64/82/527836482.db2.gz YHNBRRPYGJXSSJ-AWEZNQCLSA-N 1 1 334.420 2.197 20 5 EEBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)CSc3ccc([N+](=O)[O-])cc3)[C@@H]2C1 ZINC000425047343 536487771 /nfs/dbraw/zinc/48/77/71/536487771.db2.gz MKAQXNFITHQNJJ-SWLSCSKDSA-N 1 1 335.429 2.240 20 5 EEBDMO CCOc1cc([N+](=O)[O-])c(C(=O)OCCn2cc[nH+]c2C)cc1OC ZINC000771869960 577235156 /nfs/dbraw/zinc/23/51/56/577235156.db2.gz HRTUKIAHCHDFJG-UHFFFAOYSA-N 1 1 349.343 2.364 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C[C@@H]1C ZINC000766557177 577521557 /nfs/dbraw/zinc/52/15/57/577521557.db2.gz SZLBFHAQHNSPHZ-QWHCGFSZSA-N 1 1 334.420 2.216 20 5 EEBDMO 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KCLCDZWOQMRMMJ-UHFFFAOYSA-N 1 1 327.768 2.034 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2cnn(C[NH+]3CCC4(CC3)OCCO4)c2)cc1 ZINC000103457696 683253429 /nfs/dbraw/zinc/25/34/29/683253429.db2.gz YRBRDQRNBCAOAA-UHFFFAOYSA-N 1 1 344.371 2.255 20 5 EEBDMO CC(C)c1ccc(CN2CC[C@@H](N3CC[NH2+]CC3)C2)cc1[N+](=O)[O-] ZINC000262121965 683893207 /nfs/dbraw/zinc/89/32/07/683893207.db2.gz MEKLMQWPAOFKKE-MRXNPFEDSA-N 1 1 332.448 2.198 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CNC(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000893186865 684094235 /nfs/dbraw/zinc/09/42/35/684094235.db2.gz HMZGDIODKKVVKS-KBPBESRZSA-N 1 1 334.420 2.482 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000893186868 684094364 /nfs/dbraw/zinc/09/43/64/684094364.db2.gz HMZGDIODKKVVKS-ZIAGYGMSSA-N 1 1 334.420 2.482 20 5 EEBDMO O=[N+]([O-])c1ccc(NCC[N@H+]2CCC3(C2)OCCO3)c2ccncc21 ZINC000895254852 684394560 /nfs/dbraw/zinc/39/45/60/684394560.db2.gz ZDYMZFBRIWXQLN-UHFFFAOYSA-N 1 1 344.371 2.004 20 5 EEBDMO C[C@@]1(CO)C[C@@H](O)C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000895330353 684505737 /nfs/dbraw/zinc/50/57/37/684505737.db2.gz LKEHNOQEQURIHV-PBHICJAKSA-N 1 1 332.356 2.172 20 5 EEBDMO CCOC1CC[NH+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CC1 ZINC000179242399 691063423 /nfs/dbraw/zinc/06/34/23/691063423.db2.gz IEKSVWXBJUJQRV-UHFFFAOYSA-N 1 1 348.403 2.295 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC[C@H](NC(=O)N(C)C)C1 ZINC000877574616 1199969465 /nfs/dbraw/zinc/96/94/65/1199969465.db2.gz PGGSWBHQQWDDJO-AWEZNQCLSA-N 1 1 334.420 2.447 20 5 EEBDMO C[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)CC1 ZINC000870128124 1200490246 /nfs/dbraw/zinc/49/02/46/1200490246.db2.gz NQRZHDCCJYZNFC-CQSZACIVSA-N 1 1 342.399 2.452 20 5 EEBDMO CN(C(=O)[C@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1)c1ccccc1 ZINC000886186379 1202479896 /nfs/dbraw/zinc/47/98/96/1202479896.db2.gz XCAOCTKGUXPELD-HNNXBMFYSA-N 1 1 340.383 2.475 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NC1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC001095423860 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CC[N@@H+](C)C[C@@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000072858465 159046665 /nfs/dbraw/zinc/04/66/65/159046665.db2.gz VQSFRVBPECHOOB-ZDUSSCGKSA-N 1 1 345.403 2.418 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CCCCO)C1CC1 ZINC000118844301 159368042 /nfs/dbraw/zinc/36/80/42/159368042.db2.gz GGFAVRVNFXAHSD-UHFFFAOYSA-N 1 1 335.404 2.469 20 5 EEBDMO COC(=O)c1cnc(NCCC[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000190164911 160155913 /nfs/dbraw/zinc/15/59/13/160155913.db2.gz QIKBDARGUDSHBV-LBPRGKRZSA-N 1 1 336.392 2.453 20 5 EEBDMO CCOC(=O)N1CCC[N@H+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000194856073 160201315 /nfs/dbraw/zinc/20/13/15/160201315.db2.gz YYPDEJMPSFJXRS-UHFFFAOYSA-N 1 1 337.376 2.138 20 5 EEBDMO CCOC(=O)N1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000194856073 160201316 /nfs/dbraw/zinc/20/13/16/160201316.db2.gz YYPDEJMPSFJXRS-UHFFFAOYSA-N 1 1 337.376 2.138 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000342039942 161034391 /nfs/dbraw/zinc/03/43/91/161034391.db2.gz AEUPLPIZTQXZBZ-CVEARBPZSA-N 1 1 333.388 2.485 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000342039942 161034392 /nfs/dbraw/zinc/03/43/92/161034392.db2.gz AEUPLPIZTQXZBZ-CVEARBPZSA-N 1 1 333.388 2.485 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](CO)C[C@H]1C ZINC000344132118 161200942 /nfs/dbraw/zinc/20/09/42/161200942.db2.gz OSPGPMWPLZFMIE-KGLIPLIRSA-N 1 1 335.404 2.325 20 5 EEBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2C[C@@H]3CC[C@@H](O)[C@@H]3C2)c1 ZINC000346308532 161361888 /nfs/dbraw/zinc/36/18/88/161361888.db2.gz BMBJKIWUUTVWLA-ZWKOPEQDSA-N 1 1 328.315 2.399 20 5 EEBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2C[C@@H]3CC[C@@H](O)[C@@H]3C2)c1 ZINC000346308532 161361889 /nfs/dbraw/zinc/36/18/89/161361889.db2.gz BMBJKIWUUTVWLA-ZWKOPEQDSA-N 1 1 328.315 2.399 20 5 EEBDMO [NH3+]CC[C@H]1CCCCN1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000352507472 162164192 /nfs/dbraw/zinc/16/41/92/162164192.db2.gz CQIGPSSXFSQNNT-CYBMUJFWSA-N 1 1 348.403 2.096 20 5 EEBDMO COc1c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000354981485 163040227 /nfs/dbraw/zinc/04/02/27/163040227.db2.gz OHXVIBUUCPFECT-STQMWFEESA-N 1 1 335.404 2.454 20 5 EEBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1)c1cccc([N+](=O)[O-])c1 ZINC000355303256 163137765 /nfs/dbraw/zinc/13/77/65/163137765.db2.gz GGMRJLDRTRNVGT-QGZVFWFLSA-N 1 1 341.367 2.414 20 5 EEBDMO COC(=O)COc1ccc(C[N@H+](C)Cc2ccoc2)cc1[N+](=O)[O-] ZINC000355596508 163243715 /nfs/dbraw/zinc/24/37/15/163243715.db2.gz CUYJPWVDCWTEOM-UHFFFAOYSA-N 1 1 334.328 2.372 20 5 EEBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2ccoc2)cc1[N+](=O)[O-] ZINC000355596508 163243717 /nfs/dbraw/zinc/24/37/17/163243717.db2.gz CUYJPWVDCWTEOM-UHFFFAOYSA-N 1 1 334.328 2.372 20 5 EEBDMO Cc1c(CN2CCN([C@H]3CCC[N@H+](C)C3)CC2)cccc1[N+](=O)[O-] ZINC000364547611 165180885 /nfs/dbraw/zinc/18/08/85/165180885.db2.gz RTLLHYXKCAQMDG-KRWDZBQOSA-N 1 1 332.448 2.115 20 5 EEBDMO CC(C)c1ccc(C(=O)NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)cc1[N+](=O)[O-] ZINC000364801837 165279725 /nfs/dbraw/zinc/27/97/25/165279725.db2.gz PVBUPLYGXGCTBA-LSDHHAIUSA-N 1 1 347.415 2.311 20 5 EEBDMO Cn1c(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000408449651 167794726 /nfs/dbraw/zinc/79/47/26/167794726.db2.gz ATNMYDMLSABSQI-TZMCWYRMSA-N 1 1 332.404 2.022 20 5 EEBDMO CCCC[N@H+](CC(N)=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000123006685 222199263 /nfs/dbraw/zinc/19/92/63/222199263.db2.gz FQEKBEBSQWFHAL-UHFFFAOYSA-N 1 1 344.209 2.445 20 5 EEBDMO CCCC[N@@H+](CC(N)=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000123006685 222199266 /nfs/dbraw/zinc/19/92/66/222199266.db2.gz FQEKBEBSQWFHAL-UHFFFAOYSA-N 1 1 344.209 2.445 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-] ZINC000269462309 268685226 /nfs/dbraw/zinc/68/52/26/268685226.db2.gz SKKZCSRNCVFHLM-GFCCVEGCSA-N 1 1 337.424 2.292 20 5 EEBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000277443012 269156691 /nfs/dbraw/zinc/15/66/91/269156691.db2.gz FQBGEDRPLNZUIC-CYBMUJFWSA-N 1 1 347.371 2.070 20 5 EEBDMO Cc1cc(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c(N)c([N+](=O)[O-])c1 ZINC000277530741 269160552 /nfs/dbraw/zinc/16/05/52/269160552.db2.gz MLYLAQRYOBYOER-CYBMUJFWSA-N 1 1 332.404 2.232 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](C)Cn1cc[nH+]c1C ZINC000277693897 269173364 /nfs/dbraw/zinc/17/33/64/269173364.db2.gz ZWTSYYFTMYJRKC-NSHDSACASA-N 1 1 332.360 2.174 20 5 EEBDMO CC(C)[C@@H](CNc1c2c(ccc1[N+](=O)[O-])NCC2)N1CC[NH+](C)CC1 ZINC000278500836 269234536 /nfs/dbraw/zinc/23/45/36/269234536.db2.gz XDUIMLPMSOKOFM-QGZVFWFLSA-N 1 1 347.463 2.247 20 5 EEBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](CC(N)=O)c1ccccc1 ZINC000280656280 269383023 /nfs/dbraw/zinc/38/30/23/269383023.db2.gz ZODRLKYIBKMQCB-DLBZAZTESA-N 1 1 343.383 2.177 20 5 EEBDMO CC(=O)c1cc(N2CC[N@@H+](C3CCOCC3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000287922926 275006188 /nfs/dbraw/zinc/00/61/88/275006188.db2.gz WRTPGPSSDZZFRS-CYBMUJFWSA-N 1 1 347.415 2.487 20 5 EEBDMO CCC[C@@]1(CO)CC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000288915537 275091194 /nfs/dbraw/zinc/09/11/94/275091194.db2.gz UPVWSTGSZOBKCK-CXAGYDPISA-N 1 1 335.404 2.406 20 5 EEBDMO CCC[C@@]1(CO)CC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000288915537 275091195 /nfs/dbraw/zinc/09/11/95/275091195.db2.gz UPVWSTGSZOBKCK-CXAGYDPISA-N 1 1 335.404 2.406 20 5 EEBDMO CCC[C@]1(CO)CC[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000288989244 275094448 /nfs/dbraw/zinc/09/44/48/275094448.db2.gz ZWCBLWXQEHQADD-DYVFJYSZSA-N 1 1 335.404 2.406 20 5 EEBDMO CCC[C@]1(CO)CC[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000288989244 275094449 /nfs/dbraw/zinc/09/44/49/275094449.db2.gz ZWCBLWXQEHQADD-DYVFJYSZSA-N 1 1 335.404 2.406 20 5 EEBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000291538437 275315401 /nfs/dbraw/zinc/31/54/01/275315401.db2.gz LOEDTROVYXVHGE-GFCCVEGCSA-N 1 1 341.383 2.349 20 5 EEBDMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000291790415 275340418 /nfs/dbraw/zinc/34/04/18/275340418.db2.gz GKRZAKYLLDPTSZ-SECBINFHSA-N 1 1 337.405 2.058 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](n2cccn2)C1 ZINC000291977713 275360000 /nfs/dbraw/zinc/36/00/00/275360000.db2.gz WBCGIDOMITWYBA-QWHCGFSZSA-N 1 1 329.360 2.065 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](n2cccn2)C1 ZINC000291977713 275360002 /nfs/dbraw/zinc/36/00/02/275360002.db2.gz WBCGIDOMITWYBA-QWHCGFSZSA-N 1 1 329.360 2.065 20 5 EEBDMO CC(C)[C@@](C)(O)C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353513110 280118921 /nfs/dbraw/zinc/11/89/21/280118921.db2.gz FAKFHNOMQCDSKE-WBVHZDCISA-N 1 1 332.404 2.414 20 5 EEBDMO Cc1c(NC(=O)CCN2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000293364499 293191140 /nfs/dbraw/zinc/19/11/40/293191140.db2.gz IPVCJVSFYXAIDU-BETUJISGSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@@H](C)N(C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000293364499 293191143 /nfs/dbraw/zinc/19/11/43/293191143.db2.gz IPVCJVSFYXAIDU-BETUJISGSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2C[C@@H](C)N(C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000293364499 293191146 /nfs/dbraw/zinc/19/11/46/293191146.db2.gz IPVCJVSFYXAIDU-BETUJISGSA-N 1 1 334.420 2.256 20 5 EEBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C[C@H](C)[N@@H+]1C ZINC000294087373 293367742 /nfs/dbraw/zinc/36/77/42/293367742.db2.gz XFJOKIALHDBBRF-TXEJJXNPSA-N 1 1 328.372 2.308 20 5 EEBDMO COC(=O)Cc1ccc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000296624314 294024625 /nfs/dbraw/zinc/02/46/25/294024625.db2.gz VFKCOUYUNXHBEU-CABCVRRESA-N 1 1 333.388 2.349 20 5 EEBDMO O=c1c([N+](=O)[O-])cc(Br)cn1Cc1cn2ccccc2[nH+]1 ZINC000158217904 311325866 /nfs/dbraw/zinc/32/58/66/311325866.db2.gz FLJJRFFVAPBAEM-UHFFFAOYSA-N 1 1 349.144 2.215 20 5 EEBDMO COC(=O)[C@H]1CN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC[N@@H+](C)C1 ZINC000414485341 313033683 /nfs/dbraw/zinc/03/36/83/313033683.db2.gz HXYGEDGFDMQFLE-IHWMJMDHSA-N 1 1 347.415 2.035 20 5 EEBDMO COC(=O)[C@@H]1CN(C)CC[N@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000414485341 313033687 /nfs/dbraw/zinc/03/36/87/313033687.db2.gz HXYGEDGFDMQFLE-IHWMJMDHSA-N 1 1 347.415 2.035 20 5 EEBDMO COC(=O)[C@@H]1CN(C)CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000414485341 313033693 /nfs/dbraw/zinc/03/36/93/313033693.db2.gz HXYGEDGFDMQFLE-IHWMJMDHSA-N 1 1 347.415 2.035 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H](O)[C@@H](CO)C3)o2)c1 ZINC000414559660 313041771 /nfs/dbraw/zinc/04/17/71/313041771.db2.gz PEKHBMUXXYOIIQ-CZUORRHYSA-N 1 1 332.356 2.030 20 5 EEBDMO C[C@H]1C[C@@H](CO)C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000420947136 314005492 /nfs/dbraw/zinc/00/54/92/314005492.db2.gz SXFBUUIAGWMLMX-NWDGAFQWSA-N 1 1 332.360 2.095 20 5 EEBDMO COCCOCC[N@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425461070 314398726 /nfs/dbraw/zinc/39/87/26/314398726.db2.gz UFPKEPWAJNCLIQ-UHFFFAOYSA-N 1 1 347.209 2.452 20 5 EEBDMO COCCOCC[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425461070 314398729 /nfs/dbraw/zinc/39/87/29/314398729.db2.gz UFPKEPWAJNCLIQ-UHFFFAOYSA-N 1 1 347.209 2.452 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH2+]Cc1nc(C2CC2)cs1 ZINC000579824791 323936941 /nfs/dbraw/zinc/93/69/41/323936941.db2.gz VIMCKGDMYJPWPS-GFCCVEGCSA-N 1 1 349.412 2.458 20 5 EEBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1 ZINC000580405234 324053996 /nfs/dbraw/zinc/05/39/96/324053996.db2.gz YNYZELCCDZYEKK-SMDDNHRTSA-N 1 1 335.429 2.483 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000296032838 465057488 /nfs/dbraw/zinc/05/74/88/465057488.db2.gz ZUVRIFKRBFPZEM-XJKSGUPXSA-N 1 1 347.415 2.356 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000535274825 468305490 /nfs/dbraw/zinc/30/54/90/468305490.db2.gz DMISSCRGHOOKIQ-CYBMUJFWSA-N 1 1 343.387 2.358 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000535274825 468305496 /nfs/dbraw/zinc/30/54/96/468305496.db2.gz DMISSCRGHOOKIQ-CYBMUJFWSA-N 1 1 343.387 2.358 20 5 EEBDMO Cc1c(NC(=O)CCN2CC[C@H](C[NH+](C)C)C2)cccc1[N+](=O)[O-] ZINC000114198733 462632336 /nfs/dbraw/zinc/63/23/36/462632336.db2.gz ZQCOPPYRWZNTCE-CQSZACIVSA-N 1 1 334.420 2.115 20 5 EEBDMO C[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)CCOCC1CC1 ZINC000088601614 462638921 /nfs/dbraw/zinc/63/89/21/462638921.db2.gz KHKPFWGLMTUXRV-UHFFFAOYSA-N 1 1 349.387 2.251 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H](O)COc1ccccc1)CC2 ZINC000088605339 462639250 /nfs/dbraw/zinc/63/92/50/462639250.db2.gz WHMCHFMDCFUQRI-QGZVFWFLSA-N 1 1 328.368 2.393 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H](O)COc1ccccc1)CC2 ZINC000088605339 462639253 /nfs/dbraw/zinc/63/92/53/462639253.db2.gz WHMCHFMDCFUQRI-QGZVFWFLSA-N 1 1 328.368 2.393 20 5 EEBDMO CC[C@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000114460967 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ZINC001169039543 803581914 /nfs/dbraw/zinc/58/19/14/803581914.db2.gz RAEMSDDFSRGJQG-GHMZBOCLSA-N 1 1 339.417 2.123 20 5 EEBDMO CCOC(=O)c1nc2c(s1)C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2 ZINC001169039543 803581918 /nfs/dbraw/zinc/58/19/18/803581918.db2.gz RAEMSDDFSRGJQG-GHMZBOCLSA-N 1 1 339.417 2.123 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCCn3cnc(Cn4cccc4)c3C2)C1 ZINC001169026418 803591634 /nfs/dbraw/zinc/59/16/34/803591634.db2.gz WSWDPBGKQGFKJE-HOTGVXAUSA-N 1 1 343.431 2.384 20 5 EEBDMO O=C1c2cccc(F)c2CN1[C@@H]1CC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169056323 803597512 /nfs/dbraw/zinc/59/75/12/803597512.db2.gz RSYLGWKWUZRIDF-BFHYXJOUSA-N 1 1 347.390 2.301 20 5 EEBDMO Cc1ccc(C(=O)OCCC[NH+]2CCN(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000787571027 807155009 /nfs/dbraw/zinc/15/50/09/807155009.db2.gz IECUDFMMJVBNGN-UHFFFAOYSA-N 1 1 349.431 2.476 20 5 EEBDMO O=[N+]([O-])c1cnn(CN2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000788381761 807506975 /nfs/dbraw/zinc/50/69/75/807506975.db2.gz HFJHBCIKUAJPBJ-UHFFFAOYSA-N 1 1 330.392 2.161 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@H](O)[C@@H](F)CC2)c([N+](=O)[O-])c1 ZINC001170328388 809892988 /nfs/dbraw/zinc/89/29/88/809892988.db2.gz KHKBWMPLEWUEHD-PJODQICGSA-N 1 1 326.368 2.329 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H](C(=O)N(C)C)C2)c([N+](=O)[O-])c1 ZINC001170345375 809916026 /nfs/dbraw/zinc/91/60/26/809916026.db2.gz JNKJJYLHORVVIM-UKRRQHHQSA-N 1 1 349.431 2.335 20 5 EEBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@H](C(C)C)[NH+]1CCN(C)CC1 ZINC000807924431 812387341 /nfs/dbraw/zinc/38/73/41/812387341.db2.gz IDPJUFVUDHIMLB-GOSISDBHSA-N 1 1 348.447 2.481 20 5 EEBDMO CC[C@@H]1CN(c2cc(OC)c([N+](=O)[O-])cc2F)CC[N@H+]1C[C@@H](C)O ZINC000159898074 529401548 /nfs/dbraw/zinc/40/15/48/529401548.db2.gz NHXGGYUQZFVGFS-VXGBXAGGSA-N 1 1 341.383 2.024 20 5 EEBDMO CC[C@@](C)(O)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1 ZINC000189718925 529508289 /nfs/dbraw/zinc/50/82/89/529508289.db2.gz ILDHLTHQWTYNSY-QGZVFWFLSA-N 1 1 332.404 2.455 20 5 EEBDMO CCc1ccc(C(=O)N2CC[N@@H+](CC(C)(C)O)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000186969841 529598446 /nfs/dbraw/zinc/59/84/46/529598446.db2.gz PTBMZKWMYIQHLE-ZDUSSCGKSA-N 1 1 349.431 2.074 20 5 EEBDMO C[N@@H+](CCCn1ccnc1)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000129567605 529899062 /nfs/dbraw/zinc/89/90/62/529899062.db2.gz FVYBKXRZWMNTRE-UHFFFAOYSA-N 1 1 349.366 2.281 20 5 EEBDMO CN(CC[N@@H+](C)C1CC1)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000186776073 529902814 /nfs/dbraw/zinc/90/28/14/529902814.db2.gz FRNRTJMRWYDRAU-UHFFFAOYSA-N 1 1 340.811 2.213 20 5 EEBDMO CCn1nccc1N1CCC[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)C1=O ZINC000191635288 239226475 /nfs/dbraw/zinc/22/64/75/239226475.db2.gz JYLOWVCLFWXRFG-GFCCVEGCSA-N 1 1 349.416 2.158 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@H+](CC(C)(C)O)C[C@@H]1C ZINC000421878879 240041139 /nfs/dbraw/zinc/04/11/39/240041139.db2.gz WDZJFUIYCPDZDD-AWEZNQCLSA-N 1 1 349.431 2.129 20 5 EEBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(C3OCCO3)CC2)c([N+](=O)[O-])c1 ZINC000193861963 240337885 /nfs/dbraw/zinc/33/78/85/240337885.db2.gz MKNBAJVRRFBMAK-UHFFFAOYSA-N 1 1 337.332 2.088 20 5 EEBDMO O=C(C[N@H+]1CCC[C@@H]1CCO)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000426214459 241235334 /nfs/dbraw/zinc/23/53/34/241235334.db2.gz GAZDWBVNMDFXFD-LLVKDONJSA-N 1 1 327.768 2.034 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@@H]1CCO)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000426214459 241235343 /nfs/dbraw/zinc/23/53/43/241235343.db2.gz GAZDWBVNMDFXFD-LLVKDONJSA-N 1 1 327.768 2.034 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000447318583 242266218 /nfs/dbraw/zinc/26/62/18/242266218.db2.gz KQOMLOOWGFOKQN-HZPDHXFCSA-N 1 1 344.415 2.289 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)[C@@H](C)C1 ZINC000245521092 243123129 /nfs/dbraw/zinc/12/31/29/243123129.db2.gz KLFBWCJFGXGUAE-AAEUAGOBSA-N 1 1 349.387 2.126 20 5 EEBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc2c1 ZINC000451695272 243208707 /nfs/dbraw/zinc/20/87/07/243208707.db2.gz DJNGTZAKTKBBEH-DYEKYZERSA-N 1 1 330.388 2.454 20 5 EEBDMO C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC[N@H+](C2CC2)C1 ZINC000452172922 243364626 /nfs/dbraw/zinc/36/46/26/243364626.db2.gz LMXAKDIPVWXRFG-GFCCVEGCSA-N 1 1 335.379 2.219 20 5 EEBDMO C[C@@H](CCO)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccccc1 ZINC000093303512 218212240 /nfs/dbraw/zinc/21/22/40/218212240.db2.gz MGINKPHYBGJIPJ-HNNXBMFYSA-N 1 1 345.399 2.030 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C[N@H+]1C1CC1 ZINC000267991567 256103202 /nfs/dbraw/zinc/10/32/02/256103202.db2.gz QDSILANTCNOITP-QWRGUYRKSA-N 1 1 328.372 2.431 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000270497413 256141524 /nfs/dbraw/zinc/14/15/24/256141524.db2.gz JXWBTEDZZWRKRQ-BBRMVZONSA-N 1 1 334.420 2.119 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000268159198 256121008 /nfs/dbraw/zinc/12/10/08/256121008.db2.gz HTJOETVBCLAZPW-NHYWBVRUSA-N 1 1 335.429 2.286 20 5 EEBDMO C[C@@H]1CCC[C@@H](CO)[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000270515003 256143263 /nfs/dbraw/zinc/14/32/63/256143263.db2.gz SDVZCJJEPSNVIA-RISCZKNCSA-N 1 1 332.360 2.380 20 5 EEBDMO C[C@@H]1CCC[C@@H](CO)[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000270515003 256143264 /nfs/dbraw/zinc/14/32/64/256143264.db2.gz SDVZCJJEPSNVIA-RISCZKNCSA-N 1 1 332.360 2.380 20 5 EEBDMO C[NH+](C)[C@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000054645957 292139821 /nfs/dbraw/zinc/13/98/21/292139821.db2.gz HNANKNLPTNUGRS-OAHLLOKOSA-N 1 1 346.387 2.332 20 5 EEBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@H](CN2CCOCC2)C1 ZINC000119230650 292243158 /nfs/dbraw/zinc/24/31/58/292243158.db2.gz TXMICXABIAXSIL-CYBMUJFWSA-N 1 1 339.823 2.402 20 5 EEBDMO COC[C@@](C)(CC(=O)OC)[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000119470726 292245907 /nfs/dbraw/zinc/24/59/07/292245907.db2.gz NDHDANLTPDTDSX-CQSZACIVSA-N 1 1 330.768 2.306 20 5 EEBDMO O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000173287026 152156093 /nfs/dbraw/zinc/15/60/93/152156093.db2.gz AHYQMCSHJYNPGK-HNNXBMFYSA-N 1 1 347.415 2.354 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000081362269 159152034 /nfs/dbraw/zinc/15/20/34/159152034.db2.gz PKVQVTKJJYBEIU-ZDUSSCGKSA-N 1 1 335.404 2.407 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+](CCCCO)C2CC2)cccc1[N+](=O)[O-] ZINC000118844146 159368604 /nfs/dbraw/zinc/36/86/04/159368604.db2.gz MLVYUJAJJNHCAQ-UHFFFAOYSA-N 1 1 335.404 2.469 20 5 EEBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](CC(C)C)[NH+]1CCOCC1 ZINC000195343842 160211645 /nfs/dbraw/zinc/21/16/45/160211645.db2.gz QUGZKBNQMIWHJZ-CQSZACIVSA-N 1 1 339.440 2.278 20 5 EEBDMO CSCC[C@@H](C)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248462547 160347843 /nfs/dbraw/zinc/34/78/43/160347843.db2.gz PZCHCIDKDJUVPM-CHWSQXEVSA-N 1 1 328.434 2.408 20 5 EEBDMO COC[C@@H]1CCCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000342739025 161086928 /nfs/dbraw/zinc/08/69/28/161086928.db2.gz OENOKCSIDSUZNT-ZBFHGGJFSA-N 1 1 338.404 2.083 20 5 EEBDMO CC[C@@H]1CO[C@H](C)C[N@@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000343872143 161176481 /nfs/dbraw/zinc/17/64/81/161176481.db2.gz YJRPTFPIKOOLPJ-CHWSQXEVSA-N 1 1 349.387 2.392 20 5 EEBDMO CC[C@@H]1CO[C@H](C)C[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000343872143 161176482 /nfs/dbraw/zinc/17/64/82/161176482.db2.gz YJRPTFPIKOOLPJ-CHWSQXEVSA-N 1 1 349.387 2.392 20 5 EEBDMO CCn1nccc1C[N@H+](C)CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000352364819 162107344 /nfs/dbraw/zinc/10/73/44/162107344.db2.gz IZXCJAHHIYYPQS-UHFFFAOYSA-N 1 1 334.376 2.331 20 5 EEBDMO CCn1nccc1C[N@@H+](C)CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000352364819 162107347 /nfs/dbraw/zinc/10/73/47/162107347.db2.gz IZXCJAHHIYYPQS-UHFFFAOYSA-N 1 1 334.376 2.331 20 5 EEBDMO Cc1nn(C)c(C)c1NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000352545826 162181749 /nfs/dbraw/zinc/18/17/49/162181749.db2.gz ZWXAPNQBXOJOKB-UHFFFAOYSA-N 1 1 345.403 2.058 20 5 EEBDMO Cc1nn(C)c(C)c1NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000352545826 162181753 /nfs/dbraw/zinc/18/17/53/162181753.db2.gz ZWXAPNQBXOJOKB-UHFFFAOYSA-N 1 1 345.403 2.058 20 5 EEBDMO CC[N@@H+](CCC1CC1)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000355039680 163061151 /nfs/dbraw/zinc/06/11/51/163061151.db2.gz ODYBTIGHIQBNSN-UHFFFAOYSA-N 1 1 335.360 2.384 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)NCCNc2cccc(C)[nH+]2)c1 ZINC000359752590 164165390 /nfs/dbraw/zinc/16/53/90/164165390.db2.gz NMCIMNBHNZCYDA-UHFFFAOYSA-N 1 1 330.344 2.149 20 5 EEBDMO CC[N@@H+](CCNS(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])C(C)C ZINC000360004163 164212753 /nfs/dbraw/zinc/21/27/53/164212753.db2.gz BNYBWFMIRNDEFD-UHFFFAOYSA-N 1 1 343.449 2.220 20 5 EEBDMO C[C@@H]1C[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000360666067 164359997 /nfs/dbraw/zinc/35/99/97/164359997.db2.gz NLDBRNYKPVKTSY-ZJUUUORDSA-N 1 1 347.824 2.009 20 5 EEBDMO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)C1 ZINC000368245567 166075524 /nfs/dbraw/zinc/07/55/24/166075524.db2.gz VHFKNSTVKOZYET-IWCQGFGOSA-N 1 1 336.436 2.443 20 5 EEBDMO Cc1ccc([C@@]2(C)CC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000370028263 166380352 /nfs/dbraw/zinc/38/03/52/166380352.db2.gz CJUPNDZJLRLKRE-ROUUACIJSA-N 1 1 344.415 2.124 20 5 EEBDMO CC(C)N1CCN([C@H]2CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000375902073 167222889 /nfs/dbraw/zinc/22/28/89/167222889.db2.gz MCKIKVCSSHBDKQ-IBGZPJMESA-N 1 1 346.475 2.238 20 5 EEBDMO CC(C)N1CCN([C@H]2CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000375902073 167222892 /nfs/dbraw/zinc/22/28/92/167222892.db2.gz MCKIKVCSSHBDKQ-IBGZPJMESA-N 1 1 346.475 2.238 20 5 EEBDMO C[C@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@]2(CCCOC2)O1 ZINC000376133801 167268029 /nfs/dbraw/zinc/26/80/29/167268029.db2.gz PFJQKXLMAQHTFX-YOEHRIQHSA-N 1 1 336.388 2.244 20 5 EEBDMO C[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@]2(CCCOC2)O1 ZINC000376133801 167268032 /nfs/dbraw/zinc/26/80/32/167268032.db2.gz PFJQKXLMAQHTFX-YOEHRIQHSA-N 1 1 336.388 2.244 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)[C@@H]2C1 ZINC000272702720 269011436 /nfs/dbraw/zinc/01/14/36/269011436.db2.gz ZAKMHQMCZLYDGZ-MEDUHNTESA-N 1 1 328.372 2.242 20 5 EEBDMO Cn1ccnc1[C@H](NCC[N@H+]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000279806383 269307163 /nfs/dbraw/zinc/30/71/63/269307163.db2.gz OCFBAXFHSKFQAI-QGZVFWFLSA-N 1 1 341.415 2.269 20 5 EEBDMO Cn1ccnc1[C@H](NCC[N@@H+]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000279806383 269307165 /nfs/dbraw/zinc/30/71/65/269307165.db2.gz OCFBAXFHSKFQAI-QGZVFWFLSA-N 1 1 341.415 2.269 20 5 EEBDMO C[C@@]1(O)CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000280202549 269338144 /nfs/dbraw/zinc/33/81/44/269338144.db2.gz USLKGDZWICRKNV-MRXNPFEDSA-N 1 1 332.360 2.382 20 5 EEBDMO CO[C@@H]1CC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1(C)C ZINC000451572913 274064767 /nfs/dbraw/zinc/06/47/67/274064767.db2.gz XVFRRFCMMCWWGO-HZPDHXFCSA-N 1 1 347.415 2.447 20 5 EEBDMO CO[C@@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1(C)C ZINC000451572913 274064769 /nfs/dbraw/zinc/06/47/69/274064769.db2.gz XVFRRFCMMCWWGO-HZPDHXFCSA-N 1 1 347.415 2.447 20 5 EEBDMO C[C@@H](CN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)[N@@H+](C)C1CC1 ZINC000272554457 274175269 /nfs/dbraw/zinc/17/52/69/274175269.db2.gz RYANZAOGAUAXQF-SUMWQHHRSA-N 1 1 343.431 2.490 20 5 EEBDMO C[C@@H](c1ccccc1)[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])C(N)=O ZINC000428862884 274278286 /nfs/dbraw/zinc/27/82/86/274278286.db2.gz WIDMXHZXLFQBSW-MEDUHNTESA-N 1 1 331.347 2.481 20 5 EEBDMO CN(C)C(=O)C[NH+]1CCC(Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000287434489 274962327 /nfs/dbraw/zinc/96/23/27/274962327.db2.gz QUCAVTWFLNIQTJ-UHFFFAOYSA-N 1 1 340.811 2.213 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](n2cccn2)C1 ZINC000291686211 275330085 /nfs/dbraw/zinc/33/00/85/275330085.db2.gz HDXBISFJGSPWGD-HNNXBMFYSA-N 1 1 343.387 2.375 20 5 EEBDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1(CO)CCC1 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CC(C)[C@H](CNc1ncnc2ccc([N+](=O)[O-])cc21)[NH+]1CCOCC1 ZINC000609850017 450105302 /nfs/dbraw/zinc/10/53/02/450105302.db2.gz RTMVLQHFLZCFEN-INIZCTEOSA-N 1 1 345.403 2.307 20 5 EEBDMO COc1c(C(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000354591028 465040810 /nfs/dbraw/zinc/04/08/10/465040810.db2.gz BMLBQRIRDATVSB-CHWSQXEVSA-N 1 1 335.404 2.454 20 5 EEBDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000354624241 465060328 /nfs/dbraw/zinc/06/03/28/465060328.db2.gz NZMLITBGNIWISM-ZDUSSCGKSA-N 1 1 334.420 2.417 20 5 EEBDMO COCCC[N@@H+](C)CCNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000341269558 465085187 /nfs/dbraw/zinc/08/51/87/465085187.db2.gz NNGOHPNHUFDOES-UHFFFAOYSA-N 1 1 344.415 3.037 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])cc1N1CCOC1=O ZINC000296282088 465142127 /nfs/dbraw/zinc/14/21/27/465142127.db2.gz HHIOKQOGWOQMSS-ZDUSSCGKSA-N 1 1 334.376 2.448 20 5 EEBDMO CCc1nc(NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])cc(C)[nH+]1 ZINC000341479595 465189734 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ZINC000046379278 462674893 /nfs/dbraw/zinc/67/48/93/462674893.db2.gz MCJJHPBFTGYHCN-AWEZNQCLSA-N 1 1 334.420 2.468 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(NC[C@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)n1 ZINC000089644411 462703253 /nfs/dbraw/zinc/70/32/53/462703253.db2.gz SGXQYHYBISESNY-HZPDHXFCSA-N 1 1 342.399 2.346 20 5 EEBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000115275378 462704279 /nfs/dbraw/zinc/70/42/79/462704279.db2.gz UOKOTEMZLHGMBS-RHSMWYFYSA-N 1 1 349.431 2.462 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@]2(CCOC2)C1 ZINC000153904373 462706439 /nfs/dbraw/zinc/70/64/39/462706439.db2.gz XFQQCWMWPKBKQV-SJCJKPOMSA-N 1 1 349.387 2.043 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@]2(CCOC2)C1 ZINC000153904373 462706443 /nfs/dbraw/zinc/70/64/43/462706443.db2.gz XFQQCWMWPKBKQV-SJCJKPOMSA-N 1 1 349.387 2.043 20 5 EEBDMO C[NH+](C)[C@@H](CNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000010088610 462812328 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331.372 2.252 20 5 EEBDMO NC(=O)[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000092734965 462975538 /nfs/dbraw/zinc/97/55/38/462975538.db2.gz DICAHAOFLBGJOD-AWEZNQCLSA-N 1 1 347.396 2.009 20 5 EEBDMO NC(=O)[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000092734965 462975544 /nfs/dbraw/zinc/97/55/44/462975544.db2.gz DICAHAOFLBGJOD-AWEZNQCLSA-N 1 1 347.396 2.009 20 5 EEBDMO CCc1nn(C)c(NCC[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000092828249 462983230 /nfs/dbraw/zinc/98/32/30/462983230.db2.gz YVLUVBAYJGYXRU-UHFFFAOYSA-N 1 1 329.404 2.361 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccc4[nH]cnc4c3)CC2)cn1 ZINC000535785915 468331192 /nfs/dbraw/zinc/33/11/92/468331192.db2.gz RFEICHLSRIFEMX-UHFFFAOYSA-N 1 1 338.371 2.188 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccc4nc[nH]c4c3)CC2)cn1 ZINC000535785915 468331197 /nfs/dbraw/zinc/33/11/97/468331197.db2.gz RFEICHLSRIFEMX-UHFFFAOYSA-N 1 1 338.371 2.188 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccco2)[NH+](C)C)c1 ZINC000067778474 463050965 /nfs/dbraw/zinc/05/09/65/463050965.db2.gz ZHRIBTDWYWEFHA-CQSZACIVSA-N 1 1 333.344 2.229 20 5 EEBDMO Cc1cc(C(=O)NCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000023509335 463067913 /nfs/dbraw/zinc/06/79/13/463067913.db2.gz RDJLJQMSGZMJAG-OKILXGFUSA-N 1 1 335.404 2.132 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H]1CCSC1 ZINC000121067211 463074342 /nfs/dbraw/zinc/07/43/42/463074342.db2.gz WIFMHRLJJMQTTJ-LBPRGKRZSA-N 1 1 339.417 2.369 20 5 EEBDMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@H]2CSC)c([N+](=O)[O-])c1 ZINC000135488589 463164575 /nfs/dbraw/zinc/16/45/75/463164575.db2.gz UJYAPCMCUYXVFE-NSHDSACASA-N 1 1 339.417 2.369 20 5 EEBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@H]2CSC)c([N+](=O)[O-])c1 ZINC000135488589 463164582 /nfs/dbraw/zinc/16/45/82/463164582.db2.gz UJYAPCMCUYXVFE-NSHDSACASA-N 1 1 339.417 2.369 20 5 EEBDMO NC(=O)c1cccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000029170969 463245380 /nfs/dbraw/zinc/24/53/80/463245380.db2.gz MTUAICAKWVMWGV-UHFFFAOYSA-N 1 1 340.383 2.016 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCOc3cccc(F)c3)CC2)cn1 ZINC000029820716 463274425 /nfs/dbraw/zinc/27/44/25/463274425.db2.gz MPTNTVGPOMFPGK-UHFFFAOYSA-N 1 1 346.362 2.330 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC000055403233 463316318 /nfs/dbraw/zinc/31/63/18/463316318.db2.gz YEGMYAFYIYJWFS-QWHCGFSZSA-N 1 1 335.404 2.454 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000139876984 463334130 /nfs/dbraw/zinc/33/41/30/463334130.db2.gz WSHKYJMGWAPUTH-IIAWOOMASA-N 1 1 346.431 2.338 20 5 EEBDMO CC[N@@H+]1CCCC[C@@H]1CNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000123953724 463381138 /nfs/dbraw/zinc/38/11/38/463381138.db2.gz REPGYETVQJXVHJ-LLVKDONJSA-N 1 1 347.462 2.117 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000123953724 463381140 /nfs/dbraw/zinc/38/11/40/463381140.db2.gz REPGYETVQJXVHJ-LLVKDONJSA-N 1 1 347.462 2.117 20 5 EEBDMO 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CNS(=O)(=O)c1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000595289109 468801444 /nfs/dbraw/zinc/80/14/44/468801444.db2.gz OJUPWYLHCHDMIJ-UHFFFAOYSA-N 1 1 349.412 2.135 20 5 EEBDMO CC[N@@H+]1CCCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)[C@@H](C)C1 ZINC000601439642 468875175 /nfs/dbraw/zinc/87/51/75/468875175.db2.gz HQVGPCPQASCYHA-JTQLQIEISA-N 1 1 347.462 2.070 20 5 EEBDMO CC[N@H+]1CCCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)[C@@H](C)C1 ZINC000601439642 468875177 /nfs/dbraw/zinc/87/51/77/468875177.db2.gz HQVGPCPQASCYHA-JTQLQIEISA-N 1 1 347.462 2.070 20 5 EEBDMO CC[N@H+]1CCCN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000595536928 468892796 /nfs/dbraw/zinc/89/27/96/468892796.db2.gz XTBIWLXNKDEAGF-CQSZACIVSA-N 1 1 334.420 2.258 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])CC[C@H]21 ZINC000593535067 469021702 /nfs/dbraw/zinc/02/17/02/469021702.db2.gz UNMWVHWANLCVLJ-UKRRQHHQSA-N 1 1 335.379 2.219 20 5 EEBDMO C[C@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@]1(C)CO 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CC[C@@H](C[NH+]1CCCC1)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000609833421 469963914 /nfs/dbraw/zinc/96/39/14/469963914.db2.gz IGIKRGJHOJRKKW-NSHDSACASA-N 1 1 331.376 2.075 20 5 EEBDMO O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594202833 485603263 /nfs/dbraw/zinc/60/32/63/485603263.db2.gz SKKAWRUVFIOXOA-UONOGXRCSA-N 1 1 333.388 2.107 20 5 EEBDMO C[C@@H]1[C@H](C)C[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@H]1C ZINC000419394544 485686577 /nfs/dbraw/zinc/68/65/77/485686577.db2.gz PLIQNKFBMQSQCT-MXWKQRLJSA-N 1 1 335.360 2.238 20 5 EEBDMO CCOC(=O)[C@@H]1CCCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411155554 527821962 /nfs/dbraw/zinc/82/19/62/527821962.db2.gz HPNQTKNFACOELB-HNNXBMFYSA-N 1 1 349.387 2.341 20 5 EEBDMO CCOC(=O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411155554 527821968 /nfs/dbraw/zinc/82/19/68/527821968.db2.gz HPNQTKNFACOELB-HNNXBMFYSA-N 1 1 349.387 2.341 20 5 EEBDMO CC[C@@H](C)C[N@@H+](C)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O 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IYOJRBVBPBEGOS-JKSUJKDBSA-N 1 1 348.428 2.417 20 5 EEBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@@H](C4OCCO4)C3)nc2c1 ZINC000769731188 577583150 /nfs/dbraw/zinc/58/31/50/577583150.db2.gz TYOHANVLLSDHIA-LLVKDONJSA-N 1 1 332.360 2.056 20 5 EEBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H](C4OCCO4)C3)nc2c1 ZINC000769731188 577583151 /nfs/dbraw/zinc/58/31/51/577583151.db2.gz TYOHANVLLSDHIA-LLVKDONJSA-N 1 1 332.360 2.056 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[N@@H+](C)[C@H](C)C1 ZINC000761080502 577676020 /nfs/dbraw/zinc/67/60/20/577676020.db2.gz JNQYAPYCFHUUGS-MNOVXSKESA-N 1 1 340.811 2.211 20 5 EEBDMO CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)OCc1ccc([N+](=O)[O-])cc1 ZINC000748473918 577962549 /nfs/dbraw/zinc/96/25/49/577962549.db2.gz ZRGDVDBBAOVWJL-INIZCTEOSA-N 1 1 336.388 2.431 20 5 EEBDMO O=C(OCCC[NH+]1CCOCC1)c1cc([N+](=O)[O-])ccc1Cl ZINC000748490635 577962908 /nfs/dbraw/zinc/96/29/08/577962908.db2.gz BVIYBMJTWWPBLN-UHFFFAOYSA-N 1 1 328.752 2.127 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@H]([C@H]4CCOC4)C3)n2)cc1 ZINC000749802567 577982103 /nfs/dbraw/zinc/98/21/03/577982103.db2.gz YFGMHXXSBCCKAJ-GJZGRUSLSA-N 1 1 343.387 2.169 20 5 EEBDMO COc1cccc([C@H](C)[NH+]2CCN(c3c([N+](=O)[O-])cnn3C)CC2)c1 ZINC000892326612 678843740 /nfs/dbraw/zinc/84/37/40/678843740.db2.gz CSSHHKDFICTLJF-ZDUSSCGKSA-N 1 1 345.403 2.220 20 5 EEBDMO Cc1c(CNC(=O)N2CC[C@H]3[C@H]2CCC[N@@H+]3C)cccc1[N+](=O)[O-] ZINC000894395294 682801869 /nfs/dbraw/zinc/80/18/69/682801869.db2.gz CNVRHWBNYQHTJI-JKSUJKDBSA-N 1 1 332.404 2.281 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000892899036 683177122 /nfs/dbraw/zinc/17/71/22/683177122.db2.gz IJVCLTFXNJTLBW-SMDDNHRTSA-N 1 1 342.399 2.341 20 5 EEBDMO CC(C)c1ccc(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1 ZINC001025775762 683273302 /nfs/dbraw/zinc/27/33/02/683273302.db2.gz MMNUFBBGOFWYBL-SFFUCWETSA-N 1 1 343.427 2.022 20 5 EEBDMO CC(C)c1ccc(C[N@@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001025775762 683273305 /nfs/dbraw/zinc/27/33/05/683273305.db2.gz MMNUFBBGOFWYBL-SFFUCWETSA-N 1 1 343.427 2.022 20 5 EEBDMO CC(C)c1ccc(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001025775762 683273309 /nfs/dbraw/zinc/27/33/09/683273309.db2.gz MMNUFBBGOFWYBL-SFFUCWETSA-N 1 1 343.427 2.022 20 5 EEBDMO CC1(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccc([N+](=O)[O-])cc4)C[C@H]32)CC=CC1 ZINC001026010526 683744121 /nfs/dbraw/zinc/74/41/21/683744121.db2.gz KDNXRHIKUOMMMS-FVQHAEBGSA-N 1 1 341.411 2.498 20 5 EEBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c2cccnc12)[C@@H]1C[N@@H+](C)CCN1C ZINC000895249733 684376701 /nfs/dbraw/zinc/37/67/01/684376701.db2.gz XBWUQAOZCWXERS-WBMJQRKESA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c2cccnc12)[C@@H]1CN(C)CC[N@@H+]1C ZINC000895249733 684376706 /nfs/dbraw/zinc/37/67/06/684376706.db2.gz XBWUQAOZCWXERS-WBMJQRKESA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c2cccnc12)[C@@H]1CN(C)CC[N@H+]1C ZINC000895249733 684376710 /nfs/dbraw/zinc/37/67/10/684376710.db2.gz XBWUQAOZCWXERS-WBMJQRKESA-N 1 1 329.404 2.189 20 5 EEBDMO CC[C@@H](C[NH+]1CCOCC1)Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000895802429 684730842 /nfs/dbraw/zinc/73/08/42/684730842.db2.gz SSPJQNUTKIBRHS-JTQLQIEISA-N 1 1 337.405 2.122 20 5 EEBDMO CC1(C)CN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])CC[N@H+]1CCO ZINC000893369138 684975080 /nfs/dbraw/zinc/97/50/80/684975080.db2.gz QJQQCLQKLFDNNT-UHFFFAOYSA-N 1 1 348.378 2.175 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@H]4OCCC[C@@H]4C3)n2)cc1 ZINC000129134640 1177675977 /nfs/dbraw/zinc/67/59/77/1177675977.db2.gz ZTIPBTJYZYUJPB-GDBMZVCRSA-N 1 1 343.387 2.312 20 5 EEBDMO COCC1CC[NH+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000112331503 1193132645 /nfs/dbraw/zinc/13/26/45/1193132645.db2.gz ISOLJDMFQNCNCV-UHFFFAOYSA-N 1 1 331.376 2.169 20 5 EEBDMO O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[N@H+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000872712480 1198345894 /nfs/dbraw/zinc/34/58/94/1198345894.db2.gz PRPJRONSLNPLLU-TXEJJXNPSA-N 1 1 327.340 2.046 20 5 EEBDMO O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[N@@H+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000872712480 1198345905 /nfs/dbraw/zinc/34/59/05/1198345905.db2.gz PRPJRONSLNPLLU-TXEJJXNPSA-N 1 1 327.340 2.046 20 5 EEBDMO CCOC(=O)Cc1ccc(N2CCC[N@@H+](CC)CC2)c([N+](=O)[O-])c1 ZINC000825727703 1198879705 /nfs/dbraw/zinc/87/97/05/1198879705.db2.gz IIVGTHRGCKKQEN-UHFFFAOYSA-N 1 1 335.404 2.232 20 5 EEBDMO O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)O[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000810839560 1199773916 /nfs/dbraw/zinc/77/39/16/1199773916.db2.gz XIRQTUDLDQZJFS-HIFRSBDPSA-N 1 1 344.371 2.115 20 5 EEBDMO CCOC(=O)Cc1ccc(N(C)CC[N@@H+](C)C2CC2)c([N+](=O)[O-])c1 ZINC000825947816 1199894554 /nfs/dbraw/zinc/89/45/54/1199894554.db2.gz SUXXUUATVKWCCE-UHFFFAOYSA-N 1 1 335.404 2.231 20 5 EEBDMO CC1(C)C(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)[C@H]1C1CC1 ZINC000811769903 1200283825 /nfs/dbraw/zinc/28/38/25/1200283825.db2.gz IKQGJHQERVNKJB-HNNXBMFYSA-N 1 1 347.419 2.033 20 5 EEBDMO Cc1nn(C[N@@H+]2CCCN3c4ccccc4C[C@H]3C2)cc1[N+](=O)[O-] ZINC000811782794 1200293628 /nfs/dbraw/zinc/29/36/28/1200293628.db2.gz RXFOVBIQBIJGGX-HNNXBMFYSA-N 1 1 327.388 2.194 20 5 EEBDMO Cc1nn(C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)cc1[N+](=O)[O-] ZINC000811782794 1200293632 /nfs/dbraw/zinc/29/36/32/1200293632.db2.gz RXFOVBIQBIJGGX-HNNXBMFYSA-N 1 1 327.388 2.194 20 5 EEBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)Cc2cccc(F)c2[N+](=O)[O-])C1 ZINC000866777014 1201603748 /nfs/dbraw/zinc/60/37/48/1201603748.db2.gz NQSDSAJANHJYHN-HIFRSBDPSA-N 1 1 335.379 2.219 20 5 EEBDMO C[C@@H]1C[N@H+](CCCCNc2ccnc(F)c2[N+](=O)[O-])C[C@H](C)O1 ZINC000882075492 1201812276 /nfs/dbraw/zinc/81/22/76/1201812276.db2.gz WIPOIEGQODKCOT-TXEJJXNPSA-N 1 1 326.372 2.430 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NCCCN(C)c1ccc([N+](=O)[O-])c(C)c1 ZINC001095625622 1205895817 /nfs/dbraw/zinc/89/58/17/1205895817.db2.gz ZDVLBOMQTFISSL-UHFFFAOYSA-N 1 1 336.436 2.188 20 5 EEBDMO C[C@H](c1ccccc1)[C@H]1CCC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000932279083 1207574527 /nfs/dbraw/zinc/57/45/27/1207574527.db2.gz UOLNXAWXFVUOJF-FHLIZLRMSA-N 1 1 344.415 2.420 20 5 EEBDMO CCOC(=O)[C@@H]1CC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000932644920 1207644896 /nfs/dbraw/zinc/64/48/96/1207644896.db2.gz MRGNJWOVVNOBHL-SNVBAGLBSA-N 1 1 326.324 2.128 20 5 EEBDMO CCOC(=O)[C@@H]1CC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000932644920 1207644898 /nfs/dbraw/zinc/64/48/98/1207644898.db2.gz MRGNJWOVVNOBHL-SNVBAGLBSA-N 1 1 326.324 2.128 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000935211983 1208115927 /nfs/dbraw/zinc/11/59/27/1208115927.db2.gz FIWCKCQTYORFFM-HTQZYQBOSA-N 1 1 344.774 2.134 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000935211983 1208115929 /nfs/dbraw/zinc/11/59/29/1208115929.db2.gz FIWCKCQTYORFFM-HTQZYQBOSA-N 1 1 344.774 2.134 20 5 EEBDMO CC[C@@]1(O)CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000778393233 1208232586 /nfs/dbraw/zinc/23/25/86/1208232586.db2.gz VBXJSSYTASQREU-CQSZACIVSA-N 1 1 327.768 2.034 20 5 EEBDMO CC[C@@]1(O)CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000778393233 1208232589 /nfs/dbraw/zinc/23/25/89/1208232589.db2.gz VBXJSSYTASQREU-CQSZACIVSA-N 1 1 327.768 2.034 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(N(C)CCCNC(=O)C[N@@H+](C)C2CCC2)c1 ZINC001095769853 1208501923 /nfs/dbraw/zinc/50/19/23/1208501923.db2.gz LPRJVEKUKHBKIA-UHFFFAOYSA-N 1 1 348.447 2.330 20 5 EEBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCS[C@H]4COCC[C@H]43)c2c1 ZINC000246914971 1213407432 /nfs/dbraw/zinc/40/74/32/1213407432.db2.gz MTEOZCKLDMWEOM-HIFRSBDPSA-N 1 1 334.401 2.108 20 5 EEBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCS[C@H]4COCC[C@H]43)c2c1 ZINC000246914971 1213407435 /nfs/dbraw/zinc/40/74/35/1213407435.db2.gz MTEOZCKLDMWEOM-HIFRSBDPSA-N 1 1 334.401 2.108 20 5 EEBDMO CCN(CCCNC(=O)Cn1cc[nH+]c1C)c1ccccc1[N+](=O)[O-] ZINC001095885982 1213989987 /nfs/dbraw/zinc/98/99/87/1213989987.db2.gz QMHSWQZCWDCRNK-UHFFFAOYSA-N 1 1 345.403 2.133 20 5 EEBDMO Cc1ccc(C[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001045436724 1233745123 /nfs/dbraw/zinc/74/51/23/1233745123.db2.gz VIHOXLXDNALZIG-HZPDHXFCSA-N 1 1 331.416 2.131 20 5 EEBDMO CC1(C)CCC(C[N@@H+]2C[C@H]3CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C[C@H]3C2)CC1 ZINC001048814284 1238717736 /nfs/dbraw/zinc/71/77/36/1238717736.db2.gz CHUQUPZZEZYMGF-YYIAUSFCSA-N 1 1 349.475 2.258 20 5 EEBDMO CC1(C)CCC(C[N@H+]2C[C@H]3CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@H]3C2)CC1 ZINC001048814284 1238717751 /nfs/dbraw/zinc/71/77/51/1238717751.db2.gz CHUQUPZZEZYMGF-YYIAUSFCSA-N 1 1 349.475 2.258 20 5 EEBDMO CC1(C)CCC(C[N@@H+]2C[C@H]3CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@H]3C2)CC1 ZINC001048814284 1238717759 /nfs/dbraw/zinc/71/77/59/1238717759.db2.gz CHUQUPZZEZYMGF-YYIAUSFCSA-N 1 1 349.475 2.258 20 5 EEBDMO O=C(NCC1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1)c1cn[nH]c1 ZINC001001223866 1241858406 /nfs/dbraw/zinc/85/84/06/1241858406.db2.gz ALSBHRAOUNEDLN-UHFFFAOYSA-N 1 1 349.416 2.021 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)N[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C)n2)C1 ZINC001097077814 1243673675 /nfs/dbraw/zinc/67/36/75/1243673675.db2.gz AXVNCTWWEQLUNM-JOCQHMNTSA-N 1 1 349.435 2.088 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCCN(c1cc(C)ccc1[N+](=O)[O-])C1CC1 ZINC001101370166 1245727313 /nfs/dbraw/zinc/72/73/13/1245727313.db2.gz JAAKZPUOMGUICO-UHFFFAOYSA-N 1 1 348.447 2.330 20 5 EEBDMO Cc1noc(C[N@@H+]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851746317 1277740022 /nfs/dbraw/zinc/74/00/22/1277740022.db2.gz SAVYISXMQQXLQD-NSHDSACASA-N 1 1 340.380 2.238 20 5 EEBDMO Cc1noc(C[N@H+]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851746317 1277740028 /nfs/dbraw/zinc/74/00/28/1277740028.db2.gz SAVYISXMQQXLQD-NSHDSACASA-N 1 1 340.380 2.238 20 5 EEBDMO Nc1ccc(C(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000855810566 1293335728 /nfs/dbraw/zinc/33/57/28/1293335728.db2.gz BTHXHLMDWYRWKY-CYBMUJFWSA-N 1 1 332.404 2.314 20 5 EEBDMO COC(=O)c1ccnc(NCCNc2cccc(C)[nH+]2)c1[N+](=O)[O-] ZINC000856731917 1293610734 /nfs/dbraw/zinc/61/07/34/1293610734.db2.gz XCDWNTREZRINQS-UHFFFAOYSA-N 1 1 331.332 2.004 20 5 EEBDMO CC(C)(F)C(=O)N1CC2(C1)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C2 ZINC001072382033 1295587875 /nfs/dbraw/zinc/58/78/75/1295587875.db2.gz BYWKQBVWCFSMPW-UHFFFAOYSA-N 1 1 335.379 2.377 20 5 EEBDMO CCCSc1nc(O[C@@H]2CC[NH2+]CC[C@H]2F)c([N+](=O)[O-])c(=O)[nH]1 ZINC001218016458 1297549330 /nfs/dbraw/zinc/54/93/30/1297549330.db2.gz FABWSVCRLNCPCT-RKDXNWHRSA-N 1 1 346.384 2.061 20 5 EEBDMO COC(=O)[C@H](O[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1[N+](=O)[O-] ZINC001223641588 1300206609 /nfs/dbraw/zinc/20/66/09/1300206609.db2.gz BILXUGWMUVCHMW-OQMKEHIESA-N 1 1 334.372 2.451 20 5 EEBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cccc([N+](=O)[O-])c3F)C[C@H]1[N@H+]2C ZINC001225797369 1301159250 /nfs/dbraw/zinc/15/92/50/1301159250.db2.gz TZIHVTUBEVUEAW-HTTKSJEASA-N 1 1 338.335 2.280 20 5 EEBDMO CC(=O)Nc1cc(O[C@H]2C[NH+]3CCC2CC3)c(C(C)=O)cc1[N+](=O)[O-] ZINC001229128181 1302632130 /nfs/dbraw/zinc/63/21/30/1302632130.db2.gz NKPCWRKPGRIHOJ-KRWDZBQOSA-N 1 1 347.371 2.229 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCC1(Nc2nccc(C)c2[N+](=O)[O-])CCC1 ZINC001111827959 1303956528 /nfs/dbraw/zinc/95/65/28/1303956528.db2.gz KIUZBZSMPKBUCM-UHFFFAOYSA-N 1 1 349.435 2.091 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[C@H](Oc3ccc4[nH+]ccn4c3)C2)nc1 ZINC001233754314 1304577280 /nfs/dbraw/zinc/57/72/80/1304577280.db2.gz IFOIAHHQQCLXRE-AWEZNQCLSA-N 1 1 325.328 2.295 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000798141759 1304926655 /nfs/dbraw/zinc/92/66/55/1304926655.db2.gz RBSZWSRIBALDKO-GFCCVEGCSA-N 1 1 336.348 2.059 20 5 EEBDMO Cc1ocnc1C(=O)NCCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001235017249 1305087822 /nfs/dbraw/zinc/08/78/22/1305087822.db2.gz XTMGZKDBMZTONH-UHFFFAOYSA-N 1 1 332.360 2.143 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCC(F)(C[NH3+])CC2)c1F 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ZINC001320015151 1332810795 /nfs/dbraw/zinc/81/07/95/1332810795.db2.gz SNPNPTHMXVKVIS-UHFFFAOYSA-N 1 1 336.348 2.059 20 5 EEBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC001320921986 1332979756 /nfs/dbraw/zinc/97/97/56/1332979756.db2.gz HJRJHWDCLPKPMR-OAHLLOKOSA-N 1 1 349.435 2.219 20 5 EEBDMO CC[NH+](CC)C1CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])CC1 ZINC001322743444 1333318890 /nfs/dbraw/zinc/31/88/90/1333318890.db2.gz AKXHKBVWNLTRFV-UHFFFAOYSA-N 1 1 337.424 2.388 20 5 EEBDMO CC(C)C[N@H+]1CC[C@@H](CNc2cccc(-c3nn[nH]n3)c2[N+](=O)[O-])C1 ZINC001609095737 1351841285 /nfs/dbraw/zinc/84/12/85/1351841285.db2.gz MCCKDZFVAJUBHW-LBPRGKRZSA-N 1 1 345.407 2.165 20 5 EEBDMO CC[C@@H](CSC)[N@@H+](C)Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001609191003 1351884333 /nfs/dbraw/zinc/88/43/33/1351884333.db2.gz CDXHKNSPKOYEII-LBPRGKRZSA-N 1 1 336.421 2.348 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC001326395003 1334082979 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346.387 2.072 20 5 EEBDMO CCOC1CC[NH+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000060445329 790362384 /nfs/dbraw/zinc/36/23/84/790362384.db2.gz KJPALUKLDWSCJJ-UHFFFAOYSA-N 1 1 331.376 2.312 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)NC[C@H]1C[C@@H](Nc2ccccc2[N+](=O)[O-])C1 ZINC001091382123 790522514 /nfs/dbraw/zinc/52/25/14/790522514.db2.gz MHYDBOBHMHVAEF-OKILXGFUSA-N 1 1 343.387 2.107 20 5 EEBDMO CCOC(=O)C(F)(F)CNc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2 ZINC001167850382 778187760 /nfs/dbraw/zinc/18/77/60/778187760.db2.gz GDGYGMUPVSKYMU-UHFFFAOYSA-N 1 1 343.330 2.193 20 5 EEBDMO CCOC(=O)C(F)(F)CNc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2 ZINC001167850382 778187767 /nfs/dbraw/zinc/18/77/67/778187767.db2.gz GDGYGMUPVSKYMU-UHFFFAOYSA-N 1 1 343.330 2.193 20 5 EEBDMO O=C(N1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1)C1(CF)CC1 ZINC000981928819 778551642 /nfs/dbraw/zinc/55/16/42/778551642.db2.gz FNGAZLQMYRLNSM-UHFFFAOYSA-N 1 1 335.379 2.379 20 5 EEBDMO O=C(N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1)C1(CF)CC1 ZINC000981928819 778551646 /nfs/dbraw/zinc/55/16/46/778551646.db2.gz FNGAZLQMYRLNSM-UHFFFAOYSA-N 1 1 335.379 2.379 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000846973891 790754528 /nfs/dbraw/zinc/75/45/28/790754528.db2.gz QTYOMPSYIJMUOJ-GFCCVEGCSA-N 1 1 339.367 2.055 20 5 EEBDMO CC[N@@H+]1CC[C@H]1CNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000893872982 780263170 /nfs/dbraw/zinc/26/31/70/780263170.db2.gz MXLHMCSAFMOKAE-AWEZNQCLSA-N 1 1 340.383 2.481 20 5 EEBDMO CC[N@H+]1CC[C@H]1CNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000893872982 780263173 /nfs/dbraw/zinc/26/31/73/780263173.db2.gz MXLHMCSAFMOKAE-AWEZNQCLSA-N 1 1 340.383 2.481 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)NC[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001091460479 790896471 /nfs/dbraw/zinc/89/64/71/790896471.db2.gz YSGAOAILNCCPMK-CTYIDZIISA-N 1 1 343.387 2.107 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CC[NH2+]C[C@H]1c1ccncc1 ZINC000818006268 785161309 /nfs/dbraw/zinc/16/13/09/785161309.db2.gz YYIKYWGSGIIRLV-HNNXBMFYSA-N 1 1 346.774 2.430 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000818977683 785346998 /nfs/dbraw/zinc/34/69/98/785346998.db2.gz JMLUBNHLBIXKRD-NSHDSACASA-N 1 1 343.786 2.482 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NC/C=C/CNc1ccc(F)cc1[N+](=O)[O-] ZINC001107279714 786697968 /nfs/dbraw/zinc/69/79/68/786697968.db2.gz AYYJYOSGXVTBCY-SNAWJCMRSA-N 1 1 338.383 2.160 20 5 EEBDMO O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CCC(n3ccnc3)CC2)c1 ZINC000152092588 794541790 /nfs/dbraw/zinc/54/17/90/794541790.db2.gz VYBJAOJHXGFADY-UHFFFAOYSA-N 1 1 326.360 2.436 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)N1CCN(c2ccc(C)cc2[N+](=O)[O-])CC1 ZINC001093185236 794791969 /nfs/dbraw/zinc/79/19/69/794791969.db2.gz GJXFNHFNVGNEMU-UHFFFAOYSA-N 1 1 348.447 2.282 20 5 EEBDMO COC(=O)[C@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCCO1 ZINC001172913687 797148412 /nfs/dbraw/zinc/14/84/12/797148412.db2.gz UFOSTDDFKTWZQL-DOTOQJQBSA-N 1 1 348.399 2.106 20 5 EEBDMO CCO[C@@H]1C[C@H]2CN([C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC[N@H+]2C1 ZINC001173224456 797307873 /nfs/dbraw/zinc/30/78/73/797307873.db2.gz HAHIRPNMLSGUGY-FHLIZLRMSA-N 1 1 333.432 2.321 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCC1(Nc2cccc(F)c2[N+](=O)[O-])CC1 ZINC001110193827 798369058 /nfs/dbraw/zinc/36/90/58/798369058.db2.gz ZNYLZTWLVHNESI-UHFFFAOYSA-N 1 1 338.383 2.136 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NCC1(Nc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC001110227840 799754426 /nfs/dbraw/zinc/75/44/26/799754426.db2.gz OHHWINCNIDVMKA-UHFFFAOYSA-N 1 1 338.383 2.136 20 5 EEBDMO CC(C)c1ccc(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC001086363406 802829869 /nfs/dbraw/zinc/82/98/69/802829869.db2.gz RXGISPABHWLGNZ-VDHUWJSZSA-N 1 1 345.443 2.460 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)[C@@H](CO)[NH2+]Cc2ccsc2Cl)cc1 ZINC000790964965 809007950 /nfs/dbraw/zinc/00/79/50/809007950.db2.gz USPNDDHLYICRFJ-CHWSQXEVSA-N 1 1 342.804 2.494 20 5 EEBDMO COc1ccc(C[C@H](C)[N@@H+]2CCO[C@]3(CCOC3)C2)c([N+](=O)[O-])c1 ZINC001170334090 809898424 /nfs/dbraw/zinc/89/84/24/809898424.db2.gz BCSFHWHNDSBDTF-SUMWQHHRSA-N 1 1 336.388 2.026 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CCO[C@]3(CCOC3)C2)c([N+](=O)[O-])c1 ZINC001170334090 809898426 /nfs/dbraw/zinc/89/84/26/809898426.db2.gz BCSFHWHNDSBDTF-SUMWQHHRSA-N 1 1 336.388 2.026 20 5 EEBDMO CN(C)CC[N@@H+](C)CCCN(C)c1ccc2ncccc2c1[N+](=O)[O-] ZINC000808134063 812467669 /nfs/dbraw/zinc/46/76/69/812467669.db2.gz XRSNJOAAIDABSK-UHFFFAOYSA-N 1 1 345.447 2.463 20 5 EEBDMO CN(CCCN(C)c1ccc2ncccc2c1[N+](=O)[O-])CC[NH+](C)C ZINC000808134063 812467670 /nfs/dbraw/zinc/46/76/70/812467670.db2.gz XRSNJOAAIDABSK-UHFFFAOYSA-N 1 1 345.447 2.463 20 5 EEBDMO Cc1nccn1CCC[N@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000130609806 282204761 /nfs/dbraw/zinc/20/47/61/282204761.db2.gz AELZOTIDODXZKO-CYBMUJFWSA-N 1 1 345.403 2.449 20 5 EEBDMO Cc1nnc([C@@H](C)[NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)s1 ZINC000353655846 282337028 /nfs/dbraw/zinc/33/70/28/282337028.db2.gz GYBZCQWOSJZURF-SECBINFHSA-N 1 1 335.389 2.434 20 5 EEBDMO O=C([C@@H]1CC[NH2+]CC1(F)F)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000343880497 296037630 /nfs/dbraw/zinc/03/76/30/296037630.db2.gz QHNZXDBLOHCKHX-ZDUSSCGKSA-N 1 1 339.342 2.331 20 5 EEBDMO CCOC[C@@H]1CCC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000072975923 216334175 /nfs/dbraw/zinc/33/41/75/216334175.db2.gz NWCQELAWYLSVFV-CQSZACIVSA-N 1 1 347.415 2.232 20 5 EEBDMO CCOC[C@@H]1CCC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000072975923 216334178 /nfs/dbraw/zinc/33/41/78/216334178.db2.gz NWCQELAWYLSVFV-CQSZACIVSA-N 1 1 347.415 2.232 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000193272826 240085694 /nfs/dbraw/zinc/08/56/94/240085694.db2.gz NPYXOAVWCXNPLN-LLVKDONJSA-N 1 1 347.824 2.011 20 5 EEBDMO COC(=O)c1cnc(NC[C@H]2[N@@H+](C)CCCC2(C)C)c([N+](=O)[O-])c1 ZINC000447815832 242319695 /nfs/dbraw/zinc/31/96/95/242319695.db2.gz HXGYISWOBYSBJK-CYBMUJFWSA-N 1 1 336.392 2.309 20 5 EEBDMO CCO[C@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1C ZINC000451523115 243144854 /nfs/dbraw/zinc/14/48/54/243144854.db2.gz CKBWHVQMLXPVDX-GUYCJALGSA-N 1 1 347.415 2.231 20 5 EEBDMO CCO[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1C ZINC000451523115 243144859 /nfs/dbraw/zinc/14/48/59/243144859.db2.gz CKBWHVQMLXPVDX-GUYCJALGSA-N 1 1 347.415 2.231 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000451625683 243181489 /nfs/dbraw/zinc/18/14/89/243181489.db2.gz IPWANEPWAWDGTE-CVEARBPZSA-N 1 1 347.415 2.038 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2C[C@H](C3CC3)[C@@H]2C2CC2)c1 ZINC000453030448 243377300 /nfs/dbraw/zinc/37/73/00/243377300.db2.gz HDSZHIVUEBHONC-NXHRZFHOSA-N 1 1 332.400 2.455 20 5 EEBDMO C[C@H](C[NH+]1CCN(c2ccccn2)CC1)Nc1ncccc1[N+](=O)[O-] ZINC000265288532 247373733 /nfs/dbraw/zinc/37/37/33/247373733.db2.gz AFJSDAMOBOYJSY-CQSZACIVSA-N 1 1 342.403 2.007 20 5 EEBDMO C[C@@H](c1ccccc1Cl)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266609197 248381681 /nfs/dbraw/zinc/38/16/81/248381681.db2.gz QUQNQRHSLRPDIX-WCQYABFASA-N 1 1 338.795 2.499 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)c1cc(F)c([N+](=O)[O-])cc1F)c1ccco1 ZINC000153485578 224111456 /nfs/dbraw/zinc/11/14/56/224111456.db2.gz WFYWTTYYNBDOGL-ZDUSSCGKSA-N 1 1 339.298 2.499 20 5 EEBDMO COCCOC[C@H]1CC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184224399 533134662 /nfs/dbraw/zinc/13/46/62/533134662.db2.gz HYESVMDNEKXXBQ-LBPRGKRZSA-N 1 1 342.367 2.227 20 5 EEBDMO C[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000267472823 256062708 /nfs/dbraw/zinc/06/27/08/256062708.db2.gz PBDFYZODOUQZGR-SNVBAGLBSA-N 1 1 342.193 2.181 20 5 EEBDMO CCOC(=O)c1ccnc(N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000268140435 256117944 /nfs/dbraw/zinc/11/79/44/256117944.db2.gz KEKSSDATBGCSBG-GWCFXTLKSA-N 1 1 334.376 2.061 20 5 EEBDMO O=[N+]([O-])c1cccnc1NCc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000273233432 256278569 /nfs/dbraw/zinc/27/85/69/256278569.db2.gz SAGKNBCRDZDLOL-HNNXBMFYSA-N 1 1 328.372 2.169 20 5 EEBDMO CC(C)[NH+]1CC(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000276454189 256433947 /nfs/dbraw/zinc/43/39/47/256433947.db2.gz CEJDGWHMYSLBAY-UHFFFAOYSA-N 1 1 346.431 2.020 20 5 EEBDMO CCOC(=O)[C@@H]1CCC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000120567622 142392933 /nfs/dbraw/zinc/39/29/33/142392933.db2.gz RUQHAFSWULMHOJ-HNNXBMFYSA-N 1 1 349.387 2.259 20 5 EEBDMO CCOC(=O)[C@@H]1CCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000120567622 142392935 /nfs/dbraw/zinc/39/29/35/142392935.db2.gz RUQHAFSWULMHOJ-HNNXBMFYSA-N 1 1 349.387 2.259 20 5 EEBDMO C[NH+](C)CCOc1cccc(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)c1 ZINC000356005739 153240571 /nfs/dbraw/zinc/24/05/71/153240571.db2.gz UEAYAECBYVBJEG-UHFFFAOYSA-N 1 1 345.355 2.493 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000245200341 160229886 /nfs/dbraw/zinc/22/98/86/160229886.db2.gz AGKKRPXZQDQJEM-FRRDWIJNSA-N 1 1 335.404 2.481 20 5 EEBDMO CC[C@H](CSC)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248439230 160346002 /nfs/dbraw/zinc/34/60/02/160346002.db2.gz CILNNGYMHAGBKT-CHWSQXEVSA-N 1 1 328.434 2.408 20 5 EEBDMO CCNC(=O)[C@@H](C)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000338714683 160797277 /nfs/dbraw/zinc/79/72/77/160797277.db2.gz VKPLKLOPKZITFY-LLVKDONJSA-N 1 1 347.371 2.478 20 5 EEBDMO NC(=O)c1cccc(NCC[N@@H+]2CCc3sccc3C2)c1[N+](=O)[O-] ZINC000341836052 161017355 /nfs/dbraw/zinc/01/73/55/161017355.db2.gz CREHSYRDJZVYHW-UHFFFAOYSA-N 1 1 346.412 2.225 20 5 EEBDMO NC(=O)c1cccc(NCC[N@H+]2CCc3sccc3C2)c1[N+](=O)[O-] ZINC000341836052 161017356 /nfs/dbraw/zinc/01/73/56/161017356.db2.gz CREHSYRDJZVYHW-UHFFFAOYSA-N 1 1 346.412 2.225 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000341943926 161026138 /nfs/dbraw/zinc/02/61/38/161026138.db2.gz OMRSDAZXEZHKOY-ZDUSSCGKSA-N 1 1 343.449 2.302 20 5 EEBDMO C[C@H]1[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CCC[N@H+]1C ZINC000343483843 161140256 /nfs/dbraw/zinc/14/02/56/161140256.db2.gz FDHYRIHVJSVGQI-IINYFYTJSA-N 1 1 325.796 2.390 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3C[C@@H]4CC[C@@H](O)[C@@H]4C3)co2)cc1 ZINC000344062287 161194756 /nfs/dbraw/zinc/19/47/56/161194756.db2.gz NDRJKEKROGIXGQ-APHBMKBZSA-N 1 1 329.356 2.453 20 5 EEBDMO CCC[C@@]1(CO)CC[N@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000344244594 161210810 /nfs/dbraw/zinc/21/08/10/161210810.db2.gz GBDXFMXYZGYOGL-QGZVFWFLSA-N 1 1 335.404 2.326 20 5 EEBDMO CCC[C@@]1(CO)CC[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000344244594 161210811 /nfs/dbraw/zinc/21/08/11/161210811.db2.gz GBDXFMXYZGYOGL-QGZVFWFLSA-N 1 1 335.404 2.326 20 5 EEBDMO CN(CC(=O)NC[C@@H]1[N@@H+](C)CCCC1(C)C)c1ccccc1[N+](=O)[O-] ZINC000344700170 161237429 /nfs/dbraw/zinc/23/74/29/161237429.db2.gz HCOWEAFHLCOCBL-INIZCTEOSA-N 1 1 348.447 2.268 20 5 EEBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)COCc1ccco1 ZINC000352543398 162180288 /nfs/dbraw/zinc/18/02/88/162180288.db2.gz DXZCWXIJCLGTBY-OAHLLOKOSA-N 1 1 334.372 2.240 20 5 EEBDMO COC(=O)COc1ccc(C[N@H+](C)Cc2cccn2C)cc1[N+](=O)[O-] ZINC000355730968 163284785 /nfs/dbraw/zinc/28/47/85/163284785.db2.gz QHZPYIOSSCATOI-UHFFFAOYSA-N 1 1 347.371 2.117 20 5 EEBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2cccn2C)cc1[N+](=O)[O-] ZINC000355730968 163284788 /nfs/dbraw/zinc/28/47/88/163284788.db2.gz QHZPYIOSSCATOI-UHFFFAOYSA-N 1 1 347.371 2.117 20 5 EEBDMO CCn1nc(C)c([N+](=O)[O-])c1NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000358916328 164014966 /nfs/dbraw/zinc/01/49/66/164014966.db2.gz SKQNIZOIBVFYQQ-GFCCVEGCSA-N 1 1 325.413 2.032 20 5 EEBDMO Cc1c(CNC(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000359210890 164083596 /nfs/dbraw/zinc/08/35/96/164083596.db2.gz DVDSLTUHXRRQNW-SMDDNHRTSA-N 1 1 332.404 2.328 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[NH2+][C@@H](CO)c2c(Cl)cccc2Cl)c1 ZINC000361532035 164460441 /nfs/dbraw/zinc/46/04/41/164460441.db2.gz VMHBQJIOBVQOEW-LBPRGKRZSA-N 1 1 345.186 2.421 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000274904264 269072254 /nfs/dbraw/zinc/07/22/54/269072254.db2.gz QWQIHFAHLAZVKT-LBPRGKRZSA-N 1 1 336.392 2.080 20 5 EEBDMO C[C@@H]1C[N@H+](CCCNc2c3c(ccc2[N+](=O)[O-])NCC3)C[C@H](C)O1 ZINC000275405074 269113642 /nfs/dbraw/zinc/11/36/42/269113642.db2.gz RSWKSTRHQRNQGF-BETUJISGSA-N 1 1 334.420 2.474 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(CCCC[NH+]3CCOCC3)n2)s1 ZINC000278318861 269223626 /nfs/dbraw/zinc/22/36/26/269223626.db2.gz YTHQYURHTYOCKH-UHFFFAOYSA-N 1 1 338.389 2.361 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)c1 ZINC000282882615 269520041 /nfs/dbraw/zinc/52/00/41/269520041.db2.gz RHIMRILIVIKAIR-SWLSCSKDSA-N 1 1 335.404 2.452 20 5 EEBDMO CO[C@@H]1CCC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000374644444 274062822 /nfs/dbraw/zinc/06/28/22/274062822.db2.gz HCFABYTXBXWFHZ-HZPDHXFCSA-N 1 1 333.388 2.201 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2CO)nc1 ZINC000269101306 274109880 /nfs/dbraw/zinc/10/98/80/274109880.db2.gz RVOMCYGHAIEDEW-WBVHZDCISA-N 1 1 342.399 2.285 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCOCCCOC ZINC000271498539 274136752 /nfs/dbraw/zinc/13/67/52/274136752.db2.gz CQZODFYQGIDFLC-UHFFFAOYSA-N 1 1 326.393 2.478 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCOCCCOC ZINC000271498539 274136754 /nfs/dbraw/zinc/13/67/54/274136754.db2.gz CQZODFYQGIDFLC-UHFFFAOYSA-N 1 1 326.393 2.478 20 5 EEBDMO O=[N+]([O-])c1cnc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)nc1 ZINC000278566155 274374211 /nfs/dbraw/zinc/37/42/11/274374211.db2.gz BKRABOVCIUFKIJ-UHFFFAOYSA-N 1 1 328.376 2.302 20 5 EEBDMO Cc1cnn([C@H]2CC[N@@H+]([C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000289988887 275168354 /nfs/dbraw/zinc/16/83/54/275168354.db2.gz SFWQVJDVSVCGKY-CJNGLKHVSA-N 1 1 343.387 2.374 20 5 EEBDMO Cc1cnn([C@H]2CC[N@H+]([C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000289988887 275168356 /nfs/dbraw/zinc/16/83/56/275168356.db2.gz SFWQVJDVSVCGKY-CJNGLKHVSA-N 1 1 343.387 2.374 20 5 EEBDMO CC[N@@H+](CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])C[C@@H](C)OC ZINC000291223921 275283898 /nfs/dbraw/zinc/28/38/98/275283898.db2.gz LSXCRVSCJGBVSW-GFCCVEGCSA-N 1 1 339.392 2.289 20 5 EEBDMO C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)C1([NH+]2CCOCC2)CCCC1 ZINC000173179675 278330782 /nfs/dbraw/zinc/33/07/82/278330782.db2.gz MAJFUBPPLYHBGD-CQSZACIVSA-N 1 1 347.415 2.358 20 5 EEBDMO COc1ccc(C[NH2+][C@]2(CO)CCOc3ccccc32)cc1[N+](=O)[O-] ZINC000281602258 292769741 /nfs/dbraw/zinc/76/97/41/292769741.db2.gz FXLCYYJHFFZKOA-SFHVURJKSA-N 1 1 344.367 2.363 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[NH2+]Cc2ccccc21 ZINC000261627963 301432026 /nfs/dbraw/zinc/43/20/26/301432026.db2.gz GXXDQNNSYIJOBI-UHFFFAOYSA-N 1 1 347.396 2.202 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](O)[C@@H](CO)C3)s2)cc1 ZINC000414551435 313039068 /nfs/dbraw/zinc/03/90/68/313039068.db2.gz BDAJAAMZVUNXOI-CZUORRHYSA-N 1 1 348.424 2.498 20 5 EEBDMO [NH3+]C[C@H]1CN(C/C=C/c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414780886 313086570 /nfs/dbraw/zinc/08/65/70/313086570.db2.gz MCFQOWUAFCSWIU-WMHVBEDNSA-N 1 1 331.416 2.295 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CCO)CC1 ZINC000421025304 314029548 /nfs/dbraw/zinc/02/95/48/314029548.db2.gz YJHSHZXMXRFSTP-UONOGXRCSA-N 1 1 335.404 2.406 20 5 EEBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)CCCNc3ccc([N+](=O)[O-])cc3)[C@@H]2C1 ZINC000425041446 314326999 /nfs/dbraw/zinc/32/69/99/314326999.db2.gz BXVUHQPQUCADGY-WMLDXEAASA-N 1 1 346.431 2.340 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000576574432 320184200 /nfs/dbraw/zinc/18/42/00/320184200.db2.gz KRJUDWJHQMRUMQ-CYBMUJFWSA-N 1 1 331.376 2.171 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000578480022 320316409 /nfs/dbraw/zinc/31/64/09/320316409.db2.gz HVTPZFRXNAKHJY-YOEHRIQHSA-N 1 1 349.431 2.171 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@H](CNC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)C1 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ZINC000068203705 463104904 /nfs/dbraw/zinc/10/49/04/463104904.db2.gz UKJMALMRLYYNPW-NVXWUHKLSA-N 1 1 342.399 2.293 20 5 EEBDMO CNC(=O)c1ccc(NCC[NH+]2Cc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000068321465 463119867 /nfs/dbraw/zinc/11/98/67/463119867.db2.gz AHGRBUDWBRSICR-UHFFFAOYSA-N 1 1 340.383 2.382 20 5 EEBDMO CC1CC[NH+](CCn2cc(Br)cc([N+](=O)[O-])c2=O)CC1 ZINC000158274851 463222663 /nfs/dbraw/zinc/22/26/63/463222663.db2.gz LMKYMLKLAOZZJU-UHFFFAOYSA-N 1 1 344.209 2.251 20 5 EEBDMO Cc1ccc(NC(=O)N2CC[NH+](C[C@@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000069462667 463252550 /nfs/dbraw/zinc/25/25/50/463252550.db2.gz ZTFAYYHAFROORW-HNNXBMFYSA-N 1 1 348.403 2.232 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@H](C)[C@H]1C ZINC000139301938 463321329 /nfs/dbraw/zinc/32/13/29/463321329.db2.gz XVAQEBDIAWTTKH-VXGBXAGGSA-N 1 1 337.376 2.041 20 5 EEBDMO C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)c2n[nH]cc2[N+](=O)[O-])CC1 ZINC000160239295 463324108 /nfs/dbraw/zinc/32/41/08/463324108.db2.gz 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O=c1ccn(Cc2cn3cc(Br)ccc3[nH+]2)cc1[N+](=O)[O-] ZINC000084494091 463607516 /nfs/dbraw/zinc/60/75/16/463607516.db2.gz IFZBMRXKXWPJSO-UHFFFAOYSA-N 1 1 349.144 2.215 20 5 EEBDMO NC(=O)N1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000126766794 463662046 /nfs/dbraw/zinc/66/20/46/463662046.db2.gz DFLXCPQRLFJGOB-UHFFFAOYSA-N 1 1 344.371 2.441 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@H](C)C1 ZINC000127295170 463694676 /nfs/dbraw/zinc/69/46/76/463694676.db2.gz JBIAAHJKHQWBST-IAQYHMDHSA-N 1 1 345.403 2.273 20 5 EEBDMO CC[N@@H+]1CC[C@@H](N(C)C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@H](C)C1 ZINC000127295170 463694680 /nfs/dbraw/zinc/69/46/80/463694680.db2.gz JBIAAHJKHQWBST-IAQYHMDHSA-N 1 1 345.403 2.273 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@H](C)C1 ZINC000127295170 463694681 /nfs/dbraw/zinc/69/46/81/463694681.db2.gz JBIAAHJKHQWBST-IAQYHMDHSA-N 1 1 345.403 2.273 20 5 EEBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]1CN1CCOCC1 ZINC000255897264 463752651 /nfs/dbraw/zinc/75/26/51/463752651.db2.gz VNDUMGOMTHETNG-SVEBXFOSSA-N 1 1 331.416 2.405 20 5 EEBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000177790979 463792917 /nfs/dbraw/zinc/79/29/17/463792917.db2.gz OPZOCLAZFFSWBC-MRXNPFEDSA-N 1 1 329.404 2.392 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000177795979 463794179 /nfs/dbraw/zinc/79/41/79/463794179.db2.gz LYCYZYFBDJOFFN-HIFRSBDPSA-N 1 1 333.388 2.059 20 5 EEBDMO C[N@H+](Cc1ccc([S@@](C)=O)cc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269626910 464039801 /nfs/dbraw/zinc/03/98/01/464039801.db2.gz CYIIYKWTZFLFDH-MZNJEOGPSA-N 1 1 348.424 2.498 20 5 EEBDMO CC(C)[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)N1CCN(C)CC1 ZINC000283919566 464041916 /nfs/dbraw/zinc/04/19/16/464041916.db2.gz DOYMWDNHKIYORY-KSSFIOAISA-N 1 1 349.479 2.100 20 5 EEBDMO C[C@@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C(C)(C)C[NH+](C)C ZINC000173044695 464183155 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EEBDMO Cc1cc(OCC(=O)N(C)[C@@H]2CC[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000281716870 464558210 /nfs/dbraw/zinc/55/82/10/464558210.db2.gz QKTPGGGUCJPJBD-UKRRQHHQSA-N 1 1 335.404 2.081 20 5 EEBDMO CC(C)(O)C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000189915308 464562206 /nfs/dbraw/zinc/56/22/06/464562206.db2.gz XQTJFOGIBWGHBR-UHFFFAOYSA-N 1 1 332.360 2.380 20 5 EEBDMO CC(C)(O)C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000189915308 464562214 /nfs/dbraw/zinc/56/22/14/464562214.db2.gz XQTJFOGIBWGHBR-UHFFFAOYSA-N 1 1 332.360 2.380 20 5 EEBDMO CCOC1CC2(C1)CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000285526565 464595895 /nfs/dbraw/zinc/59/58/95/464595895.db2.gz PJMPWFRJMGVYIT-UHFFFAOYSA-N 1 1 333.388 2.424 20 5 EEBDMO CCOC1CC2(C1)CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000285526565 464595900 /nfs/dbraw/zinc/59/59/00/464595900.db2.gz PJMPWFRJMGVYIT-UHFFFAOYSA-N 1 1 333.388 2.424 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1CCCC[C@H]1O 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20 5 EEBDMO CC1(C)CN(C(=O)C2CC2)CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000611462953 469254442 /nfs/dbraw/zinc/25/44/42/469254442.db2.gz QOHFRFKLYBFJCV-UHFFFAOYSA-N 1 1 347.415 2.306 20 5 EEBDMO COCCC1CC[NH+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000599507178 469279324 /nfs/dbraw/zinc/27/93/24/469279324.db2.gz RLROJHSSEWSWLU-UHFFFAOYSA-N 1 1 347.415 2.232 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCCC(F)(F)CC2)c1 ZINC000599551030 469290230 /nfs/dbraw/zinc/29/02/30/469290230.db2.gz FIFSRFVVZDWMNE-ZDUSSCGKSA-N 1 1 330.331 2.456 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H](CCO)C3)o2)cc1 ZINC000609204394 469902799 /nfs/dbraw/zinc/90/27/99/469902799.db2.gz MEWHPZUJMOHKLM-LBPRGKRZSA-N 1 1 332.360 2.239 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](CCO)C3)o2)cc1 ZINC000609204394 469902805 /nfs/dbraw/zinc/90/28/05/469902805.db2.gz MEWHPZUJMOHKLM-LBPRGKRZSA-N 1 1 332.360 2.239 20 5 EEBDMO COCC[N@H+]1CCC[C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000609268806 469912050 /nfs/dbraw/zinc/91/20/50/469912050.db2.gz CIHNLJFQCOXPKC-ZDUSSCGKSA-N 1 1 347.371 2.182 20 5 EEBDMO CCN1CCN(C[C@@H](C)C[NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000602539485 485643103 /nfs/dbraw/zinc/64/31/03/485643103.db2.gz GTCXYRJGIOHPHY-INIZCTEOSA-N 1 1 334.464 2.001 20 5 EEBDMO C[C@@H]1CCCC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000187925453 534154532 /nfs/dbraw/zinc/15/45/32/534154532.db2.gz VRUNMQFLRAGJEN-LLVKDONJSA-N 1 1 335.360 2.384 20 5 EEBDMO C[C@@H]1CCCC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000187925453 534154534 /nfs/dbraw/zinc/15/45/34/534154534.db2.gz VRUNMQFLRAGJEN-LLVKDONJSA-N 1 1 335.360 2.384 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 ZINC000158044150 534162765 /nfs/dbraw/zinc/16/27/65/534162765.db2.gz UQDCIECYEULPST-OLZOCXBDSA-N 1 1 335.408 2.045 20 5 EEBDMO O=C(C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)N1CCCCC1 ZINC000174242946 534521331 /nfs/dbraw/zinc/52/13/31/534521331.db2.gz VAMIFFKGVDFXOC-UHFFFAOYSA-N 1 1 347.415 2.451 20 5 EEBDMO CCN1CCN([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3C)C2)CC1 ZINC000183330728 529152604 /nfs/dbraw/zinc/15/26/04/529152604.db2.gz YOAKQRWELATFQE-SFHVURJKSA-N 1 1 332.448 2.115 20 5 EEBDMO CCN1CCN([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3C)C2)CC1 ZINC000183330728 529152605 /nfs/dbraw/zinc/15/26/05/529152605.db2.gz YOAKQRWELATFQE-SFHVURJKSA-N 1 1 332.448 2.115 20 5 EEBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)[C@@H]2C1 ZINC000425060101 536487737 /nfs/dbraw/zinc/48/77/37/536487737.db2.gz UKKJARSXGXILKQ-XJKSGUPXSA-N 1 1 331.416 2.425 20 5 EEBDMO C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@@H+]1C ZINC000748349533 577959895 /nfs/dbraw/zinc/95/98/95/577959895.db2.gz OJFQZCPXNIFXID-VIFPVBQESA-N 1 1 342.193 2.133 20 5 EEBDMO C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1C ZINC000748349533 577959896 /nfs/dbraw/zinc/95/98/96/577959896.db2.gz OJFQZCPXNIFXID-VIFPVBQESA-N 1 1 342.193 2.133 20 5 EEBDMO Cc1cn2cc(Nc3ccc(-c4nn[nH]n4)cc3[N+](=O)[O-])ccc2[nH+]1 ZINC000737445855 578258204 /nfs/dbraw/zinc/25/82/04/578258204.db2.gz KSGHXUDPVNHAJV-UHFFFAOYSA-N 1 1 336.315 2.475 20 5 EEBDMO COc1c(O)ccc(C[N@@H+](C)C[C@@H](O)Cc2ccccc2)c1[N+](=O)[O-] ZINC000894604813 682985531 /nfs/dbraw/zinc/98/55/31/682985531.db2.gz GVCQNMQIGSYVAH-HNNXBMFYSA-N 1 1 346.383 2.344 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000892899024 683177106 /nfs/dbraw/zinc/17/71/06/683177106.db2.gz IJVCLTFXNJTLBW-BXUZGUMPSA-N 1 1 342.399 2.341 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCC1CCCC1 ZINC001029304616 683939784 /nfs/dbraw/zinc/93/97/84/683939784.db2.gz BUXOKPPCGAOODX-YYIAUSFCSA-N 1 1 335.448 2.297 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@H+]2CCCC1CCCC1 ZINC001029304616 683939787 /nfs/dbraw/zinc/93/97/87/683939787.db2.gz BUXOKPPCGAOODX-YYIAUSFCSA-N 1 1 335.448 2.297 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCC1CCCC1 ZINC001029304616 683939791 /nfs/dbraw/zinc/93/97/91/683939791.db2.gz BUXOKPPCGAOODX-YYIAUSFCSA-N 1 1 335.448 2.297 20 5 EEBDMO COc1c(O)ccc(CN[C@H]2CCC[N@@H+]3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000895228252 684311295 /nfs/dbraw/zinc/31/12/95/684311295.db2.gz XGHUCQYDHCCBKR-UONOGXRCSA-N 1 1 335.404 2.416 20 5 EEBDMO COc1c(O)ccc(CN[C@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000895228252 684311298 /nfs/dbraw/zinc/31/12/98/684311298.db2.gz XGHUCQYDHCCBKR-UONOGXRCSA-N 1 1 335.404 2.416 20 5 EEBDMO C[C@H](Nc1nccc2c1cccc2[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C ZINC000895245607 684372159 /nfs/dbraw/zinc/37/21/59/684372159.db2.gz GVYYFUCJRCWUQB-BLLLJJGKSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1nccc2c1cccc2[N+](=O)[O-])[C@H]1CN(C)CC[N@@H+]1C ZINC000895245607 684372167 /nfs/dbraw/zinc/37/21/67/684372167.db2.gz GVYYFUCJRCWUQB-BLLLJJGKSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1nccc2c1cccc2[N+](=O)[O-])[C@H]1CN(C)CC[N@H+]1C ZINC000895245607 684372172 /nfs/dbraw/zinc/37/21/72/684372172.db2.gz GVYYFUCJRCWUQB-BLLLJJGKSA-N 1 1 329.404 2.189 20 5 EEBDMO O=[N+]([O-])c1c(NCC[N@@H+]2CCC3(C2)OCCO3)ccc2ncccc21 ZINC000895254657 684394588 /nfs/dbraw/zinc/39/45/88/684394588.db2.gz WLPCTXWGNSBZSM-UHFFFAOYSA-N 1 1 344.371 2.004 20 5 EEBDMO O=[N+]([O-])c1c(NCC[N@H+]2CCC3(C2)OCCO3)ccc2ncccc21 ZINC000895254657 684394591 /nfs/dbraw/zinc/39/45/91/684394591.db2.gz WLPCTXWGNSBZSM-UHFFFAOYSA-N 1 1 344.371 2.004 20 5 EEBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCN(C(=O)c2cn[nH]c2)CC1 ZINC000985292149 686243858 /nfs/dbraw/zinc/24/38/58/686243858.db2.gz ZOJDTYGUDAOJSL-UHFFFAOYSA-N 1 1 343.387 2.055 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)N[C@@H]1C[C@H](Nc2ccc(C)cc2[N+](=O)[O-])C1 ZINC001059647065 687693469 /nfs/dbraw/zinc/69/34/69/687693469.db2.gz GUCUPPKRDLLXLB-OKILXGFUSA-N 1 1 343.387 2.167 20 5 EEBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1C[C@@H]2COC[C@@H]2C1 ZINC000872321262 1198146941 /nfs/dbraw/zinc/14/69/41/1198146941.db2.gz VFHSRLZBTSMDPF-GARJFASQSA-N 1 1 339.779 2.153 20 5 EEBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1C[C@@H]2COC[C@@H]2C1 ZINC000872321262 1198146945 /nfs/dbraw/zinc/14/69/45/1198146945.db2.gz VFHSRLZBTSMDPF-GARJFASQSA-N 1 1 339.779 2.153 20 5 EEBDMO CC(C)(O)[C@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000877796315 1200114274 /nfs/dbraw/zinc/11/42/74/1200114274.db2.gz COGGIKTXJJVUPO-ZDUSSCGKSA-N 1 1 336.388 2.349 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCCOC(F)(F)F)C2)nc1 ZINC000878251472 1200354133 /nfs/dbraw/zinc/35/41/33/1200354133.db2.gz MVAIFEGSAZQUQG-SNVBAGLBSA-N 1 1 334.298 2.403 20 5 EEBDMO O=C(c1csc([N+](=O)[O-])c1)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC000870083359 1200452111 /nfs/dbraw/zinc/45/21/11/1200452111.db2.gz SKSPVVGVLMLABC-ZDUSSCGKSA-N 1 1 333.369 2.149 20 5 EEBDMO Cc1nn(C[N@@H+]2CC[C@@H](n3cccn3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000812296142 1200645989 /nfs/dbraw/zinc/64/59/89/1200645989.db2.gz LIAPCNWEWDJTBM-CQSZACIVSA-N 1 1 326.360 2.354 20 5 EEBDMO Cc1nn(C[N@H+]2CC[C@@H](n3cccn3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000812296142 1200645994 /nfs/dbraw/zinc/64/59/94/1200645994.db2.gz LIAPCNWEWDJTBM-CQSZACIVSA-N 1 1 326.360 2.354 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@@H](CF)C1 ZINC000880293972 1201449455 /nfs/dbraw/zinc/44/94/55/1201449455.db2.gz GKVFFYGZHQYGDH-QWRGUYRKSA-N 1 1 325.340 2.222 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@@H](CF)C1 ZINC000880293972 1201449457 /nfs/dbraw/zinc/44/94/57/1201449457.db2.gz GKVFFYGZHQYGDH-QWRGUYRKSA-N 1 1 325.340 2.222 20 5 EEBDMO C[C@]([NH3+])(C(=O)N1CCc2cc(F)ccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000867977421 1201718229 /nfs/dbraw/zinc/71/82/29/1201718229.db2.gz GYNJPWBFSXAENU-GOSISDBHSA-N 1 1 343.358 2.493 20 5 EEBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NCC[N@H+]1CCC(C)(C)C1 ZINC000890072308 1204777295 /nfs/dbraw/zinc/77/72/95/1204777295.db2.gz QRIFOLNLPUAXKM-UHFFFAOYSA-N 1 1 335.404 2.455 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC1CCN(c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC001095427628 1205736896 /nfs/dbraw/zinc/73/68/96/1205736896.db2.gz MFKWUKXECRCRCI-UHFFFAOYSA-N 1 1 348.447 2.330 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NCCCN(C)c1ccc(F)cc1[N+](=O)[O-] ZINC001095574726 1205878609 /nfs/dbraw/zinc/87/86/09/1205878609.db2.gz LEYJKUZRLGNTRH-UHFFFAOYSA-N 1 1 340.399 2.017 20 5 EEBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1C ZINC000928556472 1206398741 /nfs/dbraw/zinc/39/87/41/1206398741.db2.gz PQSMLEOGHXAGAI-SECBINFHSA-N 1 1 342.193 2.100 20 5 EEBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@@H+]1C ZINC000928556472 1206398743 /nfs/dbraw/zinc/39/87/43/1206398743.db2.gz PQSMLEOGHXAGAI-SECBINFHSA-N 1 1 342.193 2.100 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2C[C@@H](Cc3ccccc3)[C@H](O)C2)cc1 ZINC000934435116 1207962976 /nfs/dbraw/zinc/96/29/76/1207962976.db2.gz BBCNTUQLGJXHHI-BHIYHBOVSA-N 1 1 342.395 2.164 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000778289044 1208070303 /nfs/dbraw/zinc/07/03/03/1208070303.db2.gz JPPNEPCNYFPVAN-CMPLNLGQSA-N 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LVNNCNPJOFWADU-UHFFFAOYSA-N 1 1 334.420 2.387 20 5 EEBDMO O=C1OCCN1C[C@H]1CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000495964675 247243453 /nfs/dbraw/zinc/24/34/53/247243453.db2.gz YQDHWYZKIIAEOG-KQIUPUNMSA-N 1 1 331.372 2.382 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@H+](CCCO)[C@H]2CCc3ccccc32)n1 ZINC000176242728 285167961 /nfs/dbraw/zinc/16/79/61/285167961.db2.gz IZIJGMURXRZLEC-INIZCTEOSA-N 1 1 330.388 2.163 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1[C@H](C)CCC[C@H]1CO ZINC000270408849 256132505 /nfs/dbraw/zinc/13/25/05/256132505.db2.gz DLYXGTJSRPOBEL-HIFRSBDPSA-N 1 1 335.404 2.467 20 5 EEBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1n1ccnc1 ZINC000271216618 256221036 /nfs/dbraw/zinc/22/10/36/256221036.db2.gz IZSJPDVFOPQCQD-XYPHTWIQSA-N 1 1 330.388 2.408 20 5 EEBDMO C[N@H+]1CCC[C@@H]1CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000119367091 221305028 /nfs/dbraw/zinc/30/50/28/221305028.db2.gz JBUPGYGERHLDCX-MRXNPFEDSA-N 1 1 332.404 2.363 20 5 EEBDMO CC(C)[C@@H](C(=O)NCc1cccc([N+](=O)[O-])c1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000067593900 292159697 /nfs/dbraw/zinc/15/96/97/292159697.db2.gz LUILOBRYLKNYKI-CPUCHLNUSA-N 1 1 349.431 2.345 20 5 EEBDMO C[C@H]([NH2+]C1CCN(CCC(=O)N(C)C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000361346049 153518814 /nfs/dbraw/zinc/51/88/14/153518814.db2.gz LZYHOXCEJJZHKO-AWEZNQCLSA-N 1 1 348.447 2.188 20 5 EEBDMO CC[N@@H+](C)CCNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000066949222 159005533 /nfs/dbraw/zinc/00/55/33/159005533.db2.gz CYZHAESVWWTMAU-UHFFFAOYSA-N 1 1 349.309 2.217 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C1CCC(CO)CC1 ZINC000089924579 159188846 /nfs/dbraw/zinc/18/88/46/159188846.db2.gz YOOZPQVJGMADPG-UHFFFAOYSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC000246728249 160291568 /nfs/dbraw/zinc/29/15/68/160291568.db2.gz OMHYFLJOQZKFFW-DVOMOZLQSA-N 1 1 333.388 2.423 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2OCCC[C@H]2C1 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/nfs/dbraw/zinc/17/52/98/161175298.db2.gz LHZOAWBUQWQCHW-ZDUSSCGKSA-N 1 1 329.360 2.080 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C1CCC(NC(C)=O)CC1 ZINC000344102185 161198476 /nfs/dbraw/zinc/19/84/76/161198476.db2.gz DZJVUSZIWFNEFB-UHFFFAOYSA-N 1 1 335.404 2.483 20 5 EEBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)[C@@H](C)C1 ZINC000344450129 161228759 /nfs/dbraw/zinc/22/87/59/161228759.db2.gz LNXCRNFXZDEALG-OKILXGFUSA-N 1 1 335.404 2.223 20 5 EEBDMO CCC[N@@H+](CC)C[C@H](C)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000352574659 162195054 /nfs/dbraw/zinc/19/50/54/162195054.db2.gz IORNMOVYOKYPPF-ZDUSSCGKSA-N 1 1 343.449 2.302 20 5 EEBDMO C[NH+](C)Cc1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000356257384 163383220 /nfs/dbraw/zinc/38/32/20/163383220.db2.gz CTIZGMSHLYLESD-UHFFFAOYSA-N 1 1 335.385 2.457 20 5 EEBDMO COC[C@@](C)(CC(=O)OC)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000360027552 164219688 /nfs/dbraw/zinc/21/96/88/164219688.db2.gz LJBAUFLICSCPLG-CQSZACIVSA-N 1 1 330.768 2.306 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000365073184 165370147 /nfs/dbraw/zinc/37/01/47/165370147.db2.gz QUVQYLKCELLONL-KGLIPLIRSA-N 1 1 348.403 2.196 20 5 EEBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1CCc1ccc([N+](=O)[O-])cc1 ZINC000369626553 166299479 /nfs/dbraw/zinc/29/94/79/166299479.db2.gz BNNYYZIPQPQUFS-HNNXBMFYSA-N 1 1 333.432 2.322 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC2(CCC[N@H+]2C)CC1 ZINC000370651380 166504207 /nfs/dbraw/zinc/50/42/07/166504207.db2.gz PYXOALKYJCDBDJ-CQSZACIVSA-N 1 1 346.431 2.482 20 5 EEBDMO C[C@@H]1C[C@@H](N2CCCC2)C[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000375739332 167182405 /nfs/dbraw/zinc/18/24/05/167182405.db2.gz ZZMPZPYXZVCWRR-HUUCEWRRSA-N 1 1 346.431 2.482 20 5 EEBDMO C[C@@H]1C[C@@H](N2CCCC2)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000375739332 167182406 /nfs/dbraw/zinc/18/24/06/167182406.db2.gz ZZMPZPYXZVCWRR-HUUCEWRRSA-N 1 1 346.431 2.482 20 5 EEBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@H](O)C[C@@H]2CO)s1 ZINC000376297302 167299629 /nfs/dbraw/zinc/29/96/29/167299629.db2.gz YPWZCCCTMXKKQK-VXGBXAGGSA-N 1 1 334.397 2.251 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C2OCCO2)C1 ZINC000171376893 227049160 /nfs/dbraw/zinc/04/91/60/227049160.db2.gz AOOIURLLRQLEIC-STQMWFEESA-N 1 1 349.387 2.007 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C2OCCO2)C1 ZINC000171376893 227049163 /nfs/dbraw/zinc/04/91/63/227049163.db2.gz AOOIURLLRQLEIC-STQMWFEESA-N 1 1 349.387 2.007 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272585329 268995960 /nfs/dbraw/zinc/99/59/60/268995960.db2.gz SJGUQKGCVASYLT-UHFFFAOYSA-N 1 1 338.314 2.398 20 5 EEBDMO CCOc1cccc(N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000275435353 269115041 /nfs/dbraw/zinc/11/50/41/269115041.db2.gz FIERSVQYSWIGJI-ZDUSSCGKSA-N 1 1 337.420 2.275 20 5 EEBDMO CCCc1n[nH]c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-] ZINC000277624886 269164052 /nfs/dbraw/zinc/16/40/52/269164052.db2.gz WOHLGWCYWFNKHG-LBPRGKRZSA-N 1 1 335.408 2.017 20 5 EEBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCN(C)[C@@H](c2nccn2C)C1 ZINC000280220780 269339594 /nfs/dbraw/zinc/33/95/94/269339594.db2.gz VQFDTENXOVYACL-CZUORRHYSA-N 1 1 329.404 2.378 20 5 EEBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCN(C)[C@@H](c2nccn2C)C1 ZINC000280220780 269339595 /nfs/dbraw/zinc/33/95/95/269339595.db2.gz VQFDTENXOVYACL-CZUORRHYSA-N 1 1 329.404 2.378 20 5 EEBDMO CC(C)CC[C@@H](O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000280269815 269345122 /nfs/dbraw/zinc/34/51/22/269345122.db2.gz KSCBYRQOJBMRII-QGZVFWFLSA-N 1 1 349.431 2.150 20 5 EEBDMO COc1ccc(NC(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000272795980 274182843 /nfs/dbraw/zinc/18/28/43/274182843.db2.gz GYNFRDBNVNSGMK-OLZOCXBDSA-N 1 1 334.376 2.352 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](O)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000275423966 274246876 /nfs/dbraw/zinc/24/68/76/274246876.db2.gz HZKXEBGIUYKNEO-OAHLLOKOSA-N 1 1 335.404 2.325 20 5 EEBDMO C[N@H+]1CCC[C@@]2(CCN(c3ncnc4cccc([N+](=O)[O-])c43)C2)C1 ZINC000338747794 277073102 /nfs/dbraw/zinc/07/31/02/277073102.db2.gz VBFGCCHGVGYNNS-QGZVFWFLSA-N 1 1 327.388 2.460 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cnn(CC(F)F)c1 ZINC000292997009 293098340 /nfs/dbraw/zinc/09/83/40/293098340.db2.gz NMMDUYVSQNCLDV-UHFFFAOYSA-N 1 1 326.303 2.355 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCCO1 ZINC000293234344 293158115 /nfs/dbraw/zinc/15/81/15/293158115.db2.gz SJBYXHMKVKBOAC-WMLDXEAASA-N 1 1 338.404 2.081 20 5 EEBDMO CSC1(C[NH+]2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000294141684 293380665 /nfs/dbraw/zinc/38/06/65/293380665.db2.gz UXAILMWVSNWVLE-UHFFFAOYSA-N 1 1 335.429 2.248 20 5 EEBDMO O=C(Cn1c[nH+]c2c1CCCC2)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000296687977 294040719 /nfs/dbraw/zinc/04/07/19/294040719.db2.gz LTUJBRNCULJTNE-UHFFFAOYSA-N 1 1 344.327 2.038 20 5 EEBDMO CO[C@@H](C[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000298009313 294396085 /nfs/dbraw/zinc/39/60/85/294396085.db2.gz CDENXAMMFFQYDS-KRWDZBQOSA-N 1 1 342.399 2.500 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@H]1c1ccncc1 ZINC000423958157 301862556 /nfs/dbraw/zinc/86/25/56/301862556.db2.gz BOPOXSOCKOQQDN-INIZCTEOSA-N 1 1 326.356 2.085 20 5 EEBDMO COc1cc(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000161546202 311367684 /nfs/dbraw/zinc/36/76/84/311367684.db2.gz DYFGFWDQYKAEKW-ZDUSSCGKSA-N 1 1 335.404 2.454 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](CCO)CC1 ZINC000421008001 314022171 /nfs/dbraw/zinc/02/21/71/314022171.db2.gz CWLDZFIWVLDIDT-UONOGXRCSA-N 1 1 335.404 2.406 20 5 EEBDMO C[C@H]1C[C@@H](C(=O)OC(C)(C)C)C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC000421025491 314029284 /nfs/dbraw/zinc/02/92/84/314029284.db2.gz QXZLJVCZDCRGRN-QWHCGFSZSA-N 1 1 338.408 2.091 20 5 EEBDMO COc1cccc(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-] ZINC000444401275 315299671 /nfs/dbraw/zinc/29/96/71/315299671.db2.gz BHVXFPREKUCTMY-ZDUSSCGKSA-N 1 1 333.388 2.350 20 5 EEBDMO CCCNC(=O)[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444606269 315310370 /nfs/dbraw/zinc/31/03/70/315310370.db2.gz FMMJIOVRUOSTBO-GFCCVEGCSA-N 1 1 345.403 2.209 20 5 EEBDMO CCCNC(=O)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444606269 315310371 /nfs/dbraw/zinc/31/03/71/315310371.db2.gz FMMJIOVRUOSTBO-GFCCVEGCSA-N 1 1 345.403 2.209 20 5 EEBDMO CCCc1n[nH]c(C(=O)NCC[N@H+]2CCCC(C)(C)C2)c1[N+](=O)[O-] ZINC000444621018 315311519 /nfs/dbraw/zinc/31/15/19/315311519.db2.gz XUCZSMADWBHVKU-UHFFFAOYSA-N 1 1 337.424 2.122 20 5 EEBDMO C[NH+](C)[C@@H]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000448881522 315396642 /nfs/dbraw/zinc/39/66/42/315396642.db2.gz MBSXQPCLOZQQRO-CQSZACIVSA-N 1 1 343.387 2.151 20 5 EEBDMO CC(C)[C@@H](C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])N1CCN(C)CC1 ZINC000563417311 319008929 /nfs/dbraw/zinc/00/89/29/319008929.db2.gz LMMSKYNRNNTDIS-PKOBYXMFSA-N 1 1 346.475 2.444 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000580873739 324143303 /nfs/dbraw/zinc/14/33/03/324143303.db2.gz FPTCLKSWFBSILF-CQSZACIVSA-N 1 1 347.415 2.404 20 5 EEBDMO Cc1c(CNC(=O)NCC[N@@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000358549644 465187108 /nfs/dbraw/zinc/18/71/08/465187108.db2.gz ZHIHERJCWMQRRU-CYBMUJFWSA-N 1 1 334.420 2.434 20 5 EEBDMO COc1c(C(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000356323716 465312469 /nfs/dbraw/zinc/31/24/69/465312469.db2.gz YKPXASLTYVADEE-CYBMUJFWSA-N 1 1 335.404 2.311 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](N(C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000590663848 468299441 /nfs/dbraw/zinc/29/94/41/468299441.db2.gz VPHIWZLJDHRJBI-AWEZNQCLSA-N 1 1 335.404 2.281 20 5 EEBDMO C[NH+](C)C[C@H]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000590668219 468300263 /nfs/dbraw/zinc/30/02/63/468300263.db2.gz RCFYOGULZWQJHO-GFCCVEGCSA-N 1 1 343.387 2.009 20 5 EEBDMO O=[N+]([O-])c1cccc2c1ccnc2N1CC[NH+]([C@H]2CCOC2)CC1 ZINC000590694338 468309196 /nfs/dbraw/zinc/30/91/96/468309196.db2.gz CXRDGMHOLZFGGP-ZDUSSCGKSA-N 1 1 328.372 2.054 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000063695355 462662518 /nfs/dbraw/zinc/66/25/18/462662518.db2.gz PJPSEAKGOHVOGE-ZDUSSCGKSA-N 1 1 335.404 2.454 20 5 EEBDMO C[N@H+](CC(=O)NCCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000066050273 462849091 /nfs/dbraw/zinc/84/90/91/462849091.db2.gz NINUVJYAKQCGIB-UHFFFAOYSA-N 1 1 327.384 2.386 20 5 EEBDMO C[N@@H+](CC(=O)NCCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000066050273 462849094 /nfs/dbraw/zinc/84/90/94/462849094.db2.gz NINUVJYAKQCGIB-UHFFFAOYSA-N 1 1 327.384 2.386 20 5 EEBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000066140298 462854555 /nfs/dbraw/zinc/85/45/55/462854555.db2.gz GRWUDDMWBGZCCK-CYBMUJFWSA-N 1 1 332.404 2.396 20 5 EEBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)CC1CCOCC1 ZINC000155836114 462950059 /nfs/dbraw/zinc/95/00/59/462950059.db2.gz FKDYFYGEONSWHJ-UHFFFAOYSA-N 1 1 349.387 2.251 20 5 EEBDMO Cc1c(CC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)cccc1[N+](=O)[O-] ZINC000133652829 462955485 /nfs/dbraw/zinc/95/54/85/462955485.db2.gz FIJMYIUHYLETNY-WBVHZDCISA-N 1 1 331.416 2.388 20 5 EEBDMO C[C@@H]1COC[C@@H](C)[NH+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000120902119 463053088 /nfs/dbraw/zinc/05/30/88/463053088.db2.gz PRVUBQNBCMWWEJ-VXGBXAGGSA-N 1 1 335.360 2.002 20 5 EEBDMO Cc1cccc(NCCNC(=O)Cc2ccc([N+](=O)[O-])cc2F)[nH+]1 ZINC000157526895 463140501 /nfs/dbraw/zinc/14/05/01/463140501.db2.gz WAIRGUOKRGHTEZ-UHFFFAOYSA-N 1 1 332.335 2.208 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000069044898 463201985 /nfs/dbraw/zinc/20/19/85/463201985.db2.gz NGBNMRDTPAZFBM-AWEZNQCLSA-N 1 1 335.404 2.210 20 5 EEBDMO NC(=O)CC[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083170401 463537170 /nfs/dbraw/zinc/53/71/70/463537170.db2.gz AOTUSFZUKUBCKH-LLVKDONJSA-N 1 1 332.360 2.214 20 5 EEBDMO NC(=O)CC[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083170401 463537172 /nfs/dbraw/zinc/53/71/72/463537172.db2.gz AOTUSFZUKUBCKH-LLVKDONJSA-N 1 1 332.360 2.214 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000072860156 463555097 /nfs/dbraw/zinc/55/50/97/463555097.db2.gz QFAMFNACYIBEQA-CQSZACIVSA-N 1 1 334.420 2.115 20 5 EEBDMO CCCC[N@H+](CCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000072950565 463565566 /nfs/dbraw/zinc/56/55/66/463565566.db2.gz LNWFHSVWSUBLFD-UHFFFAOYSA-N 1 1 329.784 2.281 20 5 EEBDMO CCCC[N@@H+](CCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000072950565 463565570 /nfs/dbraw/zinc/56/55/70/463565570.db2.gz LNWFHSVWSUBLFD-UHFFFAOYSA-N 1 1 329.784 2.281 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000126231926 463618407 /nfs/dbraw/zinc/61/84/07/463618407.db2.gz AQYRGLVOMDKKAE-BZNIZROVSA-N 1 1 330.388 2.488 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)CC2(O)CCCC2)cccc1[N+](=O)[O-] ZINC000152268877 463669302 /nfs/dbraw/zinc/66/93/02/463669302.db2.gz VVKNXRNVPXWTAC-CYBMUJFWSA-N 1 1 335.404 2.467 20 5 EEBDMO CCCC[N@@H+](C)CCNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000112308910 463697180 /nfs/dbraw/zinc/69/71/80/463697180.db2.gz VENBHXTXFNTGQT-UHFFFAOYSA-N 1 1 339.392 2.074 20 5 EEBDMO CCOCC[N@@H+]1CCN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000255423629 463726136 /nfs/dbraw/zinc/72/61/36/463726136.db2.gz ZMYHYSPMZFLZJI-WHLNPGIBSA-N 1 1 347.415 2.177 20 5 EEBDMO CCOCC[N@H+]1CCN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000255423629 463726138 /nfs/dbraw/zinc/72/61/38/463726138.db2.gz ZMYHYSPMZFLZJI-WHLNPGIBSA-N 1 1 347.415 2.177 20 5 EEBDMO CCOC(=O)CC[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000178557710 463920657 /nfs/dbraw/zinc/92/06/57/463920657.db2.gz YXTCKRNDIAFOEZ-UHFFFAOYSA-N 1 1 343.767 2.072 20 5 EEBDMO CCOC(=O)CC[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000178557710 463920663 /nfs/dbraw/zinc/92/06/63/463920663.db2.gz YXTCKRNDIAFOEZ-UHFFFAOYSA-N 1 1 343.767 2.072 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000287565588 463929908 /nfs/dbraw/zinc/92/99/08/463929908.db2.gz QJNJJVNGMBWIAO-OCCSQVGLSA-N 1 1 343.387 2.101 20 5 EEBDMO Cn1ccnc1[C@H](O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000269284949 463940349 /nfs/dbraw/zinc/94/03/49/463940349.db2.gz QVMBUKVWXNLVHH-GDBMZVCRSA-N 1 1 330.388 2.274 20 5 EEBDMO COC(=O)C[C@H]1CCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000179148875 464068855 /nfs/dbraw/zinc/06/88/55/464068855.db2.gz GJLKIMPUCJVCBB-CYBMUJFWSA-N 1 1 346.343 2.172 20 5 EEBDMO COC(=O)C[C@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000179148875 464068858 /nfs/dbraw/zinc/06/88/58/464068858.db2.gz GJLKIMPUCJVCBB-CYBMUJFWSA-N 1 1 346.343 2.172 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CN(C)CC[N@@H+]1CCOC(C)(C)C1 ZINC000279658729 464122947 /nfs/dbraw/zinc/12/29/47/464122947.db2.gz CNKSIDQWVBVFMM-UHFFFAOYSA-N 1 1 337.420 2.146 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CN(C)CC[N@H+]1CCOC(C)(C)C1 ZINC000279658729 464122952 /nfs/dbraw/zinc/12/29/52/464122952.db2.gz CNKSIDQWVBVFMM-UHFFFAOYSA-N 1 1 337.420 2.146 20 5 EEBDMO O=C(CC[N@H+]1CCC[C@@H](C2OCCO2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000263640600 464136177 /nfs/dbraw/zinc/13/61/77/464136177.db2.gz ASVYJTUBESFKPO-CYBMUJFWSA-N 1 1 349.387 2.008 20 5 EEBDMO O=C(CC[N@H+]1CCC[C@H](C2OCCO2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000263640601 464136442 /nfs/dbraw/zinc/13/64/42/464136442.db2.gz ASVYJTUBESFKPO-ZDUSSCGKSA-N 1 1 349.387 2.008 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+](C)C[C@H]2CCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000270046756 464169340 /nfs/dbraw/zinc/16/93/40/464169340.db2.gz FAWCFJUOVBTGLJ-CJNGLKHVSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCOC2)O1 ZINC000280233153 464194699 /nfs/dbraw/zinc/19/46/99/464194699.db2.gz AMSWLISBYZEAGP-WMLDXEAASA-N 1 1 336.388 2.244 20 5 EEBDMO C[C@H](O)[C@@H]1CCCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000264391214 464308514 /nfs/dbraw/zinc/30/85/14/464308514.db2.gz FSEIQWXDBDQDAH-FZMZJTMJSA-N 1 1 332.360 2.380 20 5 EEBDMO C[C@H](O)[C@@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000264391214 464308517 /nfs/dbraw/zinc/30/85/17/464308517.db2.gz FSEIQWXDBDQDAH-FZMZJTMJSA-N 1 1 332.360 2.380 20 5 EEBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@H]1[C@@H](O)C(F)(F)F ZINC000264608181 464392117 /nfs/dbraw/zinc/39/21/17/464392117.db2.gz MSHRYNOFCIBZCN-WCQYABFASA-N 1 1 334.294 2.361 20 5 EEBDMO COCC[N@@H+]1CC[C@H](NCc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000264653165 464410432 /nfs/dbraw/zinc/41/04/32/464410432.db2.gz XIRYZMUACJERKZ-LBPRGKRZSA-N 1 1 345.346 2.007 20 5 EEBDMO COCC[N@H+]1CC[C@H](NCc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000264653165 464410436 /nfs/dbraw/zinc/41/04/36/464410436.db2.gz XIRYZMUACJERKZ-LBPRGKRZSA-N 1 1 345.346 2.007 20 5 EEBDMO Cc1cc(NC(=O)CC[N@H+](C)CCc2ccccc2[N+](=O)[O-])no1 ZINC000285315143 464521368 /nfs/dbraw/zinc/52/13/68/464521368.db2.gz MKGHEFMOPDXXFV-UHFFFAOYSA-N 1 1 332.360 2.394 20 5 EEBDMO C[C@@H]1CN(Cc2c(F)cccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000189950825 464569341 /nfs/dbraw/zinc/56/93/41/464569341.db2.gz LROGIMKIEYKSBD-GFCCVEGCSA-N 1 1 325.384 2.011 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000294737187 464590741 /nfs/dbraw/zinc/59/07/41/464590741.db2.gz WFQCEXQQALRQGA-NSHDSACASA-N 1 1 339.367 2.347 20 5 EEBDMO C[C@@H]1CC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000182324423 464628332 /nfs/dbraw/zinc/62/83/32/464628332.db2.gz HURVQGDCFGYNRS-OLZOCXBDSA-N 1 1 326.418 2.346 20 5 EEBDMO C[C@@H]1CC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000182324423 464628338 /nfs/dbraw/zinc/62/83/38/464628338.db2.gz HURVQGDCFGYNRS-OLZOCXBDSA-N 1 1 326.418 2.346 20 5 EEBDMO CC[N@H+]1CCCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000265863784 464713204 /nfs/dbraw/zinc/71/32/04/464713204.db2.gz TTZKSGVYKFBXSZ-CQSZACIVSA-N 1 1 334.420 2.258 20 5 EEBDMO C[N@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1cccc(Cl)c1 ZINC000176207936 464720725 /nfs/dbraw/zinc/72/07/25/464720725.db2.gz KHMGVZAFLJNYFL-UHFFFAOYSA-N 1 1 337.767 2.015 20 5 EEBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1cccc(Cl)c1 ZINC000176207936 464720729 /nfs/dbraw/zinc/72/07/29/464720729.db2.gz KHMGVZAFLJNYFL-UHFFFAOYSA-N 1 1 337.767 2.015 20 5 EEBDMO Cn1cc(C[N@@H+](C)CC2CC(O)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000191158496 464787251 /nfs/dbraw/zinc/78/72/51/464787251.db2.gz ARHOUZORVGQTSI-UHFFFAOYSA-N 1 1 330.388 2.198 20 5 EEBDMO COCC[N@H+](Cc1cccnc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000191237445 464804213 /nfs/dbraw/zinc/80/42/13/464804213.db2.gz MCDDNWJJLLCWSG-QGZVFWFLSA-N 1 1 331.372 2.172 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCSCC[C@H]1C ZINC000286253283 464854891 /nfs/dbraw/zinc/85/48/91/464854891.db2.gz SJNMDBKRGIVRIQ-LLVKDONJSA-N 1 1 339.417 2.369 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCSCC[C@H]1C ZINC000286253283 464854894 /nfs/dbraw/zinc/85/48/94/464854894.db2.gz SJNMDBKRGIVRIQ-LLVKDONJSA-N 1 1 339.417 2.369 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](O)CC(C)(C)C1 ZINC000295617320 464903808 /nfs/dbraw/zinc/90/38/08/464903808.db2.gz YWHBLGCMNPRQCZ-CHWSQXEVSA-N 1 1 335.404 2.405 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](O)CC(C)(C)C1 ZINC000295617320 464903815 /nfs/dbraw/zinc/90/38/15/464903815.db2.gz YWHBLGCMNPRQCZ-CHWSQXEVSA-N 1 1 335.404 2.405 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+](C(C)C)C2)n1 ZINC000286432307 464915656 /nfs/dbraw/zinc/91/56/56/464915656.db2.gz WDGFXVFETJPJBW-GFCCVEGCSA-N 1 1 336.392 2.309 20 5 EEBDMO Cc1ccc(NC(=O)N[C@@H](C)CCN2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000183892840 464923333 /nfs/dbraw/zinc/92/33/33/464923333.db2.gz VVLQRNOJCODXGJ-AWEZNQCLSA-N 1 1 349.435 2.051 20 5 EEBDMO COC(=O)[C@@]1(C)C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1C ZINC000337426224 465361505 /nfs/dbraw/zinc/36/15/05/465361505.db2.gz CXANSJNYXFDILC-HWPZZCPQSA-N 1 1 332.360 2.102 20 5 EEBDMO COC(=O)[C@@]1(C)C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1C ZINC000337426224 465361509 /nfs/dbraw/zinc/36/15/09/465361509.db2.gz CXANSJNYXFDILC-HWPZZCPQSA-N 1 1 332.360 2.102 20 5 EEBDMO O=C1C[C@H]([N@H+]2CC[C@@H](C3CCC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000591240530 468431936 /nfs/dbraw/zinc/43/19/36/468431936.db2.gz URZZBRIKZMVQFD-CJNGLKHVSA-N 1 1 343.383 2.349 20 5 EEBDMO O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000339671140 465432470 /nfs/dbraw/zinc/43/24/70/465432470.db2.gz KZDMIECPBQJVPX-OLZOCXBDSA-N 1 1 335.429 2.430 20 5 EEBDMO C[C@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+]1Cc1ccccc1 ZINC000554641045 468435373 /nfs/dbraw/zinc/43/53/73/468435373.db2.gz FNCRWOULHWLTJR-XJKSGUPXSA-N 1 1 342.399 2.326 20 5 EEBDMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000356750002 465519349 /nfs/dbraw/zinc/51/93/49/465519349.db2.gz ZFZFJLCBPCNHFM-CYBMUJFWSA-N 1 1 345.403 2.239 20 5 EEBDMO O=C(CC[N@H+]1CC[C@@H](COC(F)F)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000353029193 465586855 /nfs/dbraw/zinc/58/68/55/465586855.db2.gz PIYXCFCRKARSKU-LLVKDONJSA-N 1 1 343.330 2.485 20 5 EEBDMO COC(=O)C[C@]1([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCOC1 ZINC000362260976 465612589 /nfs/dbraw/zinc/61/25/89/465612589.db2.gz CNEMEBPSIHIDGE-CQSZACIVSA-N 1 1 328.752 2.060 20 5 EEBDMO Cc1[nH+]cn(-c2ccc(NC(=O)c3c([N+](=O)[O-])cnn3C)cc2)c1C ZINC000360935715 465645847 /nfs/dbraw/zinc/64/58/47/465645847.db2.gz CEIIAPVTWHKNAI-UHFFFAOYSA-N 1 1 340.343 2.383 20 5 EEBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000344592811 465703408 /nfs/dbraw/zinc/70/34/08/465703408.db2.gz BUGUJCVSILOQEW-CQSZACIVSA-N 1 1 345.403 2.321 20 5 EEBDMO COc1cc(CN2CC[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000330607079 465728154 /nfs/dbraw/zinc/72/81/54/465728154.db2.gz JGUHIZHVUGIARY-SNVBAGLBSA-N 1 1 345.346 2.341 20 5 EEBDMO C[C@H]1C[C@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000361064259 465740596 /nfs/dbraw/zinc/74/05/96/465740596.db2.gz BQSLFIOXFLGCBW-SMDDNHRTSA-N 1 1 332.404 2.382 20 5 EEBDMO COCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@H](O)C(F)(F)F ZINC000594018517 468463515 /nfs/dbraw/zinc/46/35/15/468463515.db2.gz YKJWVQHQZKCLBN-ZDUSSCGKSA-N 1 1 336.310 2.009 20 5 EEBDMO COCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@H](O)C(F)(F)F ZINC000594018517 468463518 /nfs/dbraw/zinc/46/35/18/468463518.db2.gz YKJWVQHQZKCLBN-ZDUSSCGKSA-N 1 1 336.310 2.009 20 5 EEBDMO C[N@H+]1CCC[C@H](N2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC000301775621 466028946 /nfs/dbraw/zinc/02/89/46/466028946.db2.gz HHOZKZTYJRCWNE-LBPRGKRZSA-N 1 1 340.374 2.089 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@H](C)c1ccon1 ZINC000349245518 466033596 /nfs/dbraw/zinc/03/35/96/466033596.db2.gz RRIIDNMOAWRTAN-SNVBAGLBSA-N 1 1 334.332 2.271 20 5 EEBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2C[C@@H]3CC[C@H](O)[C@H]3C2)c1 ZINC000346307277 466080191 /nfs/dbraw/zinc/08/01/91/466080191.db2.gz BMBJKIWUUTVWLA-XDTLVQLUSA-N 1 1 328.315 2.399 20 5 EEBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2C[C@@H]3CC[C@H](O)[C@H]3C2)c1 ZINC000346307277 466080197 /nfs/dbraw/zinc/08/01/97/466080197.db2.gz BMBJKIWUUTVWLA-XDTLVQLUSA-N 1 1 328.315 2.399 20 5 EEBDMO Cc1[nH]nc(C(=O)N(C)C(C)(C)C[NH+]2CCCCCC2)c1[N+](=O)[O-] ZINC000331541062 466131811 /nfs/dbraw/zinc/13/18/11/466131811.db2.gz QKTQORQOHHDMPS-UHFFFAOYSA-N 1 1 337.424 2.353 20 5 EEBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000362963506 466147854 /nfs/dbraw/zinc/14/78/54/466147854.db2.gz AHUYHPBTWCKSST-ZDUSSCGKSA-N 1 1 343.387 2.172 20 5 EEBDMO CCO[C@H]1C[C@H](O)C12CC[NH+](Cc1c(F)cccc1[N+](=O)[O-])CC2 ZINC000304387159 466294724 /nfs/dbraw/zinc/29/47/24/466294724.db2.gz SVCDPZVJQUHKSX-HOTGVXAUSA-N 1 1 338.379 2.486 20 5 EEBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000332072261 466372635 /nfs/dbraw/zinc/37/26/35/466372635.db2.gz XDQQPVQZAXSCON-HUUCEWRRSA-N 1 1 339.342 2.159 20 5 EEBDMO 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/nfs/dbraw/zinc/27/64/13/1321276413.db2.gz GCYVZPRNFUBNEG-FVOPLDGLSA-N 1 1 342.346 2.119 20 5 EEBDMO COc1cc(NCC2(N(C)C)CC[NH+](C)CC2)cc([N+](=O)[O-])c1C ZINC001164213413 1321319867 /nfs/dbraw/zinc/31/98/67/1321319867.db2.gz VAAKKLRWDBXNGN-UHFFFAOYSA-N 1 1 336.436 2.350 20 5 EEBDMO COC(=O)C1([NH3+])CCN(c2ccc3ccc4cccnc4c3n2)CC1 ZINC001166794376 1321789209 /nfs/dbraw/zinc/78/92/09/1321789209.db2.gz BRXQMGWFQUTRGS-UHFFFAOYSA-N 1 1 336.395 2.254 20 5 EEBDMO CNC(=O)c1ccc(N2CC[N@@H+](C3CCCC3)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001262706234 1322354696 /nfs/dbraw/zinc/35/46/96/1322354696.db2.gz HKCRBSWPAHCZJB-ZDUSSCGKSA-N 1 1 346.431 2.408 20 5 EEBDMO CC(C)OCCC[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001603352442 1350693378 /nfs/dbraw/zinc/69/33/78/1350693378.db2.gz WPYBXKAMGQRGAZ-UHFFFAOYSA-N 1 1 334.380 2.022 20 5 EEBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)OCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001318673772 1332575139 /nfs/dbraw/zinc/57/51/39/1332575139.db2.gz UEQJDHUKXZGTCL-CQSZACIVSA-N 1 1 349.387 2.001 20 5 EEBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)OCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001318673772 1332575141 /nfs/dbraw/zinc/57/51/41/1332575141.db2.gz UEQJDHUKXZGTCL-CQSZACIVSA-N 1 1 349.387 2.001 20 5 EEBDMO CN1CC[NH+](Cc2cccc(CNc3ncc([N+](=O)[O-])s3)c2)CC1 ZINC001321230023 1333049820 /nfs/dbraw/zinc/04/98/20/1333049820.db2.gz FGTJXUINGLLGPB-UHFFFAOYSA-N 1 1 347.444 2.411 20 5 EEBDMO C[C@@H](c1ccccn1)[N@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001609141676 1351858369 /nfs/dbraw/zinc/85/83/69/1351858369.db2.gz XHYXKCVVFKGLKN-NSHDSACASA-N 1 1 339.359 2.363 20 5 EEBDMO C[C@@H](c1ccccn1)[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001609141676 1351858374 /nfs/dbraw/zinc/85/83/74/1351858374.db2.gz XHYXKCVVFKGLKN-NSHDSACASA-N 1 1 339.359 2.363 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCCNc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-] ZINC001609165866 1351872661 /nfs/dbraw/zinc/87/26/61/1351872661.db2.gz ZEPXOWLCUOIDDS-LBPRGKRZSA-N 1 1 345.407 2.451 20 5 EEBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC001337536714 1336712067 /nfs/dbraw/zinc/71/20/67/1336712067.db2.gz XARHRLDJPXVGPW-GFCCVEGCSA-N 1 1 328.372 2.357 20 5 EEBDMO CSCC1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1 ZINC001341087818 1337280565 /nfs/dbraw/zinc/28/05/65/1337280565.db2.gz MQDMRZPBCAJWOY-INIZCTEOSA-N 1 1 337.445 2.370 20 5 EEBDMO CC1(C)CCC[N@H+]1CCNc1cc(F)c(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001575693065 1343857003 /nfs/dbraw/zinc/85/70/03/1343857003.db2.gz KVIYOJWUMCUYPG-UHFFFAOYSA-N 1 1 349.370 2.200 20 5 EEBDMO C[C@@]([NH3+])(C(=O)NCC(=O)CC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC001576080102 1343963008 /nfs/dbraw/zinc/96/30/08/1343963008.db2.gz CAAMUTYWFSKPDU-SFHVURJKSA-N 1 1 347.415 2.424 20 5 EEBDMO C[S@@](=O)c1cccc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)c1 ZINC001579357643 1344374196 /nfs/dbraw/zinc/37/41/96/1344374196.db2.gz JNBSUIRBFVSLMU-UPCLLVRISA-N 1 1 347.396 2.145 20 5 EEBDMO C[C@H]([NH2+]Cc1cc(-c2nn[nH]n2)ccn1)c1ccccc1[N+](=O)[O-] ZINC001605440439 1351158986 /nfs/dbraw/zinc/15/89/86/1351158986.db2.gz JUCHNZRXXJZPEI-JTQLQIEISA-N 1 1 325.332 2.021 20 5 EEBDMO C[C@@]([NH3+])(C(=O)Nc1cccc2c1OCCO2)c1cccc([N+](=O)[O-])c1 ZINC001576085111 1403559847 /nfs/dbraw/zinc/55/98/47/1403559847.db2.gz IRZPDCANRAZGTO-KRWDZBQOSA-N 1 1 343.339 2.179 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(N(C)CCNC(=O)C[N@H+]2CCC(C)(C)C2)c1 ZINC001100346924 1410550682 /nfs/dbraw/zinc/55/06/82/1410550682.db2.gz KBSXRTFRGNFKHZ-UHFFFAOYSA-N 1 1 348.447 2.188 20 5 EEBDMO O=[N+]([O-])c1cc(F)cnc1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727356 720351856 /nfs/dbraw/zinc/35/18/56/720351856.db2.gz SXFXWFJVZXKRQL-GJZGRUSLSA-N 1 1 343.362 2.377 20 5 EEBDMO C[N@@H+]1CCc2c(NC3(c4cccnn4)CC3)ccc([N+](=O)[O-])c2C1 ZINC001168524313 769503379 /nfs/dbraw/zinc/50/33/79/769503379.db2.gz PTHPILUWECVKTF-UHFFFAOYSA-N 1 1 325.372 2.474 20 5 EEBDMO C[N@H+]1CCc2c(NC3(c4cccnn4)CC3)ccc([N+](=O)[O-])c2C1 ZINC001168524313 769503388 /nfs/dbraw/zinc/50/33/88/769503388.db2.gz PTHPILUWECVKTF-UHFFFAOYSA-N 1 1 325.372 2.474 20 5 EEBDMO C[C@H](O)c1ncc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000809579721 783200121 /nfs/dbraw/zinc/20/01/21/783200121.db2.gz FZLWSFGJCGSOEI-WDEREUQCSA-N 1 1 349.416 2.186 20 5 EEBDMO C[C@H](O)c1ncc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000809579721 783200126 /nfs/dbraw/zinc/20/01/26/783200126.db2.gz FZLWSFGJCGSOEI-WDEREUQCSA-N 1 1 349.416 2.186 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)NC[C@H]1C[C@@H](Nc2ccccc2[N+](=O)[O-])C1 ZINC001091346826 790389787 /nfs/dbraw/zinc/38/97/87/790389787.db2.gz PAIRJLQLKNCYIF-OKILXGFUSA-N 1 1 343.387 2.107 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]CC2CC3(CCC3)C2)CC1 ZINC000997770921 791039864 /nfs/dbraw/zinc/03/98/64/791039864.db2.gz BQUYOLYOEKRCMS-HZPDHXFCSA-N 1 1 335.448 2.060 20 5 EEBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000825401152 788613877 /nfs/dbraw/zinc/61/38/77/788613877.db2.gz ZIVCOUZCBAMOKE-UMPJEAMMSA-N 1 1 349.431 2.111 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000844642517 789286651 /nfs/dbraw/zinc/28/66/51/789286651.db2.gz JIMKULUPNMMKCA-BBBLOLIVSA-N 1 1 327.331 2.426 20 5 EEBDMO CCC[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000171681517 791439440 /nfs/dbraw/zinc/43/94/40/791439440.db2.gz PQKCRWUVSLFTCG-UHFFFAOYSA-N 1 1 346.431 2.118 20 5 EEBDMO CC(C)[N@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000915202453 795725626 /nfs/dbraw/zinc/72/56/26/795725626.db2.gz IQGUMTOACBGFMD-QGZVFWFLSA-N 1 1 346.387 2.192 20 5 EEBDMO CC(C)[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000915202453 795725631 /nfs/dbraw/zinc/72/56/31/795725631.db2.gz IQGUMTOACBGFMD-QGZVFWFLSA-N 1 1 346.387 2.192 20 5 EEBDMO CCN(CCNc1ccccc1[N+](=O)[O-])C(=O)Cn1cc[nH+]c1C ZINC001106768236 796492465 /nfs/dbraw/zinc/49/24/65/796492465.db2.gz QBUUDBBEKBNZDB-UHFFFAOYSA-N 1 1 331.376 2.060 20 5 EEBDMO CCN(CCNc1cccc(F)c1[N+](=O)[O-])C(=O)C[N@@H+](C)C(C)C ZINC001106779029 796521921 /nfs/dbraw/zinc/52/19/21/796521921.db2.gz RLWDKIICCYULHS-UHFFFAOYSA-N 1 1 340.399 2.335 20 5 EEBDMO O=C(NCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(F)(F)F ZINC001172898925 797128603 /nfs/dbraw/zinc/12/86/03/797128603.db2.gz JOYFATNNOCSAGT-LBPRGKRZSA-N 1 1 345.321 2.110 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCO[C@@H]3C[C@H](CO)C[C@H]31)CC2 ZINC001172903918 797131040 /nfs/dbraw/zinc/13/10/40/797131040.db2.gz JPBWNKYBVUSKMW-ZQNRLITLSA-N 1 1 346.427 2.314 20 5 EEBDMO O=C1NCC[C@]12CCC[N@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172907707 797133235 /nfs/dbraw/zinc/13/32/35/797133235.db2.gz LMVCTBIRMGGHEI-LPHOPBHVSA-N 1 1 343.427 2.444 20 5 EEBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](Oc2cnccn2)C1 ZINC001173238544 797324673 /nfs/dbraw/zinc/32/46/73/797324673.db2.gz VEDZVOPOPPXQSA-XJKSGUPXSA-N 1 1 328.372 2.469 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@H]2C[N@H+]3CCC[C@H]3CO2)c(OC(F)F)c1 ZINC000785802541 806605062 /nfs/dbraw/zinc/60/50/62/806605062.db2.gz VRROXYLROFBVSY-RYUDHWBXSA-N 1 1 343.330 2.471 20 5 EEBDMO Cc1cc(C(=O)NC2CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)on1 ZINC001002333360 797917600 /nfs/dbraw/zinc/91/76/00/797917600.db2.gz KUVIAEXOLDONFA-UHFFFAOYSA-N 1 1 344.371 2.286 20 5 EEBDMO O=C(NC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1)c1ccns1 ZINC001002934048 798852246 /nfs/dbraw/zinc/85/22/46/798852246.db2.gz FYKZTHOAETVYRF-UHFFFAOYSA-N 1 1 346.412 2.446 20 5 EEBDMO O=C(NC[C@H]1C[C@H]([NH2+]Cc2ccc(Cl)s2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086363192 802829820 /nfs/dbraw/zinc/82/98/20/802829820.db2.gz HBKVJLNYGMKQLE-CNVPUSNMSA-N 1 1 343.836 2.051 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2C[C@H]3CCN(Cc4ccncc4)C[C@H]3C2)C1 ZINC001169018708 803587230 /nfs/dbraw/zinc/58/72/30/803587230.db2.gz CDFKFSYNUWBQFN-AKHDSKFASA-N 1 1 344.459 2.281 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2Cc3cncn3C[C@H](COCC3CC3)C2)C1 ZINC001169021703 803588420 /nfs/dbraw/zinc/58/84/20/803588420.db2.gz PQOJAFAECSEDHV-ZACQAIPSSA-N 1 1 348.447 2.187 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCCn3cnc(COCC4CC4)c3C2)C1 ZINC001169024200 803589822 /nfs/dbraw/zinc/58/98/22/803589822.db2.gz QLHHBPKLUALOJL-JKSUJKDBSA-N 1 1 348.447 2.461 20 5 EEBDMO CCOC[C@@H]1C[N@@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nn(CC)cc21 ZINC001169025330 803591085 /nfs/dbraw/zinc/59/10/85/803591085.db2.gz YRRCPUVRBUBYDA-ILXRZTDVSA-N 1 1 336.436 2.284 20 5 EEBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nn(CC)cc21 ZINC001169025330 803591086 /nfs/dbraw/zinc/59/10/86/803591086.db2.gz YRRCPUVRBUBYDA-ILXRZTDVSA-N 1 1 336.436 2.284 20 5 EEBDMO CCOC[C@@H]1C[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nn(CC)cc21 ZINC001169025336 803591239 /nfs/dbraw/zinc/59/12/39/803591239.db2.gz YRRCPUVRBUBYDA-QLFBSQMISA-N 1 1 336.436 2.284 20 5 EEBDMO CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nn(CC)cc21 ZINC001169025336 803591244 /nfs/dbraw/zinc/59/12/44/803591244.db2.gz YRRCPUVRBUBYDA-QLFBSQMISA-N 1 1 336.436 2.284 20 5 EEBDMO CC(C)(C)OC(=O)CC[C@@H]1COCC[N@@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169052529 803595779 /nfs/dbraw/zinc/59/57/79/803595779.db2.gz GXWPZUYCZDFAGD-QLFBSQMISA-N 1 1 342.436 2.255 20 5 EEBDMO CC(C)(C)OC(=O)CC[C@@H]1COCC[N@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169052529 803595781 /nfs/dbraw/zinc/59/57/81/803595781.db2.gz GXWPZUYCZDFAGD-QLFBSQMISA-N 1 1 342.436 2.255 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790910448 808992851 /nfs/dbraw/zinc/99/28/51/808992851.db2.gz APFSAULBJRWXKH-VHSXEESVSA-N 1 1 343.786 2.481 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H](n3ccnn3)C2)c([N+](=O)[O-])c1 ZINC001170351422 809919952 /nfs/dbraw/zinc/91/99/52/809919952.db2.gz BYRLOGVSWHKPDX-ZFWWWQNUSA-N 1 1 345.403 2.463 20 5 EEBDMO Cc1nc(Cl)c([N+](=O)[O-])c(N2CC[N@H+](C)CC23CCCC3)n1 ZINC001158409162 812987985 /nfs/dbraw/zinc/98/79/85/812987985.db2.gz VWCGGUXLRAMZSO-UHFFFAOYSA-N 1 1 325.800 2.411 20 5 EEBDMO CNC(=O)CCC[N@@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000154995413 529853126 /nfs/dbraw/zinc/85/31/26/529853126.db2.gz NNEDQECMBBHAFB-LLVKDONJSA-N 1 1 347.375 2.164 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)c1 ZINC000069045601 215355890 /nfs/dbraw/zinc/35/58/90/215355890.db2.gz DVNJVSLTSHQNMD-CYBMUJFWSA-N 1 1 335.404 2.454 20 5 EEBDMO C[C@H]([NH3+])[C@H]1COCC[C@@H]1NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000423091599 240360990 /nfs/dbraw/zinc/36/09/90/240360990.db2.gz XUGSRYDIZYEVCX-FZZIBODNSA-N 1 1 347.337 2.456 20 5 EEBDMO Cc1[nH+]ccn1CCCN(C)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000130602286 223164029 /nfs/dbraw/zinc/16/40/29/223164029.db2.gz URBDFFJQAZDEIN-UHFFFAOYSA-N 1 1 332.360 2.027 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](O)CC(C)(C)C1 ZINC000451811046 243275101 /nfs/dbraw/zinc/27/51/01/243275101.db2.gz OPROPSPWCLXDPA-CYBMUJFWSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](O)CC(C)(C)C1 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ZINC000457132128 467762574 /nfs/dbraw/zinc/76/25/74/467762574.db2.gz UJXZOWVXCAECBS-GFCCVEGCSA-N 1 1 331.376 2.026 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000457132128 467762576 /nfs/dbraw/zinc/76/25/76/467762576.db2.gz UJXZOWVXCAECBS-GFCCVEGCSA-N 1 1 331.376 2.026 20 5 EEBDMO COc1cc(C(=O)NCC[C@@H]2CCC[N@@H+](C)C2)cc([N+](=O)[O-])c1C ZINC000458224748 467792432 /nfs/dbraw/zinc/79/24/32/467792432.db2.gz RPPWXQQGROOPJD-ZDUSSCGKSA-N 1 1 335.404 2.374 20 5 EEBDMO COC(=O)Cc1ccc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000450253486 467810044 /nfs/dbraw/zinc/81/00/44/467810044.db2.gz OIWCMJXWAWVBCX-KGLIPLIRSA-N 1 1 333.388 2.349 20 5 EEBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000450381075 467839585 /nfs/dbraw/zinc/83/95/85/467839585.db2.gz SSXIAAARWVHOQK-QWHCGFSZSA-N 1 1 333.388 2.109 20 5 EEBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000450381075 467839587 /nfs/dbraw/zinc/83/95/87/467839587.db2.gz SSXIAAARWVHOQK-QWHCGFSZSA-N 1 1 333.388 2.109 20 5 EEBDMO C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC1(C)C ZINC000549721785 468193299 /nfs/dbraw/zinc/19/32/99/468193299.db2.gz WPLMIWOORZVGHK-UHFFFAOYSA-N 1 1 328.372 2.309 20 5 EEBDMO O=C(CCN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000591726558 468511172 /nfs/dbraw/zinc/51/11/72/468511172.db2.gz MRTYLJKKDVPPAB-ZIAGYGMSSA-N 1 1 332.404 2.140 20 5 EEBDMO O=C(CCN[C@@H]1CC[N@H+]2CCC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000591726558 468511176 /nfs/dbraw/zinc/51/11/76/468511176.db2.gz MRTYLJKKDVPPAB-ZIAGYGMSSA-N 1 1 332.404 2.140 20 5 EEBDMO CCOc1ccc(C(=O)NC[C@@H]2CCCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000600310562 468529143 /nfs/dbraw/zinc/52/91/43/468529143.db2.gz KACCWOBYUQLEMS-ZDUSSCGKSA-N 1 1 335.404 2.455 20 5 EEBDMO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000570228519 468607991 /nfs/dbraw/zinc/60/79/91/468607991.db2.gz NSEWKXGFMVBTJF-HNNXBMFYSA-N 1 1 345.403 2.204 20 5 EEBDMO C[C@H]1[C@H]([NH+](C)C)CCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000597696070 468642042 /nfs/dbraw/zinc/64/20/42/468642042.db2.gz BDNJMMKFAQLAOX-MEDUHNTESA-N 1 1 343.387 2.150 20 5 EEBDMO Cc1c(CC(=O)N2CCC[C@@]3(CC[N@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000597714197 468648769 /nfs/dbraw/zinc/64/87/69/468648769.db2.gz HDVHPWCWVMYKJG-SFHVURJKSA-N 1 1 331.416 2.390 20 5 EEBDMO CC(C)(C)n1nnc(C[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)n1 ZINC000594920405 468723028 /nfs/dbraw/zinc/72/30/28/468723028.db2.gz FURKPXNZAWOTGQ-UHFFFAOYSA-N 1 1 332.408 2.449 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@H](c3ccncc3)C2)c1 ZINC000559637752 468749935 /nfs/dbraw/zinc/74/99/35/468749935.db2.gz ZQWPJBICYRGOBM-RDJZCZTQSA-N 1 1 343.383 2.219 20 5 EEBDMO CC(C)OCC[NH+]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595330792 468814572 /nfs/dbraw/zinc/81/45/72/468814572.db2.gz FCKSLEKHBGQTLW-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cc4n(n3)CCCC4)CC2)n1 ZINC000593027081 468844120 /nfs/dbraw/zinc/84/41/20/468844120.db2.gz KSZNPOZNGMJFTA-UHFFFAOYSA-N 1 1 330.392 2.161 20 5 EEBDMO C[N@H+]1CC[C@@]2(C1)CCCN(Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2 ZINC000595505035 468880386 /nfs/dbraw/zinc/88/03/86/468880386.db2.gz PSCNCJNWKMDMDT-QGZVFWFLSA-N 1 1 329.404 2.389 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000595522026 468888121 /nfs/dbraw/zinc/88/81/21/468888121.db2.gz IBWASSOJFLGSNE-AWEZNQCLSA-N 1 1 334.420 2.309 20 5 EEBDMO COC(=O)c1ccnc(NCC[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000598590464 468925095 /nfs/dbraw/zinc/92/50/95/468925095.db2.gz ZCBICAMRRXUTPQ-UHFFFAOYSA-N 1 1 344.371 2.320 20 5 EEBDMO COC(=O)c1ccnc(N2CC[N@H+](C3CCC3)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000598627957 468937672 /nfs/dbraw/zinc/93/76/72/468937672.db2.gz XKOCFFCFNVHPEN-GFCCVEGCSA-N 1 1 348.403 2.087 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCNCc2nc3cc([N+](=O)[O-])ccc3o2)CCCO1 ZINC000602635446 468979467 /nfs/dbraw/zinc/97/94/67/468979467.db2.gz YVPCPWLDIPVGJN-CYBMUJFWSA-N 1 1 348.403 2.327 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000593535066 469022051 /nfs/dbraw/zinc/02/20/51/469022051.db2.gz UNMWVHWANLCVLJ-HIFRSBDPSA-N 1 1 335.379 2.219 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H](CO)c1ccc(Cl)cc1 ZINC000602834874 469106055 /nfs/dbraw/zinc/10/60/55/469106055.db2.gz FXJKQUFETRBOKX-CQSZACIVSA-N 1 1 338.795 2.419 20 5 EEBDMO C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@@H]1C[N@H+](C)CCO1 ZINC000610901131 469108771 /nfs/dbraw/zinc/10/87/71/469108771.db2.gz GIALCVJWTQUUPQ-GWCFXTLKSA-N 1 1 349.412 2.258 20 5 EEBDMO C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@@H]1C[N@@H+](C)CCO1 ZINC000610901131 469108777 /nfs/dbraw/zinc/10/87/77/469108777.db2.gz GIALCVJWTQUUPQ-GWCFXTLKSA-N 1 1 349.412 2.258 20 5 EEBDMO C[N@H+]1CCCC[C@@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000599137793 469132436 /nfs/dbraw/zinc/13/24/36/469132436.db2.gz DCOCUJKFDCJWOY-LBPRGKRZSA-N 1 1 341.433 2.142 20 5 EEBDMO O=C(N[C@H](C[NH+]1CCCCC1)c1ccccc1)c1n[nH]cc1[N+](=O)[O-] ZINC000611208167 469192203 /nfs/dbraw/zinc/19/22/03/469192203.db2.gz HLWREOIXTRZRRG-CQSZACIVSA-N 1 1 343.387 2.275 20 5 EEBDMO CN(C(=O)C[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21)c1ccc([N+](=O)[O-])cc1 ZINC000602998032 469215152 /nfs/dbraw/zinc/21/51/52/469215152.db2.gz WGEDQLKCVMQKHW-ZACQAIPSSA-N 1 1 347.415 2.183 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H]([C@H]3CCOC3)C1)OCCO2 ZINC000611274778 469218132 /nfs/dbraw/zinc/21/81/32/469218132.db2.gz GABUIIPTAPJLLH-STQMWFEESA-N 1 1 334.372 2.224 20 5 EEBDMO CC(C)(C)[N@@H+]1CC[C@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000596327594 469245283 /nfs/dbraw/zinc/24/52/83/469245283.db2.gz ULSQZFBLIREGDB-NSHDSACASA-N 1 1 341.433 2.283 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000596327594 469245288 /nfs/dbraw/zinc/24/52/88/469245288.db2.gz ULSQZFBLIREGDB-NSHDSACASA-N 1 1 341.433 2.283 20 5 EEBDMO C[N@@H+](CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)CC(C)(C)C ZINC000608886375 469884501 /nfs/dbraw/zinc/88/45/01/469884501.db2.gz CPGOLMGMVNAJAI-UHFFFAOYSA-N 1 1 348.447 2.221 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000610209672 469988584 /nfs/dbraw/zinc/98/85/84/469988584.db2.gz WNXASGLVSAMPCX-RISCZKNCSA-N 1 1 332.404 2.382 20 5 EEBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](SC)C2)c([N+](=O)[O-])c1 ZINC000451320124 536800776 /nfs/dbraw/zinc/80/07/76/536800776.db2.gz KFAZAUXRMRLVLT-ZYHUDNBSSA-N 1 1 339.417 2.368 20 5 EEBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](SC)C2)c([N+](=O)[O-])c1 ZINC000451320124 536800782 /nfs/dbraw/zinc/80/07/82/536800782.db2.gz KFAZAUXRMRLVLT-ZYHUDNBSSA-N 1 1 339.417 2.368 20 5 EEBDMO C[C@@H]1CCC[N@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000726583021 576277589 /nfs/dbraw/zinc/27/75/89/576277589.db2.gz MHMIZPZXADBPIL-GFCCVEGCSA-N 1 1 332.360 2.053 20 5 EEBDMO C[C@@H]1CCC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000726583021 576277593 /nfs/dbraw/zinc/27/75/93/576277593.db2.gz MHMIZPZXADBPIL-GFCCVEGCSA-N 1 1 332.360 2.053 20 5 EEBDMO Cc1cc(C(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)c(N)c([N+](=O)[O-])c1 ZINC000729521152 576663122 /nfs/dbraw/zinc/66/31/22/576663122.db2.gz BPJGNGUBUZGGEQ-STQMWFEESA-N 1 1 334.420 2.478 20 5 EEBDMO Cn1nccc1[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776279121 577456701 /nfs/dbraw/zinc/45/67/01/577456701.db2.gz XHSMUGWAECVNDF-YOEHRIQHSA-N 1 1 330.388 2.241 20 5 EEBDMO O=C1CCCN1C[C@@H]1CCCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581335 577463117 /nfs/dbraw/zinc/46/31/17/577463117.db2.gz CXRUUSSBWODWRS-IRXDYDNUSA-N 1 1 347.415 2.105 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)cc1 ZINC000777735369 577485530 /nfs/dbraw/zinc/48/55/30/577485530.db2.gz JGCJEHLSMPLUDY-ROUUACIJSA-N 1 1 346.358 2.361 20 5 EEBDMO Cc1nn(CN2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)c2ncc([N+](=O)[O-])cc12 ZINC000765105879 577495058 /nfs/dbraw/zinc/49/50/58/577495058.db2.gz LSHRQSFKHGXEPI-BBRMVZONSA-N 1 1 344.419 2.022 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2csc([N+](=O)[O-])c2)C[C@@H]1C ZINC000768843902 577563895 /nfs/dbraw/zinc/56/38/95/577563895.db2.gz XWYGQUDGXOLIDA-WDEREUQCSA-N 1 1 347.462 2.150 20 5 EEBDMO Cc1[nH+]ccn1CCCc1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000761257115 577680675 /nfs/dbraw/zinc/68/06/75/577680675.db2.gz VHOISBGKKHWFNX-UHFFFAOYSA-N 1 1 328.332 2.365 20 5 EEBDMO C[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C[C@H]1CCOC1 ZINC000749849359 577982975 /nfs/dbraw/zinc/98/29/75/577982975.db2.gz ZJAVDDRMPQTTLX-SNVBAGLBSA-N 1 1 327.768 2.155 20 5 EEBDMO CCCCOC(=O)CC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000120992567 675823239 /nfs/dbraw/zinc/82/32/39/675823239.db2.gz FACYUFZXFOELOC-UHFFFAOYSA-N 1 1 335.404 2.450 20 5 EEBDMO COC(=O)CC[N@@H+](Cn1nc(C)c2ccc([N+](=O)[O-])cc21)C(C)C ZINC000121192377 676254322 /nfs/dbraw/zinc/25/43/22/676254322.db2.gz VJJYKTBKBNAGRG-UHFFFAOYSA-N 1 1 334.376 2.484 20 5 EEBDMO CO[C@@H]1CCOC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Br ZINC000934036632 677771993 /nfs/dbraw/zinc/77/19/93/677771993.db2.gz MSJXOGPUMPKXKT-CHWSQXEVSA-N 1 1 345.193 2.251 20 5 EEBDMO CN(C)c1[nH+]cc(CNc2c3cc(F)ccc3ncc2[N+](=O)[O-])n1C ZINC000892515140 681476676 /nfs/dbraw/zinc/47/66/76/681476676.db2.gz FNHHZQKFESZNQI-UHFFFAOYSA-N 1 1 344.350 2.116 20 5 EEBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1c([N+](=O)[O-])cnn1C ZINC000892737955 682973827 /nfs/dbraw/zinc/97/38/27/682973827.db2.gz PUIRJQSUHCJYJA-OAHLLOKOSA-N 1 1 329.404 2.287 20 5 EEBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1c([N+](=O)[O-])cnn1C ZINC000892737954 682973997 /nfs/dbraw/zinc/97/39/97/682973997.db2.gz PUIRJQSUHCJYJA-HNNXBMFYSA-N 1 1 329.404 2.287 20 5 EEBDMO CC(C)c1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC000983654641 683068462 /nfs/dbraw/zinc/06/84/62/683068462.db2.gz PHQKSUVUPUIULT-VDHUWJSZSA-N 1 1 345.443 2.460 20 5 EEBDMO O=C(N[C@H]1C[C@H](C[NH2+]Cc2ccc(C3CC3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC000983658106 683084500 /nfs/dbraw/zinc/08/45/00/683084500.db2.gz PXTMBPRVHXTBRW-BNEJOLLZSA-N 1 1 343.427 2.214 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)N[C@@H]1C[C@@H](Nc2ccc(C)cc2[N+](=O)[O-])C1 ZINC001059350833 684317447 /nfs/dbraw/zinc/31/74/47/684317447.db2.gz AFPNSKYQJPJIND-HDJSIYSDSA-N 1 1 343.387 2.167 20 5 EEBDMO C[C@@H](Nc1ncc([N+](=O)[O-])c2ccccc21)[C@@H]1C[N@@H+](C)CCN1C ZINC000895247921 684384444 /nfs/dbraw/zinc/38/44/44/684384444.db2.gz KERLVWXXPVJWGR-WBMJQRKESA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@@H](Nc1ncc([N+](=O)[O-])c2ccccc21)[C@@H]1CN(C)CC[N@@H+]1C ZINC000895247921 684384446 /nfs/dbraw/zinc/38/44/46/684384446.db2.gz KERLVWXXPVJWGR-WBMJQRKESA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@@H](Nc1ncc([N+](=O)[O-])c2ccccc21)[C@@H]1CN(C)CC[N@H+]1C ZINC000895247921 684384449 /nfs/dbraw/zinc/38/44/49/684384449.db2.gz KERLVWXXPVJWGR-WBMJQRKESA-N 1 1 329.404 2.189 20 5 EEBDMO Cc1ccc(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001034643239 1196464087 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1189067578 /nfs/dbraw/zinc/06/75/78/1189067578.db2.gz YNKILSCUWKDJRD-HZPDHXFCSA-N 1 1 345.424 2.286 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])s1)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000870079209 1200447680 /nfs/dbraw/zinc/44/76/80/1200447680.db2.gz WUYSXLFTXPQNPZ-GFCCVEGCSA-N 1 1 333.369 2.149 20 5 EEBDMO C[N@@H+]1CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H](CO)C1 ZINC000879001007 1200796186 /nfs/dbraw/zinc/79/61/86/1200796186.db2.gz NDHUYZDEUGGRGE-NSHDSACASA-N 1 1 334.203 2.010 20 5 EEBDMO C[N@H+]1CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H](CO)C1 ZINC000879001007 1200796191 /nfs/dbraw/zinc/79/61/91/1200796191.db2.gz NDHUYZDEUGGRGE-NSHDSACASA-N 1 1 334.203 2.010 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(C)(C)O)CC1 ZINC000879626775 1201178538 /nfs/dbraw/zinc/17/85/38/1201178538.db2.gz QMODCUJDZGFMRN-GFCCVEGCSA-N 1 1 335.404 2.405 20 5 EEBDMO Cc1[nH+]ccn1CCCCNC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC000866056802 1201416990 /nfs/dbraw/zinc/41/69/90/1201416990.db2.gz NJHQAIBEZSRTKI-UHFFFAOYSA-N 1 1 334.351 2.378 20 5 EEBDMO C[C@@]([NH3+])(C(=O)N1CCc2cccc(F)c2C1)c1cccc([N+](=O)[O-])c1 ZINC000867979641 1201718848 /nfs/dbraw/zinc/71/88/48/1201718848.db2.gz LJXAGBDLHCJRAB-SFHVURJKSA-N 1 1 343.358 2.493 20 5 EEBDMO COc1c(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000886597599 1202530251 /nfs/dbraw/zinc/53/02/51/1202530251.db2.gz HNBZXNSTNVSRTL-CYBMUJFWSA-N 1 1 335.404 2.406 20 5 EEBDMO COc1c(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000886597599 1202530252 /nfs/dbraw/zinc/53/02/52/1202530252.db2.gz HNBZXNSTNVSRTL-CYBMUJFWSA-N 1 1 335.404 2.406 20 5 EEBDMO C[N@H+](CCn1cccn1)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777955524 1206606647 /nfs/dbraw/zinc/60/66/47/1206606647.db2.gz NEQBSWZKGJUEJW-UHFFFAOYSA-N 1 1 326.360 2.244 20 5 EEBDMO C[N@@H+](CCn1cccn1)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777955524 1206606648 /nfs/dbraw/zinc/60/66/48/1206606648.db2.gz NEQBSWZKGJUEJW-UHFFFAOYSA-N 1 1 326.360 2.244 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000078231728 1210118070 /nfs/dbraw/zinc/11/80/70/1210118070.db2.gz CFFCAGFLMFPEAR-LLVKDONJSA-N 1 1 336.348 2.026 20 5 EEBDMO Cc1ccc(C)c(C[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001045436597 1233744791 /nfs/dbraw/zinc/74/47/91/1233744791.db2.gz SSSDFDGILYHFNW-IAGOWNOFSA-N 1 1 345.443 2.439 20 5 EEBDMO O=C(NCC1=CC[N@@H+](CCC2CCCCC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001000674444 1240708376 /nfs/dbraw/zinc/70/83/76/1240708376.db2.gz OQXUBFHWHKWNIU-IAGOWNOFSA-N 1 1 335.448 2.370 20 5 EEBDMO O=C(NCC1=CC[N@H+](CCC2CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000674444 1240708383 /nfs/dbraw/zinc/70/83/83/1240708383.db2.gz OQXUBFHWHKWNIU-IAGOWNOFSA-N 1 1 335.448 2.370 20 5 EEBDMO O=C(NCC1=CC[N@@H+](CCC2CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000674444 1240708388 /nfs/dbraw/zinc/70/83/88/1240708388.db2.gz OQXUBFHWHKWNIU-IAGOWNOFSA-N 1 1 335.448 2.370 20 5 EEBDMO COC(=O)c1cccc([N+](=O)[O-])c1O[C@H]1[C@@H]2CCC[C@H]1C[N@H+](C)C2 ZINC001227124958 1301701584 /nfs/dbraw/zinc/70/15/84/1301701584.db2.gz ULOAUMWPQNRABU-JYAVWHMHSA-N 1 1 334.372 2.491 20 5 EEBDMO O=c1[nH]cnc(O[C@H]2CCC[N@@H+](Cc3ccccc3F)C2)c1[N+](=O)[O-] ZINC001228140727 1302122239 /nfs/dbraw/zinc/12/22/39/1302122239.db2.gz MLAVROHMQOXCPL-LBPRGKRZSA-N 1 1 348.334 2.273 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NC1(CNc2ncccc2[N+](=O)[O-])CCCC1 ZINC001103432124 1302952295 /nfs/dbraw/zinc/95/22/95/1302952295.db2.gz RUACFLSRRXKBCB-UHFFFAOYSA-N 1 1 349.435 2.171 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N[C@H]1CC[C@H](Nc2ncccc2[N+](=O)[O-])CC1 ZINC001103645327 1303183587 /nfs/dbraw/zinc/18/35/87/1303183587.db2.gz SAMWXDPGSLEDMH-HDJSIYSDSA-N 1 1 349.435 2.171 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H](CO)c2c(F)cccc2F)cc1 ZINC000782061114 1303941499 /nfs/dbraw/zinc/94/14/99/1303941499.db2.gz HXLHBIAJLMBYMO-GJZGRUSLSA-N 1 1 338.310 2.230 20 5 EEBDMO O=C(NCC1([NH2+]CCc2ccccc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530926 1305286988 /nfs/dbraw/zinc/28/69/88/1305286988.db2.gz ZDSHUNQMBSJANR-IAGOWNOFSA-N 1 1 345.443 2.303 20 5 EEBDMO C[N@H+](Cc1ccccc1)C[C@@H](O)CNCc1ccccc1[N+](=O)[O-] ZINC001120559166 1309610447 /nfs/dbraw/zinc/61/04/47/1309610447.db2.gz NVTWWJYLUDTXQE-KRWDZBQOSA-N 1 1 329.400 2.177 20 5 EEBDMO [NH3+]C1(c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)Cc2ccccc2C1 ZINC001248238760 1310868835 /nfs/dbraw/zinc/86/88/35/1310868835.db2.gz QKZPQRHZXIKVKF-UHFFFAOYSA-N 1 1 341.302 2.132 20 5 EEBDMO CC[C@@]1(CO)CCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839574283 1315217015 /nfs/dbraw/zinc/21/70/15/1315217015.db2.gz KTBCSAQVFFRJAM-HNNXBMFYSA-N 1 1 341.795 2.424 20 5 EEBDMO CC[C@@]1(CO)CCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839574283 1315217020 /nfs/dbraw/zinc/21/70/20/1315217020.db2.gz KTBCSAQVFFRJAM-HNNXBMFYSA-N 1 1 341.795 2.424 20 5 EEBDMO Cc1nn(C[N@@H+]2CCCO[C@@H](C(C)C)C2)c2ncc([N+](=O)[O-])cc12 ZINC000840095285 1315292419 /nfs/dbraw/zinc/29/24/19/1315292419.db2.gz IFYYTMWGZMBVNE-OAHLLOKOSA-N 1 1 333.392 2.352 20 5 EEBDMO Cc1nn(C[N@H+]2CCCO[C@@H](C(C)C)C2)c2ncc([N+](=O)[O-])cc12 ZINC000840095285 1315292424 /nfs/dbraw/zinc/29/24/24/1315292424.db2.gz IFYYTMWGZMBVNE-OAHLLOKOSA-N 1 1 333.392 2.352 20 5 EEBDMO Cc1cnn(C)c1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000842366275 1315690041 /nfs/dbraw/zinc/69/00/41/1315690041.db2.gz GKRSLBLIDXLFOD-HNNXBMFYSA-N 1 1 344.371 2.068 20 5 EEBDMO Cc1cnn(C)c1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000842366275 1315690045 /nfs/dbraw/zinc/69/00/45/1315690045.db2.gz GKRSLBLIDXLFOD-HNNXBMFYSA-N 1 1 344.371 2.068 20 5 EEBDMO Cc1ncc([N+](=O)[O-])cc1Nc1c[nH+]ccc1N1CCN(C)CC1 ZINC001249546001 1317113425 /nfs/dbraw/zinc/11/34/25/1317113425.db2.gz ZGXIXNHIRGULFQ-UHFFFAOYSA-N 1 1 328.376 2.189 20 5 EEBDMO Cn1cc2c(n1)CC[N@@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2 ZINC001254479326 1318084413 /nfs/dbraw/zinc/08/44/13/1318084413.db2.gz XTQDXUMSBYJKIE-UHFFFAOYSA-N 1 1 341.415 2.355 20 5 EEBDMO COc1nc(NCCC[N@H+]2CCCC[C@@H]2C)nc(OC)c1[N+](=O)[O-] ZINC001156929359 1318296346 /nfs/dbraw/zinc/29/63/46/1318296346.db2.gz UQFAAKGPZYHMAS-NSHDSACASA-N 1 1 339.396 2.078 20 5 EEBDMO COc1cc(N2CCC([NH+]3CCC(=O)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256094052 1318645946 /nfs/dbraw/zinc/64/59/46/1318645946.db2.gz VBZXVDPGVYILSA-UHFFFAOYSA-N 1 1 333.388 2.237 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)nc(N[C@H]2CCC[C@@H]2[NH+]2CCOCC2)c1 ZINC001160720990 1320246454 /nfs/dbraw/zinc/24/64/54/1320246454.db2.gz TZQWYIKVZHREQK-RYUDHWBXSA-N 1 1 326.784 2.308 20 5 EEBDMO O=C(NCCC1(C[NH2+]CC2CCCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164494558 1321395759 /nfs/dbraw/zinc/39/57/59/1321395759.db2.gz MFUAGUUNJRNHEA-HZPDHXFCSA-N 1 1 337.464 2.498 20 5 EEBDMO C[N@@H+](C1CN(c2nc(Cl)c(Cl)cc2[N+](=O)[O-])C1)[C@@H]1CCOC1 ZINC001165204245 1321471455 /nfs/dbraw/zinc/47/14/55/1321471455.db2.gz XUCVQZLQRKXMCD-MRVPVSSYSA-N 1 1 347.202 2.206 20 5 EEBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1cc([N+](=O)[O-])cc(Cl)n1)CC2 ZINC001166032002 1321638790 /nfs/dbraw/zinc/63/87/90/1321638790.db2.gz IVWFTUUQCSHWRC-UHFFFAOYSA-N 1 1 339.783 2.278 20 5 EEBDMO CCOC(=O)[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC001308119767 1331565818 /nfs/dbraw/zinc/56/58/18/1331565818.db2.gz CTOPLSSOACYZSQ-CYBMUJFWSA-N 1 1 349.387 2.117 20 5 EEBDMO COC(=O)CC[N@@H+](Cc1ccc(O)c(OC)c1[N+](=O)[O-])C(C)C ZINC001308634858 1331600519 /nfs/dbraw/zinc/60/05/19/1331600519.db2.gz NJZYVBPIFMHRIQ-UHFFFAOYSA-N 1 1 326.349 2.083 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC001318079257 1332468735 /nfs/dbraw/zinc/46/87/35/1332468735.db2.gz ZZLNHHMNTNCSHB-CHWSQXEVSA-N 1 1 334.420 2.487 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001318829990 1332606041 /nfs/dbraw/zinc/60/60/41/1332606041.db2.gz ZDFXBOCCMVMICT-HZPDHXFCSA-N 1 1 330.388 2.247 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)nc1-c1ccncc1 ZINC001319328682 1332685259 /nfs/dbraw/zinc/68/52/59/1332685259.db2.gz PJOCVTRKAYKLIJ-ZBFHGGJFSA-N 1 1 343.387 2.312 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)nc1-c1ccncc1 ZINC001319328682 1332685262 /nfs/dbraw/zinc/68/52/62/1332685262.db2.gz PJOCVTRKAYKLIJ-ZBFHGGJFSA-N 1 1 343.387 2.312 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC001326515616 1334108304 /nfs/dbraw/zinc/10/83/04/1334108304.db2.gz IDGFWHSGUPXMQS-KRWDZBQOSA-N 1 1 332.404 2.194 20 5 EEBDMO Cc1cc(N2CCC(C[N@H+](CCO)C(C)C)CC2)ncc1[N+](=O)[O-] ZINC001333206231 1335982887 /nfs/dbraw/zinc/98/28/87/1335982887.db2.gz UMXYTFLSCOFJAI-UHFFFAOYSA-N 1 1 336.436 2.217 20 5 EEBDMO CC1(C)CC[N@@H+](CCNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1 ZINC001337744288 1336732799 /nfs/dbraw/zinc/73/27/99/1336732799.db2.gz ZNODXFLWZUZXKF-UHFFFAOYSA-N 1 1 327.331 2.335 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC2(CC1)C[NH2+]CCO2 ZINC001575813235 1343892795 /nfs/dbraw/zinc/89/27/95/1343892795.db2.gz QGMHRCXZPJCVCM-UHFFFAOYSA-N 1 1 349.431 2.336 20 5 EEBDMO Cc1cccn2c(NC(=O)[C@](C)([NH3+])c3cccc([N+](=O)[O-])c3)cnc12 ZINC001579806402 1344415920 /nfs/dbraw/zinc/41/59/20/1344415920.db2.gz AOBHGUOGAMTBMK-QGZVFWFLSA-N 1 1 339.355 2.364 20 5 EEBDMO [NH3+]Cc1nc(C(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)cs1 ZINC001580352723 1344512272 /nfs/dbraw/zinc/51/22/72/1344512272.db2.gz FGUSTDGGLPWLNR-UHFFFAOYSA-N 1 1 329.341 2.311 20 5 EEBDMO C[N@H+]1CCCC[C@H](CNc2cc(F)c(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001591187692 1349446999 /nfs/dbraw/zinc/44/69/99/1349446999.db2.gz WTWJZPIRJYCVBT-SNVBAGLBSA-N 1 1 349.370 2.058 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC001607084440 1351410782 /nfs/dbraw/zinc/41/07/82/1351410782.db2.gz GFSBGCCXWWQGKF-LBPRGKRZSA-N 1 1 343.391 2.204 20 5 EEBDMO CCC[N@H+]1CC[C@H](NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000851821774 1369247507 /nfs/dbraw/zinc/24/75/07/1369247507.db2.gz ZRGKOLVJEVDTNJ-NSHDSACASA-N 1 1 347.824 2.011 20 5 EEBDMO COC(=O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(C)C ZINC001117993326 1371771146 /nfs/dbraw/zinc/77/11/46/1371771146.db2.gz SPCNXOQVEYAZEE-UHFFFAOYSA-N 1 1 337.376 2.054 20 5 EEBDMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)O[C@H]1C[C@@H]([NH+]2CCOCC2)C1 ZINC000838911528 1372875544 /nfs/dbraw/zinc/87/55/44/1372875544.db2.gz COVCFRIHGJQODD-SFEDUPDISA-N 1 1 332.356 2.014 20 5 EEBDMO C[N@H+](CCNC(=O)c1ocnc1C1CC1)Cc1cccc([N+](=O)[O-])c1 ZINC001753063761 1406657040 /nfs/dbraw/zinc/65/70/40/1406657040.db2.gz CJXXSVDYWZMDSK-UHFFFAOYSA-N 1 1 344.371 2.322 20 5 EEBDMO C[N@@H+](CCNC(=O)c1ocnc1C1CC1)Cc1cccc([N+](=O)[O-])c1 ZINC001753063761 1406657044 /nfs/dbraw/zinc/65/70/44/1406657044.db2.gz CJXXSVDYWZMDSK-UHFFFAOYSA-N 1 1 344.371 2.322 20 5 EEBDMO CCN(CCc1ccccn1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC001577728622 1403672301 /nfs/dbraw/zinc/67/23/01/1403672301.db2.gz IUVMOQHXVBELDU-SFHVURJKSA-N 1 1 342.399 2.255 20 5 EEBDMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc([N+](=O)[O-])ccn1)C2 ZINC001164814879 720073615 /nfs/dbraw/zinc/07/36/15/720073615.db2.gz XSOOBBKEGVYATF-QAPCUYQASA-N 1 1 346.431 2.175 20 5 EEBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000906452456 783923051 /nfs/dbraw/zinc/92/30/51/783923051.db2.gz SQXRBFVNZMSJLL-GFCCVEGCSA-N 1 1 349.387 2.126 20 5 EEBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000906452456 783923055 /nfs/dbraw/zinc/92/30/55/783923055.db2.gz SQXRBFVNZMSJLL-GFCCVEGCSA-N 1 1 349.387 2.126 20 5 EEBDMO Cc1nn(CN2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)cc1[N+](=O)[O-] ZINC000819896503 785704672 /nfs/dbraw/zinc/70/46/72/785704672.db2.gz DLPTXCXMDNLPRW-FUHWJXTLSA-N 1 1 341.415 2.264 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NC/C=C\CNc1ccccc1[N+](=O)[O-] ZINC001107275208 786686138 /nfs/dbraw/zinc/68/61/38/786686138.db2.gz QNVPUMVYVNWREB-SREVYHEPSA-N 1 1 334.420 2.411 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccc4nonc4c3)CC2)cc1 ZINC000821342947 786706780 /nfs/dbraw/zinc/70/67/80/786706780.db2.gz RKSKXQUAHHGHOU-UHFFFAOYSA-N 1 1 339.355 2.453 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC/C=C\CNc1ccc(F)cc1[N+](=O)[O-] ZINC001107321648 786858625 /nfs/dbraw/zinc/85/86/25/786858625.db2.gz IMDUKTQQGHFWAD-PLNGDYQASA-N 1 1 338.383 2.160 20 5 EEBDMO C[N@@H+](CC(=O)NC/C=C\CNc1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC001107564904 787666153 /nfs/dbraw/zinc/66/61/53/787666153.db2.gz JZUVVLDYYBJMIZ-IHWYPQMZSA-N 1 1 332.404 2.163 20 5 EEBDMO CC(C)[N@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000915202452 795725688 /nfs/dbraw/zinc/72/56/88/795725688.db2.gz IQGUMTOACBGFMD-KRWDZBQOSA-N 1 1 346.387 2.192 20 5 EEBDMO CC(C)[N@@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000915202452 795725693 /nfs/dbraw/zinc/72/56/93/795725693.db2.gz IQGUMTOACBGFMD-KRWDZBQOSA-N 1 1 346.387 2.192 20 5 EEBDMO CN(C)C(=O)[C@@H]1CCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922583 797153193 /nfs/dbraw/zinc/15/31/93/797153193.db2.gz YWFWSBALPSTSFX-WBVHZDCISA-N 1 1 331.416 2.395 20 5 EEBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@@H+]3CCC[C@@H]3CO)CC2)c(F)c1 ZINC001173010241 797196089 /nfs/dbraw/zinc/19/60/89/797196089.db2.gz OSINDEGUYWNBSL-GFCCVEGCSA-N 1 1 341.358 2.299 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CC[N@H+]3CCC[C@@H]3C2)c1F ZINC001173190978 797281756 /nfs/dbraw/zinc/28/17/56/797281756.db2.gz YWSUFZHNGNDMPG-CHWSQXEVSA-N 1 1 337.395 2.454 20 5 EEBDMO Cc1nc(C(=O)NC2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)co1 ZINC001002639000 798368366 /nfs/dbraw/zinc/36/83/66/798368366.db2.gz KDCXOHSSVRDBCY-UHFFFAOYSA-N 1 1 344.371 2.286 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CCC3CCCC3)C[C@H]2CC1 ZINC000946589189 801539707 /nfs/dbraw/zinc/53/97/07/801539707.db2.gz LLJXSWPPAAYYNR-XMTFNYHQSA-N 1 1 349.475 2.402 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](CCC3CCCC3)C[C@H]2CC1 ZINC000946589189 801539709 /nfs/dbraw/zinc/53/97/09/801539709.db2.gz LLJXSWPPAAYYNR-XMTFNYHQSA-N 1 1 349.475 2.402 20 5 EEBDMO 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ZINC000375903642 167222634 /nfs/dbraw/zinc/22/26/34/167222634.db2.gz IMISSMUPNKPMHD-SFHVURJKSA-N 1 1 332.448 2.195 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000275764090 269140122 /nfs/dbraw/zinc/14/01/22/269140122.db2.gz PBSJYHHDZWKMHB-TZMCWYRMSA-N 1 1 334.376 2.352 20 5 EEBDMO C[C@@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000277551098 269161727 /nfs/dbraw/zinc/16/17/27/269161727.db2.gz CFIDYBOERULLKJ-TUAOUCFPSA-N 1 1 345.403 2.349 20 5 EEBDMO CS(=O)(=O)[C@H]1CCCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000277674222 269170564 /nfs/dbraw/zinc/17/05/64/269170564.db2.gz FVYZJLZORLQWCC-HNNXBMFYSA-N 1 1 326.418 2.036 20 5 EEBDMO CS(=O)(=O)[C@H]1CCCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000277674222 269170565 /nfs/dbraw/zinc/17/05/65/269170565.db2.gz FVYZJLZORLQWCC-HNNXBMFYSA-N 1 1 326.418 2.036 20 5 EEBDMO Cc1ccc(C(=O)N2CC[N@@H+](C3CCOCC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000278285387 269221361 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EEBDMO O=C1O[C@H](C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)CC12CCC2 ZINC000191927591 275027355 /nfs/dbraw/zinc/02/73/55/275027355.db2.gz KZXGRALFFNHGRN-AWEZNQCLSA-N 1 1 345.399 2.203 20 5 EEBDMO O=C(NC[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1)C(F)(F)F ZINC000289458319 275117627 /nfs/dbraw/zinc/11/76/27/275117627.db2.gz LSLLOCAHEXUUNR-NSHDSACASA-N 1 1 345.321 2.485 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@@H](C2CC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000289506091 275122759 /nfs/dbraw/zinc/12/27/59/275122759.db2.gz UQXDLUIGLXIQFT-GFCCVEGCSA-N 1 1 347.371 2.384 20 5 EEBDMO O=C(C[N@H+]1CCC[C@@H](C2CC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000289506091 275122760 /nfs/dbraw/zinc/12/27/60/275122760.db2.gz UQXDLUIGLXIQFT-GFCCVEGCSA-N 1 1 347.371 2.384 20 5 EEBDMO C[C@@H]1[C@H](N2CCOCC2)CC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000291712546 275332738 /nfs/dbraw/zinc/33/27/38/275332738.db2.gz ZYYSGEKZBHXONB-JPQUEUOBSA-N 1 1 331.416 2.403 20 5 EEBDMO C[C@@H]1[C@H]([NH+]2CCOCC2)CCN1C/C=C/c1ccccc1[N+](=O)[O-] 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GMYICKJYJOVYFM-UHFFFAOYSA-N 1 1 348.407 2.001 20 5 EEBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000548394548 318385015 /nfs/dbraw/zinc/38/50/15/318385015.db2.gz QVIMLVVNCVPEOW-OAHLLOKOSA-N 1 1 349.387 2.174 20 5 EEBDMO O=C(C[N@H+]1CCC[C@@H]1[C@@H]1CCCOC1)Nc1ccccc1[N+](=O)[O-] ZINC000574873214 320065210 /nfs/dbraw/zinc/06/52/10/320065210.db2.gz GNBKJVROQARBPM-UKRRQHHQSA-N 1 1 333.388 2.424 20 5 EEBDMO CN(CC[N@@H+](C)C1CC1)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000184786987 465026289 /nfs/dbraw/zinc/02/62/89/465026289.db2.gz USNUMJVMGNFBIB-UHFFFAOYSA-N 1 1 346.431 2.361 20 5 EEBDMO CCS(=O)(=O)C[C@H](C)[N@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000113002020 462563785 /nfs/dbraw/zinc/56/37/85/462563785.db2.gz OSEUFIHAENIHTI-ZDUSSCGKSA-N 1 1 344.433 2.119 20 5 EEBDMO CCS(=O)(=O)C[C@H](C)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000113002020 462563790 /nfs/dbraw/zinc/56/37/90/462563790.db2.gz OSEUFIHAENIHTI-ZDUSSCGKSA-N 1 1 344.433 2.119 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1OC[C@@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000153865126 462701905 /nfs/dbraw/zinc/70/19/05/462701905.db2.gz OYBPBRPJYALCOM-INIZCTEOSA-N 1 1 346.383 2.475 20 5 EEBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000075613741 462741224 /nfs/dbraw/zinc/74/12/24/462741224.db2.gz JSFLUJRCIAKVBY-CABCVRRESA-N 1 1 347.415 2.227 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H]([C@@H](C)O)C2)cccc1[N+](=O)[O-] ZINC000089931126 462745571 /nfs/dbraw/zinc/74/55/71/462745571.db2.gz FZQZTDBXJVNAIK-MJBXVCDLSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H]([C@@H](C)O)C2)cccc1[N+](=O)[O-] ZINC000089931126 462745578 /nfs/dbraw/zinc/74/55/78/462745578.db2.gz FZQZTDBXJVNAIK-MJBXVCDLSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1 ZINC000120286660 462983034 /nfs/dbraw/zinc/98/30/34/462983034.db2.gz DQMZKXHOEKOUIR-DOMZBBRYSA-N 1 1 336.392 2.052 20 5 EEBDMO 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ZINC000069561892 463275437 /nfs/dbraw/zinc/27/54/37/463275437.db2.gz PNCBGYMRTIVWAV-LBPRGKRZSA-N 1 1 349.412 2.435 20 5 EEBDMO O=C(NCC[N@@H+]1CCc2ccccc2C1)c1ccccc1[N+](=O)[O-] ZINC000031337861 463336020 /nfs/dbraw/zinc/33/60/20/463336020.db2.gz DEAUMVUXHCDVQF-UHFFFAOYSA-N 1 1 325.368 2.383 20 5 EEBDMO O=C(NCC[N@H+]1CCc2ccccc2C1)c1ccccc1[N+](=O)[O-] ZINC000031337861 463336024 /nfs/dbraw/zinc/33/60/24/463336024.db2.gz DEAUMVUXHCDVQF-UHFFFAOYSA-N 1 1 325.368 2.383 20 5 EEBDMO C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1Cc2ccccc2C1 ZINC000141180440 463350387 /nfs/dbraw/zinc/35/03/87/463350387.db2.gz PPAPTONQWLOQSC-SFHVURJKSA-N 1 1 342.395 2.434 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000056122657 463377862 /nfs/dbraw/zinc/37/78/62/463377862.db2.gz SINVPWQVTWNSKX-UHFFFAOYSA-N 1 1 345.403 2.498 20 5 EEBDMO O=[N+]([O-])c1ccc(NCCC[NH+]2CCOCC2)c(Br)c1 ZINC000043596483 463649347 /nfs/dbraw/zinc/64/93/47/463649347.db2.gz NRFGKHDSGVIEPA-UHFFFAOYSA-N 1 1 344.209 2.492 20 5 EEBDMO Nc1ccc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000126608437 463651690 /nfs/dbraw/zinc/65/16/90/463651690.db2.gz GEFSNJBILZYEBG-XJKSGUPXSA-N 1 1 344.415 2.266 20 5 EEBDMO Cn1cc(C[N@H+]2CC[C@](C)(C[NH3+])C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000261647553 463814927 /nfs/dbraw/zinc/81/49/27/463814927.db2.gz GYMJBPYUNQKICU-QGZVFWFLSA-N 1 1 329.404 2.166 20 5 EEBDMO Cn1cc(CN2CC[C@](C)(C[NH3+])C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000261647553 463814931 /nfs/dbraw/zinc/81/49/31/463814931.db2.gz GYMJBPYUNQKICU-QGZVFWFLSA-N 1 1 329.404 2.166 20 5 EEBDMO O=C(C[N@@H+](CCCO)Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000268951662 463823891 /nfs/dbraw/zinc/82/38/91/463823891.db2.gz FRFYECULDBKRGC-UHFFFAOYSA-N 1 1 343.383 2.418 20 5 EEBDMO O=C(C[N@H+](CCCO)Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000268951662 463823895 /nfs/dbraw/zinc/82/38/95/463823895.db2.gz FRFYECULDBKRGC-UHFFFAOYSA-N 1 1 343.383 2.418 20 5 EEBDMO CCc1[nH]nc(C(=O)N2CC[NH+](CC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000171804156 463928354 /nfs/dbraw/zinc/92/83/54/463928354.db2.gz JFROLRAOAKDYHA-UHFFFAOYSA-N 1 1 349.435 2.218 20 5 EEBDMO CC(=O)c1ccc(N2CC[N@@H+](C3CCOCC3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000278884273 464005027 /nfs/dbraw/zinc/00/50/27/464005027.db2.gz WQIXNBWCINJOIV-CYBMUJFWSA-N 1 1 347.415 2.487 20 5 EEBDMO COC[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000591016556 468392534 /nfs/dbraw/zinc/39/25/34/468392534.db2.gz AOFYHFDCMBKYEN-ZDUSSCGKSA-N 1 1 337.376 2.043 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000172804395 464145774 /nfs/dbraw/zinc/14/57/74/464145774.db2.gz ACASPIGHRVNSFW-CZUORRHYSA-N 1 1 332.404 2.092 20 5 EEBDMO CC(C)c1ccc(C(=O)N2CC[NH+](CC(C)(C)O)CC2)cc1[N+](=O)[O-] ZINC000188124048 464206672 /nfs/dbraw/zinc/20/66/72/464206672.db2.gz MFTPPWFKRWRACL-UHFFFAOYSA-N 1 1 349.431 2.247 20 5 EEBDMO Cc1nnc([C@@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)[nH]1 ZINC000591053731 468400135 /nfs/dbraw/zinc/40/01/35/468400135.db2.gz HBKIBTYERPJBNA-CYBMUJFWSA-N 1 1 331.376 2.280 20 5 EEBDMO Cc1n[nH]c([C@@H]2CC[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000591053731 468400141 /nfs/dbraw/zinc/40/01/41/468400141.db2.gz HBKIBTYERPJBNA-CYBMUJFWSA-N 1 1 331.376 2.280 20 5 EEBDMO Cc1n[nH]c([C@@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000591053731 468400144 /nfs/dbraw/zinc/40/01/44/468400144.db2.gz HBKIBTYERPJBNA-CYBMUJFWSA-N 1 1 331.376 2.280 20 5 EEBDMO Cc1nc([C@@H]2CC[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)n[nH]1 ZINC000591053731 468400151 /nfs/dbraw/zinc/40/01/51/468400151.db2.gz HBKIBTYERPJBNA-CYBMUJFWSA-N 1 1 331.376 2.280 20 5 EEBDMO Cc1nc([C@@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)n[nH]1 ZINC000591053731 468400155 /nfs/dbraw/zinc/40/01/55/468400155.db2.gz HBKIBTYERPJBNA-CYBMUJFWSA-N 1 1 331.376 2.280 20 5 EEBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000188482018 464292757 /nfs/dbraw/zinc/29/27/57/464292757.db2.gz UQUFYGMFICJTDL-CYBMUJFWSA-N 1 1 334.420 2.275 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173635020 464297431 /nfs/dbraw/zinc/29/74/31/464297431.db2.gz OCWWJGYIBBASDC-UHFFFAOYSA-N 1 1 335.404 2.305 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000292842181 464360906 /nfs/dbraw/zinc/36/09/06/464360906.db2.gz BGBXJPCYWWNNHX-RDTXWAMCSA-N 1 1 346.431 2.340 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000284962902 464409005 /nfs/dbraw/zinc/40/90/05/464409005.db2.gz XJIPGOJGNCKDTQ-WBVHZDCISA-N 1 1 345.399 2.127 20 5 EEBDMO O=C(C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000284962902 464409011 /nfs/dbraw/zinc/40/90/11/464409011.db2.gz XJIPGOJGNCKDTQ-WBVHZDCISA-N 1 1 345.399 2.127 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1 ZINC000281507899 464483122 /nfs/dbraw/zinc/48/31/22/464483122.db2.gz IJHACHSIFNPLNE-KGLIPLIRSA-N 1 1 347.415 2.414 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(c3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)[C@H]2C1 ZINC000272190813 464511913 /nfs/dbraw/zinc/51/19/13/464511913.db2.gz MIXYRZCDGHENOO-ZBEGNZNMSA-N 1 1 330.388 2.010 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(c3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000272208097 464517992 /nfs/dbraw/zinc/51/79/92/464517992.db2.gz PTRNUODGJDRUNL-SJKOYZFVSA-N 1 1 344.415 2.017 20 5 EEBDMO CC[N@H+](Cc1ccccn1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181995988 464547631 /nfs/dbraw/zinc/54/76/31/464547631.db2.gz RRZYBZVFFKUWOA-HNNXBMFYSA-N 1 1 331.372 2.252 20 5 EEBDMO Cc1cc(OCC(=O)N(C)[C@H]2CC[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000281716869 464558327 /nfs/dbraw/zinc/55/83/27/464558327.db2.gz QKTPGGGUCJPJBD-HIFRSBDPSA-N 1 1 335.404 2.081 20 5 EEBDMO C[N@@H+](Cc1cc(=O)oc2ccc3ccccc3c12)[C@@H]1COC[C@H]1O ZINC000285421971 464558712 /nfs/dbraw/zinc/55/87/12/464558712.db2.gz DSKILCRYCWKEBX-HZPDHXFCSA-N 1 1 325.364 2.138 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCSC[C@H](C)C1 ZINC000190475154 464653420 /nfs/dbraw/zinc/65/34/20/464653420.db2.gz LMLLVXVHEHSWSU-LLVKDONJSA-N 1 1 339.417 2.227 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCSC[C@H](C)C1 ZINC000190475154 464653428 /nfs/dbraw/zinc/65/34/28/464653428.db2.gz LMLLVXVHEHSWSU-LLVKDONJSA-N 1 1 339.417 2.227 20 5 EEBDMO O=[N+]([O-])c1ccn(CCN2CCC[N@@H+](CC3CCCCC3)CC2)n1 ZINC000176214317 464721189 /nfs/dbraw/zinc/72/11/89/464721189.db2.gz YKQADWLYBFGVEO-UHFFFAOYSA-N 1 1 335.452 2.379 20 5 EEBDMO C[C@H]1CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+](C2CC2)C1 ZINC000295452129 464840399 /nfs/dbraw/zinc/84/03/99/464840399.db2.gz WPQOFNPISGQDDI-LLVKDONJSA-N 1 1 343.387 2.027 20 5 EEBDMO C[C@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@@H+](C2CC2)C1 ZINC000295452129 464840406 /nfs/dbraw/zinc/84/04/06/464840406.db2.gz WPQOFNPISGQDDI-LLVKDONJSA-N 1 1 343.387 2.027 20 5 EEBDMO C[C@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@H+](C2CC2)C1 ZINC000295452129 464840409 /nfs/dbraw/zinc/84/04/09/464840409.db2.gz WPQOFNPISGQDDI-LLVKDONJSA-N 1 1 343.387 2.027 20 5 EEBDMO O=[N+]([O-])c1ccc(C[NH2+][C@]2(CO)CCOc3ccccc32)cc1F ZINC000282522356 464851291 /nfs/dbraw/zinc/85/12/91/464851291.db2.gz POWZQMOEELIGPS-KRWDZBQOSA-N 1 1 332.331 2.494 20 5 EEBDMO C[C@H]1CN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000295538796 464874607 /nfs/dbraw/zinc/87/46/07/464874607.db2.gz KJQBQHFNJPNVLI-CQSZACIVSA-N 1 1 347.415 2.306 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C[N@H+]1C1CC1 ZINC000342935571 465398686 /nfs/dbraw/zinc/39/86/86/465398686.db2.gz SMINHBIDGNBJON-QWRGUYRKSA-N 1 1 328.372 2.431 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000348201573 465487457 /nfs/dbraw/zinc/48/74/57/465487457.db2.gz QAMDVQBHBMVTSC-INIZCTEOSA-N 1 1 333.388 2.059 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@H](CNc2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000352349893 465517179 /nfs/dbraw/zinc/51/71/79/465517179.db2.gz HWDNDOJELDOCOJ-OAHLLOKOSA-N 1 1 344.415 2.912 20 5 EEBDMO C[N@H+]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000371353315 465737884 /nfs/dbraw/zinc/73/78/84/465737884.db2.gz IICUPTKHAKGWFC-IRXDYDNUSA-N 1 1 325.368 2.422 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)c1 ZINC000330678298 465758464 /nfs/dbraw/zinc/75/84/64/465758464.db2.gz JXGFTWAJLNHHLU-ZIAGYGMSSA-N 1 1 335.404 2.223 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000338052542 465781502 /nfs/dbraw/zinc/78/15/02/465781502.db2.gz KTZGCCRILCIVGK-UHFFFAOYSA-N 1 1 331.376 2.032 20 5 EEBDMO C[C@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1cncc(F)c1 ZINC000361130834 465786595 /nfs/dbraw/zinc/78/65/95/465786595.db2.gz HGRZJSYAOIIRQC-NSHDSACASA-N 1 1 344.346 2.369 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+]([C@@H]3CCOC3)CC2)cc1OC(F)F ZINC000366859466 465979884 /nfs/dbraw/zinc/97/98/84/465979884.db2.gz YEPULOGWJLXHGR-GFCCVEGCSA-N 1 1 343.330 2.107 20 5 EEBDMO CC[N@@H+]1CCCN(c2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000301894999 466055492 /nfs/dbraw/zinc/05/54/92/466055492.db2.gz PQLDFGHDOGRZQW-UHFFFAOYSA-N 1 1 329.198 2.284 20 5 EEBDMO CC[N@H+]1CCCN(c2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000301894999 466055496 /nfs/dbraw/zinc/05/54/96/466055496.db2.gz PQLDFGHDOGRZQW-UHFFFAOYSA-N 1 1 329.198 2.284 20 5 EEBDMO CCOC(=O)C1CCC([N@@H+](CC)CCn2ccc([N+](=O)[O-])n2)CC1 ZINC000338373536 466069694 /nfs/dbraw/zinc/06/96/94/466069694.db2.gz ZCKCOWLBJVDCPU-UHFFFAOYSA-N 1 1 338.408 2.235 20 5 EEBDMO Cc1c(C(=O)N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000371994921 466107759 /nfs/dbraw/zinc/10/77/59/466107759.db2.gz LZTIBJAERUAPJB-DOTOQJQBSA-N 1 1 347.415 2.276 20 5 EEBDMO COCCCn1nccc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000338430713 466121287 /nfs/dbraw/zinc/12/12/87/466121287.db2.gz CPBXEFFBZMNFGJ-UHFFFAOYSA-N 1 1 334.376 2.126 20 5 EEBDMO COCC[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)C1 ZINC000591529211 468480226 /nfs/dbraw/zinc/48/02/26/468480226.db2.gz GHRDMXKURXSSJQ-CQSZACIVSA-N 1 1 335.404 2.052 20 5 EEBDMO Cn1c(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000340714570 466282811 /nfs/dbraw/zinc/28/28/11/466282811.db2.gz UROZTFJVQBAMMQ-HNNXBMFYSA-N 1 1 342.399 2.328 20 5 EEBDMO Cc1cc(N2C[C@H]3OCC[N@H+](C)[C@@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000338723704 466336125 /nfs/dbraw/zinc/33/61/25/466336125.db2.gz GXTXINPNQDNQKY-ZIAGYGMSSA-N 1 1 345.321 2.441 20 5 EEBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2c([N+](=O)[O-])ncn2C)C1 ZINC000363447191 466409268 /nfs/dbraw/zinc/40/92/68/466409268.db2.gz ADELMCSWEWCUNB-GJZGRUSLSA-N 1 1 335.452 2.415 20 5 EEBDMO C[N@H+](Cc1ccc(Cl)c(F)c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000305709900 466431757 /nfs/dbraw/zinc/43/17/57/466431757.db2.gz XFJGMYJLHHEVEM-GFCCVEGCSA-N 1 1 342.758 2.077 20 5 EEBDMO COCC1(C)CC[NH+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000332256263 466474578 /nfs/dbraw/zinc/47/45/78/466474578.db2.gz CQTIIDHSGFLAMH-UHFFFAOYSA-N 1 1 347.415 2.232 20 5 EEBDMO O=C1CCCN1C[C@H]1CCCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000362136760 466581473 /nfs/dbraw/zinc/58/14/73/466581473.db2.gz MSOSEJZDYDKQMA-SJORKVTESA-N 1 1 347.415 2.105 20 5 EEBDMO C[C@@]12CCC[N@@H+]1C[C@@H](c1noc(Cc3cccc([N+](=O)[O-])c3)n1)OC2 ZINC000347359160 466587899 /nfs/dbraw/zinc/58/78/99/466587899.db2.gz ZKAQFOQWEPQTTH-YOEHRIQHSA-N 1 1 344.371 2.494 20 5 EEBDMO C[C@@]12CCC[N@H+]1C[C@@H](c1noc(Cc3cccc([N+](=O)[O-])c3)n1)OC2 ZINC000347359160 466587902 /nfs/dbraw/zinc/58/79/02/466587902.db2.gz ZKAQFOQWEPQTTH-YOEHRIQHSA-N 1 1 344.371 2.494 20 5 EEBDMO C[NH+](C)[C@H](C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000354507158 466618601 /nfs/dbraw/zinc/61/86/01/466618601.db2.gz VCOVMWREKVSVKX-HNNXBMFYSA-N 1 1 339.355 2.713 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)c1 ZINC000374796346 466746667 /nfs/dbraw/zinc/74/66/67/466746667.db2.gz UXNKYPNARQWONI-OLZOCXBDSA-N 1 1 333.388 2.302 20 5 EEBDMO CCOC(=O)C[C@@H](C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411497787 466836535 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333.388 2.160 20 5 EEBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000267166808 256033638 /nfs/dbraw/zinc/03/36/38/256033638.db2.gz BDTRBWLNVUPRPT-QGZVFWFLSA-N 1 1 342.399 2.129 20 5 EEBDMO Cc1nn(C)c(NC2CCN(c3cc(C)[nH+]c(C)n3)CC2)c1[N+](=O)[O-] ZINC000267427936 256058308 /nfs/dbraw/zinc/05/83/08/256058308.db2.gz VZVDUZLPHNVWNG-UHFFFAOYSA-N 1 1 345.407 2.124 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000270373435 256128331 /nfs/dbraw/zinc/12/83/31/256128331.db2.gz NHSUZTZFJGENMG-GTNSWQLSSA-N 1 1 342.399 2.218 20 5 EEBDMO COc1ccc(NC(=O)[C@H]2CCC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000272983420 256254378 /nfs/dbraw/zinc/25/43/78/256254378.db2.gz UYPRHRNUZYHDMB-CQSZACIVSA-N 1 1 349.387 2.185 20 5 EEBDMO CC(C)C[N@H+]1CCCC[C@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O ZINC000119075966 221238912 /nfs/dbraw/zinc/23/89/12/221238912.db2.gz BDPGMPPWBMPETO-LBPRGKRZSA-N 1 1 335.408 2.011 20 5 EEBDMO CC[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000273725881 256321558 /nfs/dbraw/zinc/32/15/58/256321558.db2.gz HHLNLFOIHFZEND-OAHLLOKOSA-N 1 1 327.388 2.486 20 5 EEBDMO CCOC(=O)[C@@H](C)[C@@H](C)[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000274016726 256346138 /nfs/dbraw/zinc/34/61/38/256346138.db2.gz MHXGDMMLSWCSCW-WDEREUQCSA-N 1 1 348.359 2.322 20 5 EEBDMO CO[C@]1(C)C[C@H]([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1(C)C ZINC000072897775 286167390 /nfs/dbraw/zinc/16/73/90/286167390.db2.gz XLFFBCQJNAZJCS-WMLDXEAASA-N 1 1 335.404 2.329 20 5 EEBDMO O=[N+]([O-])c1ccn(CCN2CC[NH+](C/C=C\c3ccccc3)CC2)n1 ZINC000255546631 160397424 /nfs/dbraw/zinc/39/74/24/160397424.db2.gz GANMYOMZDBZICB-DAXSKMNVSA-N 1 1 341.415 2.122 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[NH+]2CCN(C/C=C\c3ccccc3)CC2)n1 ZINC000255546631 160397426 /nfs/dbraw/zinc/39/74/26/160397426.db2.gz GANMYOMZDBZICB-DAXSKMNVSA-N 1 1 341.415 2.122 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC000246845662 160297172 /nfs/dbraw/zinc/29/71/72/160297172.db2.gz TVELTAPKXZCCAZ-SWLSCSKDSA-N 1 1 349.387 2.043 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC000246845662 160297174 /nfs/dbraw/zinc/29/71/74/160297174.db2.gz TVELTAPKXZCCAZ-SWLSCSKDSA-N 1 1 349.387 2.043 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000246915064 160300642 /nfs/dbraw/zinc/30/06/42/160300642.db2.gz MTFYVIBNGJBYCB-JKIFEVAISA-N 1 1 346.431 2.338 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000342851087 161095715 /nfs/dbraw/zinc/09/57/15/161095715.db2.gz IGONZARNHCXYQG-SWLSCSKDSA-N 1 1 331.416 2.471 20 5 EEBDMO CCOC(=O)C[C@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000343617447 161151720 /nfs/dbraw/zinc/15/17/20/161151720.db2.gz KNKZNDBZJCLJRP-NSHDSACASA-N 1 1 338.360 2.235 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1 ZINC000344066306 161195547 /nfs/dbraw/zinc/19/55/47/161195547.db2.gz OUVYEWFKWYSWNJ-BQPHKTIFSA-N 1 1 344.371 2.409 20 5 EEBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000344699349 161236978 /nfs/dbraw/zinc/23/69/78/161236978.db2.gz WCTXQXCRNSASDL-OAHLLOKOSA-N 1 1 334.420 2.243 20 5 EEBDMO O=C1CC[C@@H]([NH2+]Cc2c(F)cc([N+](=O)[O-])cc2F)[C@H](C2CC2)N1 ZINC000352372612 162109912 /nfs/dbraw/zinc/10/99/12/162109912.db2.gz UQHNZXWKNMEFSH-HIFRSBDPSA-N 1 1 325.315 2.020 20 5 EEBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@H+](CC(=O)Nc4c(C)cccc4[N+](=O)[O-])[C@H]1[C@H]3C2 ZINC000352670563 162236142 /nfs/dbraw/zinc/23/61/42/162236142.db2.gz GEQXUTPUQMIMOB-HHDFAXHISA-N 1 1 345.399 2.197 20 5 EEBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](CC(=O)Nc4c(C)cccc4[N+](=O)[O-])[C@H]1[C@H]3C2 ZINC000352670563 162236146 /nfs/dbraw/zinc/23/61/46/162236146.db2.gz GEQXUTPUQMIMOB-HHDFAXHISA-N 1 1 345.399 2.197 20 5 EEBDMO COC(=O)COc1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000355728686 163283675 /nfs/dbraw/zinc/28/36/75/163283675.db2.gz DSVMWGSXVOETLO-OKILXGFUSA-N 1 1 334.372 2.379 20 5 EEBDMO NC(=O)c1ccc(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)c([N+](=O)[O-])c1 ZINC000368793562 166128893 /nfs/dbraw/zinc/12/88/93/166128893.db2.gz XRRXMOTXRZUTFH-OAHLLOKOSA-N 1 1 333.388 2.085 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H](OCC3CC3)C2)c([N+](=O)[O-])c1 ZINC000368793562 166128894 /nfs/dbraw/zinc/12/88/94/166128894.db2.gz XRRXMOTXRZUTFH-OAHLLOKOSA-N 1 1 333.388 2.085 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@@H]3CCO[C@H]3C3CC3)n2)cc1 ZINC000368897300 166148547 /nfs/dbraw/zinc/14/85/47/166148547.db2.gz QTFDZSKSOKMKCN-HIFRSBDPSA-N 1 1 330.344 2.302 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(C(=O)Nc2ccccc2)CC1 ZINC000370038468 166382552 /nfs/dbraw/zinc/38/25/52/166382552.db2.gz SARZVSKVNKMQPM-UHFFFAOYSA-N 1 1 343.387 2.179 20 5 EEBDMO CC1(C)C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@H]1O ZINC000275467004 269118628 /nfs/dbraw/zinc/11/86/28/269118628.db2.gz OAHXMBJEXGFBLL-CYBMUJFWSA-N 1 1 332.360 2.238 20 5 EEBDMO CC1(C)C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@H]1O ZINC000275467004 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KRPCGKMGYNKNBQ-CYBMUJFWSA-N 1 1 335.404 2.407 20 5 EEBDMO Cc1noc(C[C@H]([NH2+]Cc2c([N+](=O)[O-])ncn2C)c2ccccc2)n1 ZINC000429539986 274874309 /nfs/dbraw/zinc/87/43/09/274874309.db2.gz RQHGIKZPAYVSIZ-ZDUSSCGKSA-N 1 1 342.359 2.093 20 5 EEBDMO O=C1[C@H]([N@H+]2CC[C@@H]3OCCC[C@@H]3C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000246977361 275029709 /nfs/dbraw/zinc/02/97/09/275029709.db2.gz XZTVTCMKPROHCH-XYPHTWIQSA-N 1 1 345.399 2.201 20 5 EEBDMO CCC[C@]1(CO)CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000288721337 275082323 /nfs/dbraw/zinc/08/23/23/275082323.db2.gz FYWNINDJILVNCW-KRWDZBQOSA-N 1 1 335.404 2.326 20 5 EEBDMO CCC[C@]1(CO)CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000288721337 275082324 /nfs/dbraw/zinc/08/23/24/275082324.db2.gz FYWNINDJILVNCW-KRWDZBQOSA-N 1 1 335.404 2.326 20 5 EEBDMO CCC[C@@]1(CO)CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000288752137 275083841 /nfs/dbraw/zinc/08/38/41/275083841.db2.gz IBZWCMNPQHEVES-QGZVFWFLSA-N 1 1 338.404 2.467 20 5 EEBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[NH+]1CCSCC1 ZINC000289965131 275166023 /nfs/dbraw/zinc/16/60/23/275166023.db2.gz YOQQRQYITZUCMJ-UHFFFAOYSA-N 1 1 338.433 2.328 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000408435059 288101698 /nfs/dbraw/zinc/10/16/98/288101698.db2.gz LAIFGAUPTFFFAM-UONOGXRCSA-N 1 1 346.431 2.360 20 5 EEBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NCCCn1cc[nH+]c1C ZINC000282971328 292873633 /nfs/dbraw/zinc/87/36/33/292873633.db2.gz IOWIBWGFXCWCFM-UHFFFAOYSA-N 1 1 332.360 2.319 20 5 EEBDMO Cn1cc[nH+]c1C[C@H]1CCCN(c2nc3sccn3c2[N+](=O)[O-])C1 ZINC000301717939 294886706 /nfs/dbraw/zinc/88/67/06/294886706.db2.gz OJBKEXBZWPMAKL-LLVKDONJSA-N 1 1 346.416 2.497 20 5 EEBDMO COc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000160339586 311353235 /nfs/dbraw/zinc/35/32/35/311353235.db2.gz GRLBXTKPDOIBAB-CQSZACIVSA-N 1 1 345.355 2.313 20 5 EEBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000160339586 311353237 /nfs/dbraw/zinc/35/32/37/311353237.db2.gz GRLBXTKPDOIBAB-CQSZACIVSA-N 1 1 345.355 2.313 20 5 EEBDMO C[N@H+](C[C@@H]1CCCCO1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000332634498 312037655 /nfs/dbraw/zinc/03/76/55/312037655.db2.gz GEVDQGBYPQBWFM-HOTGVXAUSA-N 1 1 333.388 2.201 20 5 EEBDMO C[N@@H+](C[C@@H]1CCCCO1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000332634498 312037656 /nfs/dbraw/zinc/03/76/56/312037656.db2.gz GEVDQGBYPQBWFM-HOTGVXAUSA-N 1 1 333.388 2.201 20 5 EEBDMO CC1=C(C)C[N@@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000527034449 317144122 /nfs/dbraw/zinc/14/41/22/317144122.db2.gz QKKQCPAIRGFLEU-HNNXBMFYSA-N 1 1 329.356 2.269 20 5 EEBDMO CC1=C(C)C[N@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000527034449 317144125 /nfs/dbraw/zinc/14/41/25/317144125.db2.gz QKKQCPAIRGFLEU-HNNXBMFYSA-N 1 1 329.356 2.269 20 5 EEBDMO C[C@H](C(=O)N(C)C(C)(C)C[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000575151015 320091447 /nfs/dbraw/zinc/09/14/47/320091447.db2.gz 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ZINC000332056373 466365380 /nfs/dbraw/zinc/36/53/80/466365380.db2.gz OSKJFJSMLWMXSI-CJNGLKHVSA-N 1 1 332.404 2.139 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H](C)[C@@H]2CO)cccc1[N+](=O)[O-] ZINC000305460160 466410687 /nfs/dbraw/zinc/41/06/87/466410687.db2.gz VGYGZXOXCSXRPA-WBMJQRKESA-N 1 1 335.404 2.325 20 5 EEBDMO CCn1c(C)nc([N+](=O)[O-])c1NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000340900953 466421004 /nfs/dbraw/zinc/42/10/04/466421004.db2.gz JGEDEYXJYNUBJU-LBPRGKRZSA-N 1 1 325.413 2.032 20 5 EEBDMO O=c1[nH]cnc2cc(NC[C@H]3CC[N@H+](C4CC4)C3)c([N+](=O)[O-])cc21 ZINC000324340884 466646057 /nfs/dbraw/zinc/64/60/57/466646057.db2.gz YTZMZLJGRSHMAR-SNVBAGLBSA-N 1 1 329.360 2.140 20 5 EEBDMO C[N@H+]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)C1 ZINC000369775309 466752274 /nfs/dbraw/zinc/75/22/74/466752274.db2.gz XHTWEKOJTQIVIA-QZTJIDSGSA-N 1 1 339.395 2.351 20 5 EEBDMO CN1[C@@H]2CC[C@H]1CC([N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000411724126 466887330 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O=[N+]([O-])c1cccnc1N1CC[NH+](Cc2cccc3c2NCC3)CC1 ZINC000415110345 467492371 /nfs/dbraw/zinc/49/23/71/467492371.db2.gz SOIWXGUHNZTQEG-UHFFFAOYSA-N 1 1 339.399 2.280 20 5 EEBDMO COc1ccc(CN2CCC([C@H]3C[C@H]([NH3+])CCO3)CC2)cc1[N+](=O)[O-] ZINC000415119936 467493664 /nfs/dbraw/zinc/49/36/64/467493664.db2.gz FWHSTOBNKDHXSZ-CRAIPNDOSA-N 1 1 349.431 2.322 20 5 EEBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000408074305 467505042 /nfs/dbraw/zinc/50/50/42/467505042.db2.gz VYRMGNOHXUNJJS-KBPBESRZSA-N 1 1 346.431 2.360 20 5 EEBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000408074305 467505047 /nfs/dbraw/zinc/50/50/47/467505047.db2.gz VYRMGNOHXUNJJS-KBPBESRZSA-N 1 1 346.431 2.360 20 5 EEBDMO Cc1[nH+]ccn1CCNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000438023733 467559909 /nfs/dbraw/zinc/55/99/09/467559909.db2.gz ONEKQJOSQGHCLJ-UHFFFAOYSA-N 1 1 343.387 2.474 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(NC[C@@H]3CCCn4cc[nH+]c43)n2)cc1 ZINC000446972991 467586724 /nfs/dbraw/zinc/58/67/24/467586724.db2.gz BUDLBYYLFCDPCA-LBPRGKRZSA-N 1 1 340.343 2.831 20 5 EEBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCN([C@H]2CCC[C@@H]2O)CC1 ZINC000449191565 467622709 /nfs/dbraw/zinc/62/27/09/467622709.db2.gz PKKIMMZNFARVTM-CCKFTAQKSA-N 1 1 347.459 2.493 20 5 EEBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1C[C@@H](C)[N@@H+](CCO)[C@@H](C)C1 ZINC000449530019 467658860 /nfs/dbraw/zinc/65/88/60/467658860.db2.gz BNSIRENDRRUNNB-SZWOSNRGSA-N 1 1 333.432 2.385 20 5 EEBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@@H](C)N(CCO)[C@@H](C)C1 ZINC000449530019 467658865 /nfs/dbraw/zinc/65/88/65/467658865.db2.gz BNSIRENDRRUNNB-SZWOSNRGSA-N 1 1 333.432 2.385 20 5 EEBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H](C)N(CCO)[C@@H](C)C1 ZINC000449530019 467658868 /nfs/dbraw/zinc/65/88/68/467658868.db2.gz BNSIRENDRRUNNB-SZWOSNRGSA-N 1 1 333.432 2.385 20 5 EEBDMO C[N@@H+](CCCCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000457210374 467778326 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333.388 2.109 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000450381073 467839611 /nfs/dbraw/zinc/83/96/11/467839611.db2.gz SSXIAAARWVHOQK-CHWSQXEVSA-N 1 1 333.388 2.109 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CCCO1 ZINC000493304071 467882437 /nfs/dbraw/zinc/88/24/37/467882437.db2.gz QLINFIUCEIFCMB-WUKHSURWSA-N 1 1 347.415 2.225 20 5 EEBDMO C[C@H](C(=O)NCCC[N@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000514642132 467944769 /nfs/dbraw/zinc/94/47/69/467944769.db2.gz MPEKJWJCYIYEGM-GJZGRUSLSA-N 1 1 349.431 2.315 20 5 EEBDMO COCC[N@H+]1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])C[C@@H]1C ZINC000493868791 468000324 /nfs/dbraw/zinc/00/03/24/468000324.db2.gz AINHGFXJGXDUHB-LBPRGKRZSA-N 1 1 327.812 2.401 20 5 EEBDMO C[C@@H]1C[C@H](Nc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000516943395 468057865 /nfs/dbraw/zinc/05/78/65/468057865.db2.gz YJVDXFCBSYNLPM-ZJUUUORDSA-N 1 1 329.360 2.281 20 5 EEBDMO Cc1cnn([C@H]2CC[N@H+](Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C2)c1 ZINC000589521600 468159469 /nfs/dbraw/zinc/15/94/69/468159469.db2.gz MPVIEDUOLGASFC-AWEZNQCLSA-N 1 1 344.371 2.318 20 5 EEBDMO Cc1cnn([C@H]2CC[N@@H+](Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C2)c1 ZINC000589521600 468159470 /nfs/dbraw/zinc/15/94/70/468159470.db2.gz MPVIEDUOLGASFC-AWEZNQCLSA-N 1 1 344.371 2.318 20 5 EEBDMO Cc1cc(N2CCN([C@@H]3CCC[N@H+](C)C3)CC2)c(F)cc1[N+](=O)[O-] ZINC000589687921 468177017 /nfs/dbraw/zinc/17/70/17/468177017.db2.gz QBSOBVFVFZNUGV-CQSZACIVSA-N 1 1 336.411 2.259 20 5 EEBDMO C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000533294687 468187112 /nfs/dbraw/zinc/18/71/12/468187112.db2.gz LFLKHJAUCRDXJA-CYBMUJFWSA-N 1 1 343.383 2.077 20 5 EEBDMO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000533294687 468187116 /nfs/dbraw/zinc/18/71/16/468187116.db2.gz LFLKHJAUCRDXJA-CYBMUJFWSA-N 1 1 343.383 2.077 20 5 EEBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594217082 468516098 /nfs/dbraw/zinc/51/60/98/468516098.db2.gz OWHSDBYPZWQSHB-IRXDYDNUSA-N 1 1 346.431 2.453 20 5 EEBDMO O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594227252 468520181 /nfs/dbraw/zinc/52/01/81/468520181.db2.gz VGFLODBGQNWMBB-HZPDHXFCSA-N 1 1 332.404 2.411 20 5 EEBDMO O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594227251 468520299 /nfs/dbraw/zinc/52/02/99/468520299.db2.gz VGFLODBGQNWMBB-HOTGVXAUSA-N 1 1 332.404 2.411 20 5 EEBDMO CC(C)(C)n1nnc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000594512579 468612940 /nfs/dbraw/zinc/61/29/40/468612940.db2.gz WJYJZBMNLNKAOK-CQSZACIVSA-N 1 1 344.419 2.447 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000597603522 468613834 /nfs/dbraw/zinc/61/38/34/468613834.db2.gz CYQHJCYJBDTVSS-AWEZNQCLSA-N 1 1 335.404 2.225 20 5 EEBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000582983852 468625519 /nfs/dbraw/zinc/62/55/19/468625519.db2.gz UIXJJXZVQCLVTN-OAHLLOKOSA-N 1 1 349.431 2.479 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+](C(C)(C)C)C1 ZINC000597854421 468694529 /nfs/dbraw/zinc/69/45/29/468694529.db2.gz HPLDUBHHNPUOIY-GFCCVEGCSA-N 1 1 335.404 2.454 20 5 EEBDMO CCCc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000597861447 468697206 /nfs/dbraw/zinc/69/72/06/468697206.db2.gz UKXGBHAYXZVRPY-NSHDSACASA-N 1 1 337.424 2.121 20 5 EEBDMO [NH3+]Cc1ccc(CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000592437198 468698006 /nfs/dbraw/zinc/69/80/06/468698006.db2.gz CHVDENLAODPCCD-UHFFFAOYSA-N 1 1 329.356 2.115 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1CN1CCC([C@@H]3CC[NH2+]C3)CC1)OCCO2 ZINC000592433569 468698032 /nfs/dbraw/zinc/69/80/32/468698032.db2.gz CGKOPCAKGZXMBQ-CQSZACIVSA-N 1 1 347.415 2.188 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000571117806 468741801 /nfs/dbraw/zinc/74/18/01/468741801.db2.gz UOVIZKKHFBDOQS-OAHLLOKOSA-N 1 1 334.420 2.340 20 5 EEBDMO C[C@H]([NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C1(CO)CC1 ZINC000595069341 468752486 /nfs/dbraw/zinc/75/24/86/468752486.db2.gz QXWAUOSJILZVAA-SWLSCSKDSA-N 1 1 330.388 2.168 20 5 EEBDMO CCN(CC)C(=O)C[NH+]1CCC(Nc2ncc([N+](=O)[O-])cc2C)CC1 ZINC000601182791 468774361 /nfs/dbraw/zinc/77/43/61/468774361.db2.gz XQSFMXWMEYXSFC-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO CC(C)O[C@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000593053754 468853730 /nfs/dbraw/zinc/85/37/30/468853730.db2.gz LPPLDVXIYYJFAS-CABCVRRESA-N 1 1 338.404 2.224 20 5 EEBDMO C[C@@H](CO)C1CC[NH+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000593081383 468863757 /nfs/dbraw/zinc/86/37/57/468863757.db2.gz CVDXHYVFQNGTDZ-LBPRGKRZSA-N 1 1 346.387 2.485 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC([C@H](C)CO)CC1 ZINC000593084899 468864294 /nfs/dbraw/zinc/86/42/94/468864294.db2.gz RTEZLHUKDTVHKC-CHWSQXEVSA-N 1 1 335.404 2.262 20 5 EEBDMO Nc1c(C(=O)NC[C@H]2CC[N@@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000598508333 468893246 /nfs/dbraw/zinc/89/32/46/468893246.db2.gz GNVAGKQJIIDHCU-CQSZACIVSA-N 1 1 340.383 2.181 20 5 EEBDMO Nc1c(C(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000598508333 468893251 /nfs/dbraw/zinc/89/32/51/468893251.db2.gz GNVAGKQJIIDHCU-CQSZACIVSA-N 1 1 340.383 2.181 20 5 EEBDMO COc1cc(C(=O)N2[C@H](C)C[N@@H+](C)[C@@H](C)[C@H]2C)c([N+](=O)[O-])cc1F ZINC000593190041 468900049 /nfs/dbraw/zinc/90/00/49/468900049.db2.gz CYSWEMCIBHFVNN-OUAUKWLOSA-N 1 1 339.367 2.296 20 5 EEBDMO C[C@@H](CO)[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000595678114 468951518 /nfs/dbraw/zinc/95/15/18/468951518.db2.gz QXANLEITYIDAMK-DZGCQCFKSA-N 1 1 335.404 2.406 20 5 EEBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](N3CCOCC3)CC2)c1 ZINC000585718540 469019773 /nfs/dbraw/zinc/01/97/73/469019773.db2.gz KQHKKKRWPGSQRA-INIZCTEOSA-N 1 1 349.431 2.160 20 5 EEBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2n[nH]cc2C1 ZINC000598941546 469058919 /nfs/dbraw/zinc/05/89/19/469058919.db2.gz XBTWNQIEETVVTE-LLVKDONJSA-N 1 1 329.360 2.093 20 5 EEBDMO C[N@H+]1CCCC[C@@H](CNC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000598994549 469080824 /nfs/dbraw/zinc/08/08/24/469080824.db2.gz AMBFJMXODLPBPG-AWEZNQCLSA-N 1 1 334.420 2.168 20 5 EEBDMO C[N@H+]1CCCN(CCCNc2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000610929222 469114630 /nfs/dbraw/zinc/11/46/30/469114630.db2.gz FQJVJUQHFHPGPP-UHFFFAOYSA-N 1 1 327.816 2.083 20 5 EEBDMO CN1CCC[N@H+](CCCNc2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000610929222 469114634 /nfs/dbraw/zinc/11/46/34/469114634.db2.gz FQJVJUQHFHPGPP-UHFFFAOYSA-N 1 1 327.816 2.083 20 5 EEBDMO CN1CCC[N@@H+](CCCNc2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000610929222 469114639 /nfs/dbraw/zinc/11/46/39/469114639.db2.gz FQJVJUQHFHPGPP-UHFFFAOYSA-N 1 1 327.816 2.083 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000593736235 469117786 /nfs/dbraw/zinc/11/77/86/469117786.db2.gz KGUNEFRPRQZLGV-YEWWUXTCSA-N 1 1 349.431 2.322 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCOC2)c([N+](=O)[O-])c1 ZINC000563066366 469157642 /nfs/dbraw/zinc/15/76/42/469157642.db2.gz NJCPSYXAKNAEMN-HUUCEWRRSA-N 1 1 333.388 2.085 20 5 EEBDMO Cc1nn(C)c(N2CC[C@@H]([N@@H+](C)CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596467595 469277046 /nfs/dbraw/zinc/27/70/46/469277046.db2.gz UAFMKPOXFACUFN-MRXNPFEDSA-N 1 1 343.431 2.390 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1N[C@@H]1CCC[N@@H+](CCN2CCOCC2)C1 ZINC000603424467 469391492 /nfs/dbraw/zinc/39/14/92/469391492.db2.gz XHXWQKCHMXBPJJ-MRXNPFEDSA-N 1 1 348.447 2.112 20 5 EEBDMO COc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)c1cc[nH+]c(C)c1 ZINC000619496980 469626065 /nfs/dbraw/zinc/62/60/65/469626065.db2.gz NKKSWEWICINVIH-UHFFFAOYSA-N 1 1 337.357 2.132 20 5 EEBDMO O=C(Cc1cccc([N+](=O)[O-])c1)NCC[NH+]1Cc2ccccc2C1 ZINC000610239003 469991063 /nfs/dbraw/zinc/99/10/63/469991063.db2.gz LSDSJRPKAUHUJI-UHFFFAOYSA-N 1 1 325.368 2.269 20 5 EEBDMO CCC[N@@H+](CC)CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000174659616 527977866 /nfs/dbraw/zinc/97/78/66/527977866.db2.gz SYCSDOUPGJAYSW-UHFFFAOYSA-N 1 1 345.403 2.242 20 5 EEBDMO O=[N+]([O-])c1ccc(OCCNc2nc(N3CCCC3)cc[nH+]2)cc1 ZINC000733191057 577212416 /nfs/dbraw/zinc/21/24/16/577212416.db2.gz NNQBOLTVWKUXKV-UHFFFAOYSA-N 1 1 329.360 2.476 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H](O)C[NH+]2CCN(c3cccc(O)c3)CC2)cc1 ZINC000776273472 577456193 /nfs/dbraw/zinc/45/61/93/577456193.db2.gz BTPZHNVZHOIZTB-GOSISDBHSA-N 1 1 343.383 2.156 20 5 EEBDMO CNC(=O)c1ccc(C[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776276587 577456464 /nfs/dbraw/zinc/45/64/64/577456464.db2.gz OBCFFBIFADQTRT-KRWDZBQOSA-N 1 1 343.383 2.120 20 5 EEBDMO C[N@H+](Cc1ccc([S@@](C)=O)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776588803 577463535 /nfs/dbraw/zinc/46/35/35/577463535.db2.gz BXKXWXWMFRUWIR-MZNJEOGPSA-N 1 1 348.424 2.498 20 5 EEBDMO Cc1nn(C[N@H+]2CCC[C@@H](C3OCCO3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765015705 577492813 /nfs/dbraw/zinc/49/28/13/577492813.db2.gz UJJCRGABGZTCGK-CYBMUJFWSA-N 1 1 346.387 2.295 20 5 EEBDMO CC[N@H+](CC(=O)NC)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000768302489 577553535 /nfs/dbraw/zinc/55/35/35/577553535.db2.gz MDSKNBDCPIKFTJ-UHFFFAOYSA-N 1 1 347.371 2.431 20 5 EEBDMO CC[N@@H+](CC(=O)NC)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000768302489 577553536 /nfs/dbraw/zinc/55/35/36/577553536.db2.gz MDSKNBDCPIKFTJ-UHFFFAOYSA-N 1 1 347.371 2.431 20 5 EEBDMO O=C(NCC[NH+]1CCSCC1)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000770002625 577588772 /nfs/dbraw/zinc/58/87/72/577588772.db2.gz MDELGIXYOYHKTH-UHFFFAOYSA-N 1 1 344.824 2.419 20 5 EEBDMO C[C@@H]1CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000751069621 577747751 /nfs/dbraw/zinc/74/77/51/577747751.db2.gz QTVCKRCHFSKPBZ-SECBINFHSA-N 1 1 342.193 2.133 20 5 EEBDMO C[C@@H]1CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000751069621 577747752 /nfs/dbraw/zinc/74/77/52/577747752.db2.gz QTVCKRCHFSKPBZ-SECBINFHSA-N 1 1 342.193 2.133 20 5 EEBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@@H]1CC[N@H+](C2CC2)C1 ZINC000756950050 577853672 /nfs/dbraw/zinc/85/36/72/577853672.db2.gz AOQIKWNKOHLGMR-LLVKDONJSA-N 1 1 338.795 2.284 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000743399086 577884712 /nfs/dbraw/zinc/88/47/12/577884712.db2.gz PGKFGOJNLLJLGV-CQSZACIVSA-N 1 1 344.419 2.084 20 5 EEBDMO CC[NH+](CC)[C@@H](C(=O)OCCn1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000748123210 577955567 /nfs/dbraw/zinc/95/55/67/577955567.db2.gz SOAFVNFXMMMVDD-MRXNPFEDSA-N 1 1 346.387 2.418 20 5 EEBDMO CCOC[C@@H]1CC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000177627828 681421132 /nfs/dbraw/zinc/42/11/32/681421132.db2.gz DUMFCHVGSLGRDH-CYBMUJFWSA-N 1 1 331.376 2.169 20 5 EEBDMO CCOC[C@@H]1CC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000177627828 681421135 /nfs/dbraw/zinc/42/11/35/681421135.db2.gz DUMFCHVGSLGRDH-CYBMUJFWSA-N 1 1 331.376 2.169 20 5 EEBDMO COc1c(O)ccc(C[N@H+]2CC[C@@H](c3nccn3C)C2)c1[N+](=O)[O-] ZINC000894484315 682921081 /nfs/dbraw/zinc/92/10/81/682921081.db2.gz QRZFISYFFSAUBP-GFCCVEGCSA-N 1 1 332.360 2.032 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21)C1CCCC1 ZINC001025646214 683206618 /nfs/dbraw/zinc/20/66/18/683206618.db2.gz JBABFCLUEKPTEA-FVQHAEBGSA-N 1 1 329.400 2.331 20 5 EEBDMO CC(C)c1ccccc1C[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001025778333 683268588 /nfs/dbraw/zinc/26/85/88/683268588.db2.gz SJUZVHRCTBGFSI-SFFUCWETSA-N 1 1 343.427 2.022 20 5 EEBDMO CC(C)c1ccccc1C[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001025778333 683268592 /nfs/dbraw/zinc/26/85/92/683268592.db2.gz SJUZVHRCTBGFSI-SFFUCWETSA-N 1 1 343.427 2.022 20 5 EEBDMO CC(C)c1ccccc1C[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001025778333 683268598 /nfs/dbraw/zinc/26/85/98/683268598.db2.gz SJUZVHRCTBGFSI-SFFUCWETSA-N 1 1 343.427 2.022 20 5 EEBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)c2ccn[nH]2)CC1 ZINC000985287598 686229288 /nfs/dbraw/zinc/22/92/88/686229288.db2.gz RHTIXAMTBCHFSB-UHFFFAOYSA-N 1 1 343.387 2.055 20 5 EEBDMO C[C@@H]1CC[N@@H+](CCNC(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1 ZINC000897457037 690561559 /nfs/dbraw/zinc/56/15/59/690561559.db2.gz QGRDLLXTRJOHKI-CQSZACIVSA-N 1 1 334.420 2.121 20 5 EEBDMO C[N@@H+](Cc1ccccc1)C1CN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000794749777 1197929302 /nfs/dbraw/zinc/92/93/02/1197929302.db2.gz BEKGMNSRQANRDE-LJQANCHMSA-N 1 1 341.411 2.444 20 5 EEBDMO COC(=O)N1CCC[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1 ZINC000865500972 1198249280 /nfs/dbraw/zinc/24/92/80/1198249280.db2.gz JJQCFBIXHSUPPL-NSHDSACASA-N 1 1 330.344 2.208 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NC[C@H]1C[N@@H+](CC(C)C)CCO1 ZINC000873842810 1198717235 /nfs/dbraw/zinc/71/72/35/1198717235.db2.gz HUJABKHTNJFKJP-HNNXBMFYSA-N 1 1 349.431 2.298 20 5 EEBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000810315571 1199448593 /nfs/dbraw/zinc/44/85/93/1199448593.db2.gz BVAGSSSEVOTAQF-HUUCEWRRSA-N 1 1 348.403 2.142 20 5 EEBDMO COc1ccc(CC(=O)O[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000810846796 1199776066 /nfs/dbraw/zinc/77/60/66/1199776066.db2.gz KAVAIZFVAYQAEA-KGLIPLIRSA-N 1 1 334.372 2.316 20 5 EEBDMO CN(Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCC[N@H+]1C ZINC000878722125 1200639606 /nfs/dbraw/zinc/63/96/06/1200639606.db2.gz AJVYYVCALIQVPI-LBPRGKRZSA-N 1 1 331.376 2.171 20 5 EEBDMO Cc1c(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)cnn1C ZINC000813173625 1201142242 /nfs/dbraw/zinc/14/22/42/1201142242.db2.gz HIZLMCHZAAXQDB-HNNXBMFYSA-N 1 1 344.371 2.068 20 5 EEBDMO Cc1c(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cnn1C ZINC000813173625 1201142247 /nfs/dbraw/zinc/14/22/47/1201142247.db2.gz HIZLMCHZAAXQDB-HNNXBMFYSA-N 1 1 344.371 2.068 20 5 EEBDMO CCc1[nH+]ccn1Cc1cn(Cc2ccc(C)c([N+](=O)[O-])c2)nn1 ZINC000881213204 1201658604 /nfs/dbraw/zinc/65/86/04/1201658604.db2.gz YFZDPEPIDRJZSG-UHFFFAOYSA-N 1 1 326.360 2.350 20 5 EEBDMO CCOC[C@@H]1CCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1 ZINC000867928079 1201707697 /nfs/dbraw/zinc/70/76/97/1201707697.db2.gz VOKRJMWMMJSJQG-CXAGYDPISA-N 1 1 335.404 2.044 20 5 EEBDMO CCOCCC[N@H+]1CC[C@@H](NCc2cccnc2[N+](=O)[O-])[C@@H](C)C1 ZINC000886140956 1202476914 /nfs/dbraw/zinc/47/69/14/1202476914.db2.gz SWOHRHJOQGRRGU-GOEBONIOSA-N 1 1 336.436 2.216 20 5 EEBDMO CNc1ccc(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000886589400 1202528202 /nfs/dbraw/zinc/52/82/02/1202528202.db2.gz UIZKWOXRRLLZFV-AWEZNQCLSA-N 1 1 334.420 2.439 20 5 EEBDMO CNc1ccc(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000886589400 1202528203 /nfs/dbraw/zinc/52/82/03/1202528203.db2.gz UIZKWOXRRLLZFV-AWEZNQCLSA-N 1 1 334.420 2.439 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NCCCN(C)c1ccc(C)cc1[N+](=O)[O-] ZINC001095625546 1205895529 /nfs/dbraw/zinc/89/55/29/1205895529.db2.gz VQHWDFWKABVNPB-UHFFFAOYSA-N 1 1 336.436 2.188 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](N(C)C)[C@H]1C ZINC000931040957 1206602141 /nfs/dbraw/zinc/60/21/41/1206602141.db2.gz ATLGOPGNANFJHH-CZUORRHYSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](N(C)C)[C@H]1C ZINC000931040957 1206602142 /nfs/dbraw/zinc/60/21/42/1206602142.db2.gz ATLGOPGNANFJHH-CZUORRHYSA-N 1 1 334.420 2.256 20 5 EEBDMO CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CCc2ccccc2F)CC1 ZINC001045437307 1233744865 /nfs/dbraw/zinc/74/48/65/1233744865.db2.gz MTIYGVPFMONDBM-GDBMZVCRSA-N 1 1 349.406 2.004 20 5 EEBDMO O=C(NCC1=CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1)c1cc[nH]c1 ZINC001000717849 1240787871 /nfs/dbraw/zinc/78/78/71/1240787871.db2.gz RLMCKCWXYSBBCQ-UHFFFAOYSA-N 1 1 340.383 2.485 20 5 EEBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2ccc(F)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050326355 1243351907 /nfs/dbraw/zinc/35/19/07/1243351907.db2.gz YUQCAMNPTHDDCN-MWQQHZPXSA-N 1 1 349.406 2.256 20 5 EEBDMO Cc1cc(N[C@H]2C[C@@H](NC(=O)C[N@H+](C)C3CCC3)C2)ccc1[N+](=O)[O-] ZINC001097260475 1243886987 /nfs/dbraw/zinc/88/69/87/1243886987.db2.gz BOGNJCLKKDXUCB-GASCZTMLSA-N 1 1 346.431 2.447 20 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O=[N+]([O-])c1cc(Nc2cccc(CN3CC[NH2+]CC3)c2)ccc1O ZINC001159631928 1319925636 /nfs/dbraw/zinc/92/56/36/1319925636.db2.gz XYZOQEZUVDBCHA-UHFFFAOYSA-N 1 1 328.372 2.449 20 5 EEBDMO Cc1nc(Cl)c([N+](=O)[O-])c(NCC[NH+]2CCC(F)(F)CC2)n1 ZINC001160747271 1320256607 /nfs/dbraw/zinc/25/66/07/1320256607.db2.gz HDXJQOKKCVDXLE-UHFFFAOYSA-N 1 1 335.742 2.490 20 5 EEBDMO C[NH+](C)/C=C/c1cc(NC2CN(c3ccccn3)C2)ncc1[N+](=O)[O-] ZINC001161322841 1320457956 /nfs/dbraw/zinc/45/79/56/1320457956.db2.gz RMCBEOWITRQWNQ-SOFGYWHQSA-N 1 1 340.387 2.218 20 5 EEBDMO Cc1[nH+]ccn1CCCC(=O)NCCN(C)c1ccc([N+](=O)[O-])cc1 ZINC001316594309 1323852348 /nfs/dbraw/zinc/85/23/48/1323852348.db2.gz VPVJCDJYQXJYCY-UHFFFAOYSA-N 1 1 345.403 2.133 20 5 EEBDMO NC(=O)C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001324140043 1333617086 /nfs/dbraw/zinc/61/70/86/1333617086.db2.gz DTQMGMIAHNSVLP-VIFPVBQESA-N 1 1 342.193 2.055 20 5 EEBDMO NC(=O)C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001324140043 1333617088 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YAXCONDUPLWKCI-UHFFFAOYSA-N 1 1 335.404 2.056 20 5 EEBDMO CCCOCC(=O)N1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001195160001 1368504436 /nfs/dbraw/zinc/50/44/36/1368504436.db2.gz YAXCONDUPLWKCI-UHFFFAOYSA-N 1 1 335.404 2.056 20 5 EEBDMO C[C@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000888091501 1371273733 /nfs/dbraw/zinc/27/37/33/1371273733.db2.gz JVFVLWFLNQALDD-WMLDXEAASA-N 1 1 332.356 2.172 20 5 EEBDMO CCn1cc(C[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)cn1 ZINC000782500796 1371303767 /nfs/dbraw/zinc/30/37/67/1371303767.db2.gz NUTHXMWXZTVALZ-UHFFFAOYSA-N 1 1 349.366 2.411 20 5 EEBDMO Cc1nn(CN2CCC[N@H+]3CCC[C@H]3C2)c2cc([N+](=O)[O-])ccc12 ZINC001116399026 1371724940 /nfs/dbraw/zinc/72/49/40/1371724940.db2.gz SFAFZOSPJKJLDH-HNNXBMFYSA-N 1 1 329.404 2.381 20 5 EEBDMO C[N@@H+](CCNC(=O)/C=C\c1ccc[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC001753047609 1406635243 /nfs/dbraw/zinc/63/52/43/1406635243.db2.gz NPFURCZJELAYSH-TWGQIWQCSA-N 1 1 328.372 2.184 20 5 EEBDMO 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UMCAPBRSTZHVPL-CABCVRRESA-N 1 1 331.376 2.249 20 5 EEBDMO O=[N+]([O-])c1ccc(S(=O)(=O)NCC[NH+]2CCCCC2)c(Cl)c1 ZINC000055592550 214332569 /nfs/dbraw/zinc/33/25/69/214332569.db2.gz HVXUBZJMPPBXLX-UHFFFAOYSA-N 1 1 347.824 2.012 20 5 EEBDMO CCC[N@H+]1CCC[C@@H]1CNC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000349868135 283336132 /nfs/dbraw/zinc/33/61/32/283336132.db2.gz LOXUNCJEGWKQBO-CQSZACIVSA-N 1 1 349.435 2.180 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000072703884 216296053 /nfs/dbraw/zinc/29/60/53/216296053.db2.gz YGSKCTYSLNQXNO-CYBMUJFWSA-N 1 1 341.433 2.138 20 5 EEBDMO O=C(C[N@H+]1CCC[C@H]1CCO)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000426214464 241235226 /nfs/dbraw/zinc/23/52/26/241235226.db2.gz GAZDWBVNMDFXFD-NSHDSACASA-N 1 1 327.768 2.034 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@H]1CCO)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000426214464 241235228 /nfs/dbraw/zinc/23/52/28/241235228.db2.gz GAZDWBVNMDFXFD-NSHDSACASA-N 1 1 327.768 2.034 20 5 EEBDMO COCC1=CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000185819028 533159363 /nfs/dbraw/zinc/15/93/63/533159363.db2.gz YWKZYDMQKRMFFP-UHFFFAOYSA-N 1 1 349.387 2.211 20 5 EEBDMO COCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000117287785 221045133 /nfs/dbraw/zinc/04/51/33/221045133.db2.gz GCDVBXBXZHQBRE-NSHDSACASA-N 1 1 341.795 2.041 20 5 EEBDMO COCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000117287785 221045136 /nfs/dbraw/zinc/04/51/36/221045136.db2.gz GCDVBXBXZHQBRE-NSHDSACASA-N 1 1 341.795 2.041 20 5 EEBDMO CN(c1ncc([N+](=O)[O-])cc1Br)[C@@H]1CCC[N@H+](C)C1 ZINC000267204454 256037452 /nfs/dbraw/zinc/03/74/52/256037452.db2.gz GFZOICYEDLVPOW-SECBINFHSA-N 1 1 329.198 2.283 20 5 EEBDMO CN(c1ncc([N+](=O)[O-])cc1Br)[C@@H]1CCC[N@@H+](C)C1 ZINC000267204454 256037454 /nfs/dbraw/zinc/03/74/54/256037454.db2.gz GFZOICYEDLVPOW-SECBINFHSA-N 1 1 329.198 2.283 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C[N@H+]1C1CC1 ZINC000267988845 256102620 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348.428 2.346 20 5 EEBDMO CC(C)C[C@H]1COCC[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000072980250 159048955 /nfs/dbraw/zinc/04/89/55/159048955.db2.gz QWQPFZYLQPFCPA-HOTGVXAUSA-N 1 1 338.404 2.081 20 5 EEBDMO CC(C)C[C@H]1COCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000072980250 159048958 /nfs/dbraw/zinc/04/89/58/159048958.db2.gz QWQPFZYLQPFCPA-HOTGVXAUSA-N 1 1 338.404 2.081 20 5 EEBDMO O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000106787517 159321623 /nfs/dbraw/zinc/32/16/23/159321623.db2.gz SFYPXRCOBUOBQD-CYBMUJFWSA-N 1 1 333.388 2.107 20 5 EEBDMO CCOc1cc(N[C@H](C)CCN2CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC000184827408 160018534 /nfs/dbraw/zinc/01/85/34/160018534.db2.gz KKQBKDIQRGAHCQ-CQSZACIVSA-N 1 1 336.436 2.431 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000338056217 160701337 /nfs/dbraw/zinc/70/13/37/160701337.db2.gz GKDSBOLMLDBLDY-UKRRQHHQSA-N 1 1 346.431 2.404 20 5 EEBDMO 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LTZCIUQGVYCFRP-STQMWFEESA-N 1 1 326.418 2.019 20 5 EEBDMO CCCn1nccc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000597012768 468416244 /nfs/dbraw/zinc/41/62/44/468416244.db2.gz CFYQUYPPKYBGNX-CYBMUJFWSA-N 1 1 330.392 2.283 20 5 EEBDMO CCCn1nccc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000597012768 468416250 /nfs/dbraw/zinc/41/62/50/468416250.db2.gz CFYQUYPPKYBGNX-CYBMUJFWSA-N 1 1 330.392 2.283 20 5 EEBDMO Cc1cc(NC[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000348185523 465479901 /nfs/dbraw/zinc/47/99/01/465479901.db2.gz ZHTQGPDRRWJAAI-GOSISDBHSA-N 1 1 342.399 2.347 20 5 EEBDMO CC(C)[C@H](CNc1ccc([N+](=O)[O-])c(N)c1F)[NH+]1CCOCC1 ZINC000266850883 464844140 /nfs/dbraw/zinc/84/41/40/464844140.db2.gz LBWJZXYJQSHHFL-ZDUSSCGKSA-N 1 1 326.372 2.085 20 5 EEBDMO C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc2ncccc2c1[N+](=O)[O-] ZINC000286324811 464880441 /nfs/dbraw/zinc/88/04/41/464880441.db2.gz LBPPEUYFOSCRIN-ZIAGYGMSSA-N 1 1 342.399 2.442 20 5 EEBDMO CC(C)c1ccc(C(=O)N[C@H]2CCC[N@@H+](CCCO)C2)cc1[N+](=O)[O-] ZINC000295583217 464891212 /nfs/dbraw/zinc/89/12/12/464891212.db2.gz VXULEAQIOBOVOE-HNNXBMFYSA-N 1 1 349.431 2.295 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C[N@H+]1C1CC1 ZINC000177089749 464927554 /nfs/dbraw/zinc/92/75/54/464927554.db2.gz OQMTZIGNYGSUDI-VXGBXAGGSA-N 1 1 332.404 2.016 20 5 EEBDMO CN1CC[NH+](CCCNc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000276533429 464969635 /nfs/dbraw/zinc/96/96/35/464969635.db2.gz CCZHMJGZVMRDMZ-UHFFFAOYSA-N 1 1 329.404 2.192 20 5 EEBDMO COc1cccc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-] ZINC000192777779 464994180 /nfs/dbraw/zinc/99/41/80/464994180.db2.gz QLLQANQWYJGLTH-JSGCOSHPSA-N 1 1 333.388 2.160 20 5 EEBDMO CC(C)[N@@H+](C)CCNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184584321 465001250 /nfs/dbraw/zinc/00/12/50/465001250.db2.gz VFLLZLFOOPCKPM-UHFFFAOYSA-N 1 1 328.800 2.388 20 5 EEBDMO C[C@H](CNC(=O)COc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000298502306 465414176 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ZINC000305631331 466411989 /nfs/dbraw/zinc/41/19/89/466411989.db2.gz FTGCUDHCNHKNFN-KBPBESRZSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H]([C@H](C)O)C2)cccc1[N+](=O)[O-] ZINC000305631939 466412281 /nfs/dbraw/zinc/41/22/81/466412281.db2.gz FZQZTDBXJVNAIK-IHRRRGAJSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H]([C@H](C)O)C2)cccc1[N+](=O)[O-] ZINC000305631939 466412287 /nfs/dbraw/zinc/41/22/87/466412287.db2.gz FZQZTDBXJVNAIK-IHRRRGAJSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H]([C@H](C)O)C1 ZINC000305652140 466416268 /nfs/dbraw/zinc/41/62/68/466416268.db2.gz NYDHJRBZCLEPKN-KBPBESRZSA-N 1 1 335.404 2.325 20 5 EEBDMO CC(C)(C(=O)N[C@@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000358123024 466475015 /nfs/dbraw/zinc/47/50/15/466475015.db2.gz MHVGENZJPUBKOJ-LLVKDONJSA-N 1 1 335.379 2.364 20 5 EEBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])n2C)C1 ZINC000347312079 466555416 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2.197 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[C@H](C[NH+]3CCCCC3)C2)c1[N+](=O)[O-] ZINC000365509521 466842386 /nfs/dbraw/zinc/84/23/86/466842386.db2.gz DFOUFCFTHVSUBJ-CYBMUJFWSA-N 1 1 349.435 2.218 20 5 EEBDMO CCOC(=O)c1cc(NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)ccc1[N+](=O)[O-] ZINC000373676369 466885501 /nfs/dbraw/zinc/88/55/01/466885501.db2.gz WEMRIIRJPKHNKS-ZIAGYGMSSA-N 1 1 349.387 2.047 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000411906009 466929502 /nfs/dbraw/zinc/92/95/02/466929502.db2.gz NMPDRXVGBGNPOL-NSHDSACASA-N 1 1 341.383 2.132 20 5 EEBDMO O=C(NC1CC1)c1ccc(N2CCC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000377639936 467103358 /nfs/dbraw/zinc/10/33/58/467103358.db2.gz LOBIRSCYFHIDLF-HNNXBMFYSA-N 1 1 344.415 2.162 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]([C@@H]2CCOC2)C1 ZINC000378236657 467237668 /nfs/dbraw/zinc/23/76/68/467237668.db2.gz PHQWLKPSNIYDOW-HZSPNIEDSA-N 1 1 333.388 2.280 20 5 EEBDMO 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Cc1ccccc1C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001050325703 1243351641 /nfs/dbraw/zinc/35/16/41/1243351641.db2.gz LEFCJDQGSXKSQH-VDHUWJSZSA-N 1 1 345.443 2.425 20 5 EEBDMO O=C(NCc1ccc2c(c1)C[N@H+](CCC1CC1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001054264974 1247934051 /nfs/dbraw/zinc/93/40/51/1247934051.db2.gz YCUKIZGIIGQVIJ-IAGOWNOFSA-N 1 1 329.400 2.084 20 5 EEBDMO O=C(NCc1ccc2c(c1)C[N@@H+](CCC1CC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054264974 1247934064 /nfs/dbraw/zinc/93/40/64/1247934064.db2.gz YCUKIZGIIGQVIJ-IAGOWNOFSA-N 1 1 329.400 2.084 20 5 EEBDMO O=C(NCc1ccc2c(c1)C[N@H+](CCC1CC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054264974 1247934077 /nfs/dbraw/zinc/93/40/77/1247934077.db2.gz YCUKIZGIIGQVIJ-IAGOWNOFSA-N 1 1 329.400 2.084 20 5 EEBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC([C@@H](O)c2ncc[nH]2)CC1 ZINC000851974414 1291937825 /nfs/dbraw/zinc/93/78/25/1291937825.db2.gz XLVHWQCCYFKYRP-OAHLLOKOSA-N 1 1 334.351 2.403 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CCC1=CCCCC1)C2 ZINC001072724667 1296054570 /nfs/dbraw/zinc/05/45/70/1296054570.db2.gz ARRPBILHPVQLGJ-HZPDHXFCSA-N 1 1 333.432 2.076 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](CCC1=CCCCC1)C2 ZINC001072724667 1296054583 /nfs/dbraw/zinc/05/45/83/1296054583.db2.gz ARRPBILHPVQLGJ-HZPDHXFCSA-N 1 1 333.432 2.076 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CCC1=CCCCC1)C2 ZINC001072724667 1296054600 /nfs/dbraw/zinc/05/46/00/1296054600.db2.gz ARRPBILHPVQLGJ-HZPDHXFCSA-N 1 1 333.432 2.076 20 5 EEBDMO COC(=O)c1c(CO[C@@H]2CCc3[nH+]ccn3C2)cccc1[N+](=O)[O-] ZINC001223293825 1300063460 /nfs/dbraw/zinc/06/34/60/1300063460.db2.gz DYFVHJNJPQYHDC-GFCCVEGCSA-N 1 1 331.328 2.110 20 5 EEBDMO CO[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])c(Br)c2)C1 ZINC001229085675 1302604814 /nfs/dbraw/zinc/60/48/14/1302604814.db2.gz GVJAEFAXMDPJTF-LLVKDONJSA-N 1 1 345.193 2.457 20 5 EEBDMO CC[N@H+]1CCC[C@H](Oc2cc(C(=O)OC)c([N+](=O)[O-])cc2F)C1 ZINC001229938466 1302992404 /nfs/dbraw/zinc/99/24/04/1302992404.db2.gz ITKBIMTUCZBDRJ-JTQLQIEISA-N 1 1 326.324 2.384 20 5 EEBDMO C[NH+]1CCC2(CC[C@@H](COc3cc4[nH]ncc4cc3[N+](=O)[O-])O2)CC1 ZINC001230593831 1303301078 /nfs/dbraw/zinc/30/10/78/1303301078.db2.gz BRTDIBKQIRSVNN-ZDUSSCGKSA-N 1 1 346.387 2.493 20 5 EEBDMO CC[N@@H+](CCc1ccccn1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000784172276 1304430059 /nfs/dbraw/zinc/43/00/59/1304430059.db2.gz AHJPMBUNAGPZLX-INIZCTEOSA-N 1 1 345.399 2.294 20 5 EEBDMO CN1CCC[N@H+](CCCNCc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000784534395 1304496283 /nfs/dbraw/zinc/49/62/83/1304496283.db2.gz NWPITEXLGPFRND-UHFFFAOYSA-N 1 1 340.855 2.365 20 5 EEBDMO CN1CCC[N@@H+](CCCNCc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000784534395 1304496289 /nfs/dbraw/zinc/49/62/89/1304496289.db2.gz NWPITEXLGPFRND-UHFFFAOYSA-N 1 1 340.855 2.365 20 5 EEBDMO CC(=O)CCCC(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001233897450 1304633061 /nfs/dbraw/zinc/63/30/61/1304633061.db2.gz ZKWJZPFZCGABFA-UHFFFAOYSA-N 1 1 335.404 2.292 20 5 EEBDMO CC(=O)CCCC(=O)NCCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001233897450 1304633067 /nfs/dbraw/zinc/63/30/67/1304633067.db2.gz ZKWJZPFZCGABFA-UHFFFAOYSA-N 1 1 335.404 2.292 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2nnc(-c3ccc([N+](=O)[O-])o3)n2C)C1 ZINC001121297779 1309973650 /nfs/dbraw/zinc/97/36/50/1309973650.db2.gz SFZSYPVUAVLESC-LBPRGKRZSA-N 1 1 348.407 2.151 20 5 EEBDMO COc1cc(N2CCC(N[C@H]3CC[C@H](C)[NH2+]C3)CC2)ccc1[N+](=O)[O-] ZINC001246079314 1310232419 /nfs/dbraw/zinc/23/24/19/1310232419.db2.gz JTDNTTPHRHXYKR-ZFWWWQNUSA-N 1 1 348.447 2.302 20 5 EEBDMO COc1ncccc1-c1noc([C@H]([NH3+])Cc2cccc([N+](=O)[O-])c2)n1 ZINC001248209821 1310863103 /nfs/dbraw/zinc/86/31/03/1310863103.db2.gz YQNWKTINYIDYJW-CYBMUJFWSA-N 1 1 341.327 2.291 20 5 EEBDMO COc1cncc(-c2noc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)n2)c1 ZINC001248208868 1310863570 /nfs/dbraw/zinc/86/35/70/1310863570.db2.gz MYYCPILDRNDYEN-CQSZACIVSA-N 1 1 341.327 2.291 20 5 EEBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@](F)(COC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 ZINC000842335046 1315687182 /nfs/dbraw/zinc/68/71/82/1315687182.db2.gz IQMBRWIQHYWZLB-MMTVNHQJSA-N 1 1 336.363 2.370 20 5 EEBDMO C[C@H](c1ccccc1)[N@@H+]1CC[C@@](F)(COC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC000842335046 1315687184 /nfs/dbraw/zinc/68/71/84/1315687184.db2.gz IQMBRWIQHYWZLB-MMTVNHQJSA-N 1 1 336.363 2.370 20 5 EEBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@](F)(COC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC000842335046 1315687187 /nfs/dbraw/zinc/68/71/87/1315687187.db2.gz IQMBRWIQHYWZLB-MMTVNHQJSA-N 1 1 336.363 2.370 20 5 EEBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1CCN(C2COC2)CC1 ZINC001254549308 1318119379 /nfs/dbraw/zinc/11/93/79/1318119379.db2.gz RCSKTXGWRCMGKL-CQSZACIVSA-N 1 1 333.432 2.226 20 5 EEBDMO COc1ncnc2c1CC[N@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])CC2 ZINC001254556323 1318119745 /nfs/dbraw/zinc/11/97/45/1318119745.db2.gz KMQZWUNLCNAFCG-ZDUSSCGKSA-N 1 1 342.399 2.425 20 5 EEBDMO COc1ncnc2c1CC[N@@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])C2 ZINC001254558525 1318121192 /nfs/dbraw/zinc/12/11/92/1318121192.db2.gz CEWPEVJDFFQRGM-GFCCVEGCSA-N 1 1 328.372 2.383 20 5 EEBDMO COc1ncnc2c1CC[N@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])C2 ZINC001254558525 1318121200 /nfs/dbraw/zinc/12/12/00/1318121200.db2.gz CEWPEVJDFFQRGM-GFCCVEGCSA-N 1 1 328.372 2.383 20 5 EEBDMO Cc1ccnc(O[C@@H]2CC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254612151 1318145624 /nfs/dbraw/zinc/14/56/24/1318145624.db2.gz VKNKWIHBVJKAJB-DLBZAZTESA-N 1 1 340.383 2.314 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CC[C@H](C(C)=O)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101522 1318647067 /nfs/dbraw/zinc/64/70/67/1318647067.db2.gz MPJDOEVRJUUWOE-AWEZNQCLSA-N 1 1 347.415 2.483 20 5 EEBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2ncc([N+](=O)[O-])cc2F)CC1 ZINC001165109313 1321456653 /nfs/dbraw/zinc/45/66/53/1321456653.db2.gz SZQTXTQNWPPUEE-CYBMUJFWSA-N 1 1 338.383 2.209 20 5 EEBDMO CCOC(=O)c1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[nH]1 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/nfs/dbraw/zinc/96/30/33/1334963033.db2.gz OFMHPUUJNFOHGA-KRWDZBQOSA-N 1 1 334.416 2.399 20 5 EEBDMO CN(C(=O)[C@H](Cc1ccccc1)[NH2+]CC[N+](=O)[O-])c1ccccc1 ZINC001335985300 1336460593 /nfs/dbraw/zinc/46/05/93/1336460593.db2.gz BOBVLOWYEPWTRK-KRWDZBQOSA-N 1 1 327.384 2.127 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000848583946 1338725402 /nfs/dbraw/zinc/72/54/02/1338725402.db2.gz JOQBTRFYWSINBH-WDEREUQCSA-N 1 1 343.330 2.165 20 5 EEBDMO CCCC[N@@H+](C)CC1CCN(c2nnc(C[N+](=O)[O-])n2CC)CC1 ZINC001356349676 1338818015 /nfs/dbraw/zinc/81/80/15/1338818015.db2.gz STFHMAYSTMCOBW-UHFFFAOYSA-N 1 1 338.456 2.023 20 5 EEBDMO C[C@H](CNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC001590259536 1349234362 /nfs/dbraw/zinc/23/43/62/1349234362.db2.gz LCDMXGFESNUJLG-NWDGAFQWSA-N 1 1 345.407 2.307 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNc1cc(C)c([N+](=O)[O-])c(-c2nn[nH]n2)c1 ZINC001590731830 1349394295 /nfs/dbraw/zinc/39/42/95/1349394295.db2.gz DNGGPBNBMJFVFQ-CYBMUJFWSA-N 1 1 345.407 2.370 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nn[nH]n2)cc1N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC001607081192 1351409229 /nfs/dbraw/zinc/40/92/29/1351409229.db2.gz AZMIKTLJOWIHKE-GXTWGEPZSA-N 1 1 343.391 2.204 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nn[nH]n2)cc1N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC001607081194 1351409573 /nfs/dbraw/zinc/40/95/73/1351409573.db2.gz AZMIKTLJOWIHKE-OCCSQVGLSA-N 1 1 343.391 2.204 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nn[nH]n2)cc1NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC001607083124 1351411087 /nfs/dbraw/zinc/41/10/87/1351411087.db2.gz XLUDMCQZAJWEJH-ZDUSSCGKSA-N 1 1 343.391 2.204 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1NC[C@H]1CC[N@H+]1C1CCCC1 ZINC001607084780 1351411719 /nfs/dbraw/zinc/41/17/19/1351411719.db2.gz YEKLNLJQPAPBPY-GFCCVEGCSA-N 1 1 343.391 2.204 20 5 EEBDMO CCCOCC(=O)N1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001195159849 1368504052 /nfs/dbraw/zinc/50/40/52/1368504052.db2.gz UQFGICCXLMOCMM-UHFFFAOYSA-N 1 1 335.404 2.056 20 5 EEBDMO CCCOCC(=O)N1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001195159849 1368504057 /nfs/dbraw/zinc/50/40/57/1368504057.db2.gz UQFGICCXLMOCMM-UHFFFAOYSA-N 1 1 335.404 2.056 20 5 EEBDMO C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2)C1 ZINC000839533488 1372908677 /nfs/dbraw/zinc/90/86/77/1372908677.db2.gz UTNQPCXNFDNLMS-IAOVAPTHSA-N 1 1 331.416 2.200 20 5 EEBDMO C[C@H]1CCC[N@H+](Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)C1 ZINC000839533488 1372908679 /nfs/dbraw/zinc/90/86/79/1372908679.db2.gz UTNQPCXNFDNLMS-IAOVAPTHSA-N 1 1 331.416 2.200 20 5 EEBDMO C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)C1 ZINC000839533488 1372908681 /nfs/dbraw/zinc/90/86/81/1372908681.db2.gz UTNQPCXNFDNLMS-IAOVAPTHSA-N 1 1 331.416 2.200 20 5 EEBDMO C[C@@H]1CN(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C[C@H](C)[N@@H+]1C ZINC000840090969 1372921221 /nfs/dbraw/zinc/92/12/21/1372921221.db2.gz VXSIHKOJHISJDD-OKILXGFUSA-N 1 1 329.404 2.440 20 5 EEBDMO 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CNc1c(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)cccc1[N+](=O)[O-] ZINC000344682672 161235867 /nfs/dbraw/zinc/23/58/67/161235867.db2.gz OFIXJZPTGUPURR-CQSZACIVSA-N 1 1 334.420 2.487 20 5 EEBDMO CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000344880819 161253330 /nfs/dbraw/zinc/25/33/30/161253330.db2.gz HDMKTVSWOWZQBH-CYBMUJFWSA-N 1 1 344.371 2.358 20 5 EEBDMO Cn1c(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000345296673 161289099 /nfs/dbraw/zinc/28/90/99/161289099.db2.gz MEJZGSRCLFHVNK-AWEZNQCLSA-N 1 1 346.387 2.483 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000345371994 161296250 /nfs/dbraw/zinc/29/62/50/161296250.db2.gz CRDKLHSRISXKJK-ZFWWWQNUSA-N 1 1 334.420 2.261 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000345941778 161344081 /nfs/dbraw/zinc/34/40/81/161344081.db2.gz DNDINWQMYWMQLR-KGLIPLIRSA-N 1 1 334.420 2.338 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(C(=O)CCOc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000345975069 161346905 /nfs/dbraw/zinc/34/69/05/161346905.db2.gz XTKOQMGHZBFTDE-KGLIPLIRSA-N 1 1 335.404 2.305 20 5 EEBDMO COc1cc[nH+]c(N2CCN(Cc3c(F)cccc3[N+](=O)[O-])CC2)c1 ZINC000355368619 163164531 /nfs/dbraw/zinc/16/45/31/163164531.db2.gz RJZHKAYBWZCXBH-UHFFFAOYSA-N 1 1 346.362 2.460 20 5 EEBDMO CNc1c(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](C)C3)cccc1[N+](=O)[O-] ZINC000356272815 163387573 /nfs/dbraw/zinc/38/75/73/163387573.db2.gz DCWAMRBHPXFFRW-KRWDZBQOSA-N 1 1 332.404 2.194 20 5 EEBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000358981607 164028855 /nfs/dbraw/zinc/02/88/55/164028855.db2.gz OFDBIFYVZRCIDE-SNVBAGLBSA-N 1 1 343.330 2.362 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2cnc(CCN3CC[C@]4(CC[NH2+]C4)C3)o2)c1 ZINC000360567712 164340818 /nfs/dbraw/zinc/34/08/18/164340818.db2.gz HAURQMBTVIFKLG-SFHVURJKSA-N 1 1 342.399 2.478 20 5 EEBDMO Cn1cc[nH+]c1N1CCC(Nc2nc3sccn3c2[N+](=O)[O-])CC1 ZINC000364608417 165205883 /nfs/dbraw/zinc/20/58/83/165205883.db2.gz RCURQWSHROWEQZ-UHFFFAOYSA-N 1 1 347.404 2.118 20 5 EEBDMO Cn1cc([C@@H](O)C[C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)cn1 ZINC000369250665 166221715 /nfs/dbraw/zinc/22/17/15/166221715.db2.gz MDAYOTUDJZYWIL-IRXDYDNUSA-N 1 1 330.388 2.416 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)NCc1c[nH+]c2n1CCCC2 ZINC000375218465 167089990 /nfs/dbraw/zinc/08/99/90/167089990.db2.gz MCYLLLDZPVFVQO-UHFFFAOYSA-N 1 1 343.387 2.170 20 5 EEBDMO C[C@@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C1=CC[N@H+](C)CC1 ZINC000272786683 269021128 /nfs/dbraw/zinc/02/11/28/269021128.db2.gz BLQCCFVBMKEATE-SECBINFHSA-N 1 1 345.446 2.122 20 5 EEBDMO C[C@@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000272786683 269021131 /nfs/dbraw/zinc/02/11/31/269021131.db2.gz BLQCCFVBMKEATE-SECBINFHSA-N 1 1 345.446 2.122 20 5 EEBDMO COC[C@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000275417945 269114804 /nfs/dbraw/zinc/11/48/04/269114804.db2.gz CDQGVZGZOYQKHV-NSHDSACASA-N 1 1 325.340 2.031 20 5 EEBDMO C[C@H]1CN(c2c(F)cc([N+](=O)[O-])cc2F)CC[N@@H+]1CC(C)(C)O ZINC000275675148 269134729 /nfs/dbraw/zinc/13/47/29/269134729.db2.gz ZUNKLATXRRSESG-JTQLQIEISA-N 1 1 329.347 2.154 20 5 EEBDMO C[C@H]1CN(c2c(F)cc([N+](=O)[O-])cc2F)CC[N@H+]1CC(C)(C)O ZINC000275675148 269134730 /nfs/dbraw/zinc/13/47/30/269134730.db2.gz ZUNKLATXRRSESG-JTQLQIEISA-N 1 1 329.347 2.154 20 5 EEBDMO C[C@H](CS(C)(=O)=O)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279620715 269294937 /nfs/dbraw/zinc/29/49/37/269294937.db2.gz YGTJXXPIVZWHMC-MRVPVSSYSA-N 1 1 340.323 2.136 20 5 EEBDMO COCCCNC(=O)[C@H](C)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451554464 274021827 /nfs/dbraw/zinc/02/18/27/274021827.db2.gz ZUGLRXUVAMHHDF-HOCLYGCPSA-N 1 1 349.431 2.315 20 5 EEBDMO COc1ccc(C[N@H+]2CCCN(c3ncc([N+](=O)[O-])cn3)CC2)cc1 ZINC000273141747 274109035 /nfs/dbraw/zinc/10/90/35/274109035.db2.gz FELHAOMSFUIAKL-UHFFFAOYSA-N 1 1 343.387 2.106 20 5 EEBDMO CC(C)OCC[NH+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1 ZINC000278291034 274345204 /nfs/dbraw/zinc/34/52/04/274345204.db2.gz GBCWGRQTTORWAR-UHFFFAOYSA-N 1 1 334.420 2.110 20 5 EEBDMO C[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC(C)(CO)CO ZINC000289331546 275109859 /nfs/dbraw/zinc/10/98/59/275109859.db2.gz HSPUTPLSLLZAJS-UHFFFAOYSA-N 1 1 337.203 2.324 20 5 EEBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC(C)(CO)CO ZINC000289331546 275109860 /nfs/dbraw/zinc/10/98/60/275109860.db2.gz HSPUTPLSLLZAJS-UHFFFAOYSA-N 1 1 337.203 2.324 20 5 EEBDMO C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCC1(F)F ZINC000289684171 275138899 /nfs/dbraw/zinc/13/88/99/275138899.db2.gz GNAXONNQKVBCMJ-NEPJUHHUSA-N 1 1 330.331 2.312 20 5 EEBDMO COc1ccc(OCC[N@H+]2CC[C@H](n3cc(C)cn3)C2)c([N+](=O)[O-])c1 ZINC000289782096 275148239 /nfs/dbraw/zinc/14/82/39/275148239.db2.gz HEZTVEQPWCGSOV-AWEZNQCLSA-N 1 1 346.387 2.434 20 5 EEBDMO CC[N@@H+](C[C@@H](C)OC)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000291223893 275283869 /nfs/dbraw/zinc/28/38/69/275283869.db2.gz LSVATLORASYZIT-VXGBXAGGSA-N 1 1 339.392 2.287 20 5 EEBDMO O=C(c1cc(C[NH+]2CCCC2)on1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000292007122 275363312 /nfs/dbraw/zinc/36/33/12/275363312.db2.gz UCCQGKCQHBWWAJ-UHFFFAOYSA-N 1 1 342.355 2.382 20 5 EEBDMO COc1cc(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)cc([N+](=O)[O-])c1C ZINC000293884057 293318659 /nfs/dbraw/zinc/31/86/59/293318659.db2.gz FZCQCVQVJPRLDC-GOSISDBHSA-N 1 1 347.415 2.470 20 5 EEBDMO Cn1cc[nH+]c1C[C@@H]1CCCN(c2nc3sccn3c2[N+](=O)[O-])C1 ZINC000301717940 294886616 /nfs/dbraw/zinc/88/66/16/294886616.db2.gz OJBKEXBZWPMAKL-NSHDSACASA-N 1 1 346.416 2.497 20 5 EEBDMO C[C@H](CN1CCN(C)CC1)[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000154907383 298619787 /nfs/dbraw/zinc/61/97/87/298619787.db2.gz OXCHGWZGYXBXBZ-CRAIPNDOSA-N 1 1 346.475 2.141 20 5 EEBDMO COCC1(C)CC[NH+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000332281417 311982552 /nfs/dbraw/zinc/98/25/52/311982552.db2.gz HQKRLODGYWQHDG-UHFFFAOYSA-N 1 1 347.415 2.232 20 5 EEBDMO CNc1c(C(=O)NCC[N@H+]2CCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000444619818 315311401 /nfs/dbraw/zinc/31/14/01/315311401.db2.gz ZRKRNJDXOAOERW-UHFFFAOYSA-N 1 1 334.420 2.488 20 5 EEBDMO O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000548084021 318353312 /nfs/dbraw/zinc/35/33/12/318353312.db2.gz JDHFYOKVJHETPV-UHFFFAOYSA-N 1 1 335.408 2.046 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1NC(=O)CCCC[NH+]1CCOCC1 ZINC000577065740 320229373 /nfs/dbraw/zinc/22/93/73/320229373.db2.gz CPABVAASJHWJID-UHFFFAOYSA-N 1 1 336.392 2.078 20 5 EEBDMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC[C@@H]([NH+]2CCOCC2)CC1 ZINC000580212311 324018147 /nfs/dbraw/zinc/01/81/47/324018147.db2.gz GRRSYETUOHWVQB-OAHLLOKOSA-N 1 1 347.415 2.489 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@H](CNc2ncnc3ccc([N+](=O)[O-])cc32)C1 ZINC000611699354 449387069 /nfs/dbraw/zinc/38/70/69/449387069.db2.gz APPHAPSUCFXBGQ-CQSZACIVSA-N 1 1 345.403 2.307 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000133661863 462957225 /nfs/dbraw/zinc/95/72/25/462957225.db2.gz MMKJYVWHGMMWOS-CABZTGNLSA-N 1 1 348.359 2.166 20 5 EEBDMO CC[N@@H+](CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)C1CC1 ZINC000263803531 464197488 /nfs/dbraw/zinc/19/74/88/464197488.db2.gz ZZLJJEVZWRNKEL-UHFFFAOYSA-N 1 1 330.388 2.150 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1N1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000336794081 465047240 /nfs/dbraw/zinc/04/72/40/465047240.db2.gz ZPBFGSFBDPRJFN-CVEARBPZSA-N 1 1 341.415 2.287 20 5 EEBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](CCc2ccccc2F)CC1 ZINC000296168727 465103089 /nfs/dbraw/zinc/10/30/89/465103089.db2.gz YTTDQEPUKIYALG-UHFFFAOYSA-N 1 1 330.363 2.494 20 5 EEBDMO Cc1cc(Cl)c(C(=O)NCCC[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000296307874 465151831 /nfs/dbraw/zinc/15/18/31/465151831.db2.gz GKJMBHIMHUOBEF-UHFFFAOYSA-N 1 1 341.795 2.009 20 5 EEBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2ccc([N+](=O)[O-])n2C)c1 ZINC000347707264 465181143 /nfs/dbraw/zinc/18/11/43/465181143.db2.gz OECPAOYGSPHEOG-UHFFFAOYSA-N 1 1 330.388 2.315 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](SC)C1 ZINC000296424577 465190256 /nfs/dbraw/zinc/19/02/56/465190256.db2.gz VAKYZHAOXSOQRK-GFCCVEGCSA-N 1 1 339.417 2.369 20 5 EEBDMO O=C(NC1CC1)N[C@H]1CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000355528659 465255172 /nfs/dbraw/zinc/25/51/72/465255172.db2.gz ZSZSQHAMKQLZLC-QTLSWZBMSA-N 1 1 330.388 2.144 20 5 EEBDMO O=C(NC1CC1)N[C@H]1CC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000355528659 465255179 /nfs/dbraw/zinc/25/51/79/465255179.db2.gz ZSZSQHAMKQLZLC-QTLSWZBMSA-N 1 1 330.388 2.144 20 5 EEBDMO O=C(NCCC[N@H+]1CCc2ccccc2C1)c1cc([N+](=O)[O-])c[nH]1 ZINC000046063040 462643530 /nfs/dbraw/zinc/64/35/30/462643530.db2.gz BBUMARWRRAVUPB-UHFFFAOYSA-N 1 1 328.372 2.101 20 5 EEBDMO CS(=O)(=O)c1cccc(N[C@@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000089620034 462698947 /nfs/dbraw/zinc/69/89/47/462698947.db2.gz QZTUVVFANLTGCH-DGCLKSJQSA-N 1 1 339.417 2.037 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCOc3ccccc3C2)c1 ZINC000076547908 462876810 /nfs/dbraw/zinc/87/68/10/462876810.db2.gz GZMDUFWCGUNXAI-INIZCTEOSA-N 1 1 344.367 2.229 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCOc3ccccc3C2)c1 ZINC000076547908 462876814 /nfs/dbraw/zinc/87/68/14/462876814.db2.gz GZMDUFWCGUNXAI-INIZCTEOSA-N 1 1 344.367 2.229 20 5 EEBDMO CCOC(=O)c1ccnc(NC[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-] ZINC000077937453 463073405 /nfs/dbraw/zinc/07/34/05/463073405.db2.gz QUUFOSZCLYAKKP-GFCCVEGCSA-N 1 1 336.392 2.309 20 5 EEBDMO C[C@@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[N@H+]1CCC[C@H](C)C1 ZINC000068084454 463089762 /nfs/dbraw/zinc/08/97/62/463089762.db2.gz HEVFPKVBUFBUIW-RYUDHWBXSA-N 1 1 345.403 2.321 20 5 EEBDMO C[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)[N@H+]1CCC[C@@H](C)C1 ZINC000068118553 463095420 /nfs/dbraw/zinc/09/54/20/463095420.db2.gz CXKKRSUDYOUVMD-MNOVXSKESA-N 1 1 338.383 2.166 20 5 EEBDMO Cc1cc(NC[C@@H](C)N2CC[NH+](C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000095988678 463130617 /nfs/dbraw/zinc/13/06/17/463130617.db2.gz FURJAZRNZGJISY-CQSZACIVSA-N 1 1 343.431 2.499 20 5 EEBDMO C[N@@H+](CCOc1ccccc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000026712009 463169182 /nfs/dbraw/zinc/16/91/82/463169182.db2.gz UZKLJVOIRWTXBB-MRXNPFEDSA-N 1 1 346.383 2.345 20 5 EEBDMO O=C(/C=C\c1ccc(F)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000491319395 468349689 /nfs/dbraw/zinc/34/96/89/468349689.db2.gz JMWSWUKRZZMYPN-JFOCPDPESA-N 1 1 333.363 2.490 20 5 EEBDMO C[N@@H+](CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)Cc1ccccc1 ZINC000056191928 463382788 /nfs/dbraw/zinc/38/27/88/463382788.db2.gz NNQWFOJPUCJPSO-UHFFFAOYSA-N 1 1 346.362 2.178 20 5 EEBDMO O=C1[C@H]([N@H+]2CCC3(C2)CCOCC3)CCN1c1cccc([N+](=O)[O-])c1 ZINC000072899020 463561809 /nfs/dbraw/zinc/56/18/09/463561809.db2.gz MAXDCGQOLJUHLK-MRXNPFEDSA-N 1 1 345.399 2.203 20 5 EEBDMO C[C@@H](NC(=O)N[C@H]1CC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000108559071 463615432 /nfs/dbraw/zinc/61/54/32/463615432.db2.gz PXTANXFWUVWGNM-DOMZBBRYSA-N 1 1 332.404 2.439 20 5 EEBDMO CCOc1cc(C[N@H+]2CCC[C@H](CNC(C)=O)C2)ccc1[N+](=O)[O-] ZINC000276867942 463787482 /nfs/dbraw/zinc/78/74/82/463787482.db2.gz HEGCFNOOFBTHGG-OAHLLOKOSA-N 1 1 335.404 2.342 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(C(=O)NCCc3ccccc3[N+](=O)[O-])CC[C@H]21 ZINC000269002556 463843053 /nfs/dbraw/zinc/84/30/53/463843053.db2.gz ZPAVOBKIDDGHJB-JKSUJKDBSA-N 1 1 346.431 2.263 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000283447013 463888190 /nfs/dbraw/zinc/88/81/90/463888190.db2.gz KNQZLXANVLJILC-QWRGUYRKSA-N 1 1 338.383 2.166 20 5 EEBDMO CCN1CC[NH+](C[C@H](C)CNc2ccc([N+](=O)[O-])c(C(C)=O)c2)CC1 ZINC000283623113 463947465 /nfs/dbraw/zinc/94/74/65/463947465.db2.gz STHOLZSQMXGNIJ-CQSZACIVSA-N 1 1 348.447 2.483 20 5 EEBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(Cn4cncn4)CC3)nc2c1 ZINC000186267432 463964474 /nfs/dbraw/zinc/96/44/74/463964474.db2.gz NFQXFVKEDRBWFS-UHFFFAOYSA-N 1 1 342.359 2.240 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000186370261 463985280 /nfs/dbraw/zinc/98/52/80/463985280.db2.gz ZGUNYCCXWJJEJY-KRWDZBQOSA-N 1 1 349.387 2.259 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000186370261 463985286 /nfs/dbraw/zinc/98/52/86/463985286.db2.gz ZGUNYCCXWJJEJY-KRWDZBQOSA-N 1 1 349.387 2.259 20 5 EEBDMO COCC[N@@H+](Cc1ccccn1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269692387 464059939 /nfs/dbraw/zinc/05/99/39/464059939.db2.gz VQOGPFOFBUSLBK-QGZVFWFLSA-N 1 1 331.372 2.172 20 5 EEBDMO COCC[N@H+](Cc1ccccn1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269692387 464059946 /nfs/dbraw/zinc/05/99/46/464059946.db2.gz VQOGPFOFBUSLBK-QGZVFWFLSA-N 1 1 331.372 2.172 20 5 EEBDMO C[C@H]1CN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000292278304 464183238 /nfs/dbraw/zinc/18/32/38/464183238.db2.gz MAUSNMYINJPTEH-GFCCVEGCSA-N 1 1 332.404 2.004 20 5 EEBDMO Nc1nc(N2CCC[N@@H+](CC3CCCCC3)CC2)ncc1[N+](=O)[O-] ZINC000263958168 464252465 /nfs/dbraw/zinc/25/24/65/464252465.db2.gz NIXOUYPMIVZGRJ-UHFFFAOYSA-N 1 1 334.424 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C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)CN1CCC(C)CC1 ZINC000449122422 467619595 /nfs/dbraw/zinc/61/95/95/467619595.db2.gz LIJNJNHYPMYUQJ-DOTOQJQBSA-N 1 1 335.448 2.208 20 5 EEBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])NC[C@@H](O)C[NH+]1CCC(C)CC1 ZINC000449122422 467619597 /nfs/dbraw/zinc/61/95/97/467619597.db2.gz LIJNJNHYPMYUQJ-DOTOQJQBSA-N 1 1 335.448 2.208 20 5 EEBDMO O=[N+]([O-])c1cccc2c1ccnc2NC[C@H]1C[N@@H+](C2CC2)CCO1 ZINC000450315534 467824066 /nfs/dbraw/zinc/82/40/66/467824066.db2.gz FMIGSMNOMPSJGX-ZDUSSCGKSA-N 1 1 328.372 2.418 20 5 EEBDMO O=[N+]([O-])c1cccc2c1ccnc2NC[C@H]1C[N@H+](C2CC2)CCO1 ZINC000450315534 467824069 /nfs/dbraw/zinc/82/40/69/467824069.db2.gz FMIGSMNOMPSJGX-ZDUSSCGKSA-N 1 1 328.372 2.418 20 5 EEBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2N[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000450351792 467833420 /nfs/dbraw/zinc/83/34/20/467833420.db2.gz ABSIFOOKRVNYAR-RYUDHWBXSA-N 1 1 330.388 2.468 20 5 EEBDMO C[C@@H]1C[C@H]([NH+]2CCOCC2)CN1c1nccc2c1cccc2[N+](=O)[O-] ZINC000450529174 467864989 /nfs/dbraw/zinc/86/49/89/467864989.db2.gz MHNKEHOYMXNHTC-KGLIPLIRSA-N 1 1 342.399 2.442 20 5 EEBDMO C[C@H](CO)[N@H+]1CCCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000487764627 468052934 /nfs/dbraw/zinc/05/29/34/468052934.db2.gz YRPXRIHJZYIGPC-CYBMUJFWSA-N 1 1 330.388 2.036 20 5 EEBDMO NC(=O)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC000532650760 468129638 /nfs/dbraw/zinc/12/96/38/468129638.db2.gz QQVSLOQFUFKQOO-OAHLLOKOSA-N 1 1 326.356 2.426 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC000532650760 468129641 /nfs/dbraw/zinc/12/96/41/468129641.db2.gz QQVSLOQFUFKQOO-OAHLLOKOSA-N 1 1 326.356 2.426 20 5 EEBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000519574296 468173462 /nfs/dbraw/zinc/17/34/62/468173462.db2.gz YNDSBGAFFOIIOY-CYBMUJFWSA-N 1 1 337.420 2.383 20 5 EEBDMO COc1ccc(C(=O)N2CCC[C@]3(CC[N@@H+](C)C3)C2)cc1[N+](=O)[O-] ZINC000597715577 468649111 /nfs/dbraw/zinc/64/91/11/468649111.db2.gz MVHZIKRNGWBBKL-QGZVFWFLSA-N 1 1 333.388 2.161 20 5 EEBDMO O=[N+]([O-])c1cc(F)ccc1CN1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000595295965 468803512 /nfs/dbraw/zinc/80/35/12/468803512.db2.gz IQAPTPWYJYJKOY-INIZCTEOSA-N 1 1 337.395 2.421 20 5 EEBDMO CCC[N@H+]1CC[C@@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000598342439 468837167 /nfs/dbraw/zinc/83/71/67/468837167.db2.gz NJVXVWLILAFQLR-CQSZACIVSA-N 1 1 330.388 2.150 20 5 EEBDMO CC[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](CC)CO1 ZINC000593058800 468855981 /nfs/dbraw/zinc/85/59/81/468855981.db2.gz OTYUGGPJHRUSHZ-VNQPRFMTSA-N 1 1 338.404 2.224 20 5 EEBDMO C[C@@H]1COCC[N@H+]1C1CCN(Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595496787 468875810 /nfs/dbraw/zinc/87/58/10/468875810.db2.gz IMSFWPOKRYZJDU-CYBMUJFWSA-N 1 1 337.395 2.419 20 5 EEBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595543087 468894842 /nfs/dbraw/zinc/89/48/42/468894842.db2.gz IPAJDWWIUGUZOH-SFHVURJKSA-N 1 1 343.358 2.363 20 5 EEBDMO CCCc1n[nH]c(C(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-] ZINC000598558032 468911774 /nfs/dbraw/zinc/91/17/74/468911774.db2.gz BNJLLXLIJOHOMZ-CYBMUJFWSA-N 1 1 349.435 2.122 20 5 EEBDMO O=C(CC[N@H+]1C[C@@H]2C[C@H](O)CC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000595637872 468934247 /nfs/dbraw/zinc/93/42/47/468934247.db2.gz YRGUCBUEIWGZQE-HZSPNIEDSA-N 1 1 333.388 2.016 20 5 EEBDMO C[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1csnn1 ZINC000602695027 469016955 /nfs/dbraw/zinc/01/69/55/469016955.db2.gz VKMUSLSHIPJPFT-SNVBAGLBSA-N 1 1 334.405 2.161 20 5 EEBDMO CC[N@@H+](CCOc1ccccc1OC)CCn1cc([N+](=O)[O-])cn1 ZINC000595883904 469063540 /nfs/dbraw/zinc/06/35/40/469063540.db2.gz DBIKOPUKRIBLLU-UHFFFAOYSA-N 1 1 334.376 2.201 20 5 EEBDMO NC(=O)c1cc(N2CC[NH+](Cc3cccs3)CC2)ccc1[N+](=O)[O-] ZINC000596058331 469131828 /nfs/dbraw/zinc/13/18/28/469131828.db2.gz FAVWOXRDISRPOT-UHFFFAOYSA-N 1 1 346.412 2.077 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@H+](C(C)(C)C)C2)n1 ZINC000596306602 469239146 /nfs/dbraw/zinc/23/91/46/469239146.db2.gz HINWJAGRBWUXES-LLVKDONJSA-N 1 1 336.392 2.309 20 5 EEBDMO COC1(CO)CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000618550720 469384786 /nfs/dbraw/zinc/38/47/86/469384786.db2.gz BOJMWDRTDXGSGF-UHFFFAOYSA-N 1 1 338.404 2.355 20 5 EEBDMO C[N@@H+](CCOC(C)(C)C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000612092306 469391590 /nfs/dbraw/zinc/39/15/90/469391590.db2.gz INGOSYBUHGLPLC-CYBMUJFWSA-N 1 1 326.393 2.081 20 5 EEBDMO CN(C(=O)C[N@@H+]1CCC[C@H](n2ccnc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000609257941 469907268 /nfs/dbraw/zinc/90/72/68/469907268.db2.gz HLEZYFGBKUVSDY-INIZCTEOSA-N 1 1 343.387 2.091 20 5 EEBDMO CN(C(=O)C[N@H+]1CCC[C@H](n2ccnc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000609257941 469907271 /nfs/dbraw/zinc/90/72/71/469907271.db2.gz HLEZYFGBKUVSDY-INIZCTEOSA-N 1 1 343.387 2.091 20 5 EEBDMO Cn1cc(CNCCC[NH2+]C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000415066968 534733554 /nfs/dbraw/zinc/73/35/54/534733554.db2.gz JSDLZFVTWOXOFP-UHFFFAOYSA-N 1 1 329.404 2.227 20 5 EEBDMO CC(C)(C)[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CCS(C)(=O)=O ZINC000131614745 526279808 /nfs/dbraw/zinc/27/98/08/526279808.db2.gz RSNBCENIQUVBBG-UHFFFAOYSA-N 1 1 344.433 2.119 20 5 EEBDMO CC(C)(C)[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CCS(C)(=O)=O ZINC000131614745 526279810 /nfs/dbraw/zinc/27/98/10/526279810.db2.gz RSNBCENIQUVBBG-UHFFFAOYSA-N 1 1 344.433 2.119 20 5 EEBDMO CC[N@H+]1CCC[C@@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000194629748 535535706 /nfs/dbraw/zinc/53/57/06/535535706.db2.gz FBYMOLUUFYDPCB-OAHLLOKOSA-N 1 1 346.431 2.409 20 5 EEBDMO Cc1[nH+]ccn1CCOC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000771913033 577238156 /nfs/dbraw/zinc/23/81/56/577238156.db2.gz YLOXBERPOQXRCA-UHFFFAOYSA-N 1 1 341.327 2.142 20 5 EEBDMO CC[C@@H]1CN(C(C)=O)[C@@H](CC)C[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776591263 577463617 /nfs/dbraw/zinc/46/36/17/577463617.db2.gz INNCEOCLHWTCKL-RYRKJORJSA-N 1 1 349.431 2.350 20 5 EEBDMO Cn1ccnc1[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000770028583 577589229 /nfs/dbraw/zinc/58/92/29/577589229.db2.gz GOUOSTQFJKPMLP-GDBMZVCRSA-N 1 1 330.388 2.241 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000771026127 577608130 /nfs/dbraw/zinc/60/81/30/577608130.db2.gz UFAVDKCXCIMRGI-SECBINFHSA-N 1 1 342.193 2.133 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000771026127 577608131 /nfs/dbraw/zinc/60/81/31/577608131.db2.gz UFAVDKCXCIMRGI-SECBINFHSA-N 1 1 342.193 2.133 20 5 EEBDMO Cc1nn(C[N@H+]2CC[C@H](OCC(C)C)C2)c2ncc([N+](=O)[O-])cc12 ZINC000759144868 577637920 /nfs/dbraw/zinc/63/79/20/577637920.db2.gz PHTSNPBKIVYXQE-AWEZNQCLSA-N 1 1 333.392 2.352 20 5 EEBDMO Cc1nn(C[N@@H+]2CC[C@H](OCC(C)C)C2)c2ncc([N+](=O)[O-])cc12 ZINC000759144868 577637921 /nfs/dbraw/zinc/63/79/21/577637921.db2.gz PHTSNPBKIVYXQE-AWEZNQCLSA-N 1 1 333.392 2.352 20 5 EEBDMO COC(=O)c1cc(C(=O)OCCCn2cc[nH+]c2C)cc([N+](=O)[O-])c1 ZINC000763116229 577715327 /nfs/dbraw/zinc/71/53/27/577715327.db2.gz PVSLDNPLKFNACA-UHFFFAOYSA-N 1 1 347.327 2.133 20 5 EEBDMO CC[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2N2CCOC2=O)C[C@@H]1C ZINC000754079011 577799842 /nfs/dbraw/zinc/79/98/42/577799842.db2.gz FGKAFIPIKBXBBY-LBPRGKRZSA-N 1 1 334.376 2.082 20 5 EEBDMO Cn1ccnc1[C@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000755790406 577831416 /nfs/dbraw/zinc/83/14/16/577831416.db2.gz OBIJIQXZIRQVPM-LBPRGKRZSA-N 1 1 326.360 2.125 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(O)c(OC)c2[N+](=O)[O-])C1 ZINC000892133187 676906869 /nfs/dbraw/zinc/90/68/69/676906869.db2.gz KKGFAJCRCFJAFE-ZDUSSCGKSA-N 1 1 337.420 2.473 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C1 ZINC000892036065 677932465 /nfs/dbraw/zinc/93/24/65/677932465.db2.gz RDIWZUJIWZQXOQ-GFCCVEGCSA-N 1 1 330.388 2.341 20 5 EEBDMO Cn1ncc([N+](=O)[O-])c1NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000892324699 678809602 /nfs/dbraw/zinc/80/96/02/678809602.db2.gz BVWXJQFYVKQUOP-OAHLLOKOSA-N 1 1 329.404 2.305 20 5 EEBDMO COc1cc(C[N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1O ZINC000178860621 681255086 /nfs/dbraw/zinc/25/50/86/681255086.db2.gz NXNLDKAWDXQHLM-INIZCTEOSA-N 1 1 332.356 2.474 20 5 EEBDMO Cc1ccnc(N2CC[NH+](C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000137076878 682069121 /nfs/dbraw/zinc/06/91/21/682069121.db2.gz UGJVZRXCDGEXSY-KRWDZBQOSA-N 1 1 342.399 2.154 20 5 EEBDMO Cc1c(CNC(=O)NCC[N@H+]2CCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000894396297 682805967 /nfs/dbraw/zinc/80/59/67/682805967.db2.gz NBZGPZJSJVRRNQ-UHFFFAOYSA-N 1 1 334.420 2.434 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)c1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000892840550 683125171 /nfs/dbraw/zinc/12/51/71/683125171.db2.gz PZASTJJIKKJPNC-OCCSQVGLSA-N 1 1 344.415 2.223 20 5 EEBDMO C[C@@H](Nc1nccc2c1cccc2[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C ZINC000895245610 684372505 /nfs/dbraw/zinc/37/25/05/684372505.db2.gz GVYYFUCJRCWUQB-WBMJQRKESA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@@H](Nc1nccc2c1cccc2[N+](=O)[O-])[C@@H]1CN(C)CC[N@H+]1C ZINC000895245610 684372517 /nfs/dbraw/zinc/37/25/17/684372517.db2.gz GVYYFUCJRCWUQB-WBMJQRKESA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1ccc([N+](=O)[O-])c2cccnc12)[C@H]1C[N@@H+](C)CCN1C ZINC000895249728 684376836 /nfs/dbraw/zinc/37/68/36/684376836.db2.gz XBWUQAOZCWXERS-BLLLJJGKSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1ccc([N+](=O)[O-])c2cccnc12)[C@H]1CN(C)CC[N@@H+]1C ZINC000895249728 684376844 /nfs/dbraw/zinc/37/68/44/684376844.db2.gz XBWUQAOZCWXERS-BLLLJJGKSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1ccc([N+](=O)[O-])c2cccnc12)[C@H]1CN(C)CC[N@H+]1C ZINC000895249728 684376848 /nfs/dbraw/zinc/37/68/48/684376848.db2.gz XBWUQAOZCWXERS-BLLLJJGKSA-N 1 1 329.404 2.189 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC3(CC2)OCCO3)cccc1[N+](=O)[O-] ZINC000026936596 686320956 /nfs/dbraw/zinc/32/09/56/686320956.db2.gz WBWYQTWTFAILTF-CYBMUJFWSA-N 1 1 349.387 2.069 20 5 EEBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000897287625 686583908 /nfs/dbraw/zinc/58/39/08/686583908.db2.gz DPRYEJWJEKJIQZ-NWDGAFQWSA-N 1 1 342.399 2.495 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000897287625 686583913 /nfs/dbraw/zinc/58/39/13/686583913.db2.gz DPRYEJWJEKJIQZ-NWDGAFQWSA-N 1 1 342.399 2.495 20 5 EEBDMO CCOC(=O)N1CC[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1 ZINC000865682113 1198329575 /nfs/dbraw/zinc/32/95/75/1198329575.db2.gz HRLQEGFKURQZRI-LLVKDONJSA-N 1 1 330.344 2.208 20 5 EEBDMO C[N@@H+](C[C@@H](O)Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000814649070 1199643035 /nfs/dbraw/zinc/64/30/35/1199643035.db2.gz IUSGUHYCRGLOSS-ZWKOTPCHSA-N 1 1 330.384 2.164 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@@H](N2CCNC2=O)C1 ZINC000876624649 1199696438 /nfs/dbraw/zinc/69/64/38/1199696438.db2.gz JFDGDHFSSDKXQL-CQSZACIVSA-N 1 1 332.404 2.201 20 5 EEBDMO CC(C)CCCCCC(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C ZINC001134786247 1199812040 /nfs/dbraw/zinc/81/20/40/1199812040.db2.gz YSBFHOFFXYTUJK-UHFFFAOYSA-N 1 1 339.440 2.141 20 5 EEBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CC[C@@]3(CCOC3)C2)o1 ZINC000878185259 1200308114 /nfs/dbraw/zinc/30/81/14/1200308114.db2.gz HWMHWFYZGKAWLH-MRXNPFEDSA-N 1 1 330.344 2.257 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878650161 1200598092 /nfs/dbraw/zinc/59/80/92/1200598092.db2.gz PQAMCLXHGBBHCA-HNNXBMFYSA-N 1 1 345.403 2.417 20 5 EEBDMO CCOC(=O)Cc1ccc(N2CC[C@@]3(CC[N@@H+](C)C3)C2)c([N+](=O)[O-])c1 ZINC000826105280 1201034951 /nfs/dbraw/zinc/03/49/51/1201034951.db2.gz ULXCKVDCAGZQDQ-GOSISDBHSA-N 1 1 347.415 2.232 20 5 EEBDMO O=C([C@H](O)c1cccc([N+](=O)[O-])c1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000826112702 1201145216 /nfs/dbraw/zinc/14/52/16/1201145216.db2.gz KAWSMZVHINWPTF-QGZVFWFLSA-N 1 1 347.415 2.105 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])CC[C@H]21 ZINC000866707451 1201585784 /nfs/dbraw/zinc/58/57/84/1201585784.db2.gz ADOKWJVXDHPHIL-DZGCQCFKSA-N 1 1 335.379 2.219 20 5 EEBDMO C[C@@]([NH3+])(C(=O)N1CCC2(CC2(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000867982721 1201720395 /nfs/dbraw/zinc/72/03/95/1201720395.db2.gz VBFCAXLOFJVVEY-AWEZNQCLSA-N 1 1 339.342 2.417 20 5 EEBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000881960202 1201794791 /nfs/dbraw/zinc/79/47/91/1201794791.db2.gz IIUJSAYVMQTMKB-CQSZACIVSA-N 1 1 344.415 2.383 20 5 EEBDMO O=[N+]([O-])c1cnc(NC[C@@H]2CCC[N@@H+]2CCCO)c2ccccc21 ZINC000884518024 1202330258 /nfs/dbraw/zinc/33/02/58/1202330258.db2.gz CFVAOMSSKCPZJE-ZDUSSCGKSA-N 1 1 330.388 2.402 20 5 EEBDMO COc1ccc(NC(=O)NC[C@H]2CCCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000930767502 1206581230 /nfs/dbraw/zinc/58/12/30/1206581230.db2.gz AFJBLEMLYWUZMR-GFCCVEGCSA-N 1 1 336.392 2.457 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1C1OCCO1 ZINC000933904609 1207866717 /nfs/dbraw/zinc/86/67/17/1207866717.db2.gz ZCNKHPNWSYMBLZ-HNNXBMFYSA-N 1 1 349.387 2.069 20 5 EEBDMO CN(CCCNC(=O)C[N@@H+](C)C1CCC1)c1ccccc1[N+](=O)[O-] ZINC001095769787 1208501336 /nfs/dbraw/zinc/50/13/36/1208501336.db2.gz HXBYEZVRIHWBBF-UHFFFAOYSA-N 1 1 334.420 2.022 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)cc1 ZINC000796450891 1218209877 /nfs/dbraw/zinc/20/98/77/1218209877.db2.gz YGYVGAXJWCNGQZ-UONOGXRCSA-N 1 1 348.321 2.408 20 5 EEBDMO CNC(=O)CC[C@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796588625 1221450607 /nfs/dbraw/zinc/45/06/07/1221450607.db2.gz VEJNWLLRLQAMFN-ZBFHGGJFSA-N 1 1 335.404 2.009 20 5 EEBDMO CC[N@H+]1CC[C@H](CNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC000900305637 1234184566 /nfs/dbraw/zinc/18/45/66/1234184566.db2.gz KLIZNENPZPCMTN-SECBINFHSA-N 1 1 329.759 2.459 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)N(C)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001096110544 1234952048 /nfs/dbraw/zinc/95/20/48/1234952048.db2.gz GGYFQDKLTFNVGI-UHFFFAOYSA-N 1 1 348.447 2.362 20 5 EEBDMO CCOC(=O)[C@@H]1CC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000902424158 1237571560 /nfs/dbraw/zinc/57/15/60/1237571560.db2.gz ZBPGGCJCHBBBLT-CQSZACIVSA-N 1 1 344.371 2.301 20 5 EEBDMO CCOC(=O)[C@@H]1CC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000902424158 1237571568 /nfs/dbraw/zinc/57/15/68/1237571568.db2.gz ZBPGGCJCHBBBLT-CQSZACIVSA-N 1 1 344.371 2.301 20 5 EEBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CC(=O)N(C)C1=O ZINC000802656250 1237934321 /nfs/dbraw/zinc/93/43/21/1237934321.db2.gz MUUUSIRRKLWDPG-ZDUSSCGKSA-N 1 1 339.779 2.218 20 5 EEBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CC(=O)N(C)C1=O ZINC000802656250 1237934328 /nfs/dbraw/zinc/93/43/28/1237934328.db2.gz MUUUSIRRKLWDPG-ZDUSSCGKSA-N 1 1 339.779 2.218 20 5 EEBDMO CC(C)(F)C(=O)N1C[C@@H]2C[N@@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001048641051 1238165740 /nfs/dbraw/zinc/16/57/40/1238165740.db2.gz WHUAWBBAAJLZLZ-TXEJJXNPSA-N 1 1 341.408 2.295 20 5 EEBDMO CC(C)(F)C(=O)N1C[C@@H]2C[N@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001048641051 1238165743 /nfs/dbraw/zinc/16/57/43/1238165743.db2.gz WHUAWBBAAJLZLZ-TXEJJXNPSA-N 1 1 341.408 2.295 20 5 EEBDMO CC(C)(F)C(=O)N1C[C@@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@@H]2C1 ZINC001048640844 1238166353 /nfs/dbraw/zinc/16/63/53/1238166353.db2.gz NHBKFRAOQZIFIK-OKILXGFUSA-N 1 1 335.379 2.233 20 5 EEBDMO Cc1ccc(F)c(C[NH+]2CCC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001001400019 1242197381 /nfs/dbraw/zinc/19/73/81/1242197381.db2.gz PIHWACJBQXQZDN-NVXWUHKLSA-N 1 1 349.406 2.128 20 5 EEBDMO CCCN(CCNC(=O)Cn1cc[nH+]c1C)c1ccc([N+](=O)[O-])cc1 ZINC001101147040 1245449162 /nfs/dbraw/zinc/44/91/62/1245449162.db2.gz GKERAHKPOJNCGX-UHFFFAOYSA-N 1 1 345.403 2.133 20 5 EEBDMO COCC[N@H+]1[C@H](C)CN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000121479857 1284281891 /nfs/dbraw/zinc/28/18/91/1284281891.db2.gz UPRMXPKOFCDNDH-OKILXGFUSA-N 1 1 335.404 2.084 20 5 EEBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000121479857 1284281903 /nfs/dbraw/zinc/28/19/03/1284281903.db2.gz UPRMXPKOFCDNDH-OKILXGFUSA-N 1 1 335.404 2.084 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)C[N@H+](C)C(C)C)cc1F ZINC000867282494 1285251031 /nfs/dbraw/zinc/25/10/31/1285251031.db2.gz OKUZDEWBWJKLSN-LLVKDONJSA-N 1 1 347.412 2.049 20 5 EEBDMO CC[N@@H+](CC1CC1)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000112200260 1292753394 /nfs/dbraw/zinc/75/33/94/1292753394.db2.gz NFHSYKCDSGOINV-QGZVFWFLSA-N 1 1 346.387 2.051 20 5 EEBDMO C[C@@H]1CN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@@H+]1C ZINC000859623051 1294556210 /nfs/dbraw/zinc/55/62/10/1294556210.db2.gz JBOLMSSETJANRQ-SECBINFHSA-N 1 1 342.193 2.133 20 5 EEBDMO C[C@@H]1CN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000859623051 1294556223 /nfs/dbraw/zinc/55/62/23/1294556223.db2.gz JBOLMSSETJANRQ-SECBINFHSA-N 1 1 342.193 2.133 20 5 EEBDMO O=c1ccc2ncc(O[C@H]3C[NH2+]CC3(F)F)c3c4ccccc4n1c32 ZINC001218238140 1297611889 /nfs/dbraw/zinc/61/18/89/1297611889.db2.gz UUSCUAPDSLZKGB-AWEZNQCLSA-N 1 1 341.317 2.425 20 5 EEBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](OCc3cccc([N+](=O)[O-])c3)C[C@H]1[N@H+]2C ZINC001222770885 1299846204 /nfs/dbraw/zinc/84/62/04/1299846204.db2.gz OCDJSUPCPVTPDM-MWDXBVQZSA-N 1 1 334.372 2.278 20 5 EEBDMO COC(=O)c1ccc(CO[C@H]2CCc3[nH+]ccn3C2)c([N+](=O)[O-])c1 ZINC001223415010 1300123292 /nfs/dbraw/zinc/12/32/92/1300123292.db2.gz URIJUUQZSZHYFV-ZDUSSCGKSA-N 1 1 331.328 2.110 20 5 EEBDMO CC(C)[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1ccc([N+](=O)[O-])cc1C(N)=O)C2 ZINC001226167292 1301282238 /nfs/dbraw/zinc/28/22/38/1301282238.db2.gz HGJXFQJFWSPWMT-IMRBUKKESA-N 1 1 333.388 2.476 20 5 EEBDMO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1[nH]c(=O)nc3ccc([N+](=O)[O-])cc31)C2 ZINC001227091743 1301682514 /nfs/dbraw/zinc/68/25/14/1301682514.db2.gz MNDPTFYSNCJSMQ-IAZYJMLFSA-N 1 1 330.344 2.248 20 5 EEBDMO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](Oc1[nH]c(=O)nc3cc([N+](=O)[O-])ccc31)C2 ZINC001228239876 1302170707 /nfs/dbraw/zinc/17/07/07/1302170707.db2.gz CIMQEIYUCNQYDF-PEGIJTEDSA-N 1 1 330.344 2.248 20 5 EEBDMO O=c1oc2ccccc2c(O[C@@H]2CCc3[nH+]ccn3C2)c1[N+](=O)[O-] ZINC001228805124 1302456988 /nfs/dbraw/zinc/45/69/88/1302456988.db2.gz IRENMWBMYREPEA-SNVBAGLBSA-N 1 1 327.296 2.292 20 5 EEBDMO O=C1[C@@H]2CCCCC[C@@H]2N1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000782859839 1304136425 /nfs/dbraw/zinc/13/64/25/1304136425.db2.gz KNWAAGLKRNJETE-CABCVRRESA-N 1 1 347.419 2.177 20 5 EEBDMO Cc1ncncc1C(=O)NCCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001234421888 1304916601 /nfs/dbraw/zinc/91/66/01/1304916601.db2.gz GTTIBXDTKIZXPS-UHFFFAOYSA-N 1 1 349.416 2.007 20 5 EEBDMO Cc1ncncc1C(=O)NCCC[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001234421888 1304916603 /nfs/dbraw/zinc/91/66/03/1304916603.db2.gz GTTIBXDTKIZXPS-UHFFFAOYSA-N 1 1 349.416 2.007 20 5 EEBDMO C[C@H]1[C@H](CO)CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000839676221 1315230671 /nfs/dbraw/zinc/23/06/71/1315230671.db2.gz WJBDUEVJVMMCPO-RYUDHWBXSA-N 1 1 339.367 2.155 20 5 EEBDMO C[C@@H]1CC2(C[N@@H+]1Cn1c(=O)oc3cccc([N+](=O)[O-])c31)CCOCC2 ZINC000842637744 1315740962 /nfs/dbraw/zinc/74/09/62/1315740962.db2.gz DRPAWRFWRKJPPN-GFCCVEGCSA-N 1 1 347.371 2.351 20 5 EEBDMO C[C@@H]1CC2(C[N@H+]1Cn1c(=O)oc3cccc([N+](=O)[O-])c31)CCOCC2 ZINC000842637744 1315740965 /nfs/dbraw/zinc/74/09/65/1315740965.db2.gz DRPAWRFWRKJPPN-GFCCVEGCSA-N 1 1 347.371 2.351 20 5 EEBDMO CCOC(=O)C1=C(O)CC[N@@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254563590 1318122701 /nfs/dbraw/zinc/12/27/01/1318122701.db2.gz ZBNPVIGAPBLGRY-UKRRQHHQSA-N 1 1 348.399 2.370 20 5 EEBDMO CCOC(=O)C1=C(O)CC[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254563590 1318122712 /nfs/dbraw/zinc/12/27/12/1318122712.db2.gz ZBNPVIGAPBLGRY-UKRRQHHQSA-N 1 1 348.399 2.370 20 5 EEBDMO O=C(NCCC1(C[NH2+]C/C=C\c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164491057 1321395075 /nfs/dbraw/zinc/39/50/75/1321395075.db2.gz YSYYHJJUPUZYMR-GGVHLCNSSA-N 1 1 343.427 2.241 20 5 EEBDMO CC(C)(C)CCC[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001164494749 1321396041 /nfs/dbraw/zinc/39/60/41/1321396041.db2.gz QGJCKOPZNINUBP-ZIAGYGMSSA-N 1 1 325.453 2.354 20 5 EEBDMO 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CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C1 ZINC000269457942 463991510 /nfs/dbraw/zinc/99/15/10/463991510.db2.gz HFZYQRMXJKQTQB-LBPRGKRZSA-N 1 1 337.424 2.245 20 5 EEBDMO CN(CC[N@@H+](C)C1CC1)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000186715526 464056628 /nfs/dbraw/zinc/05/66/28/464056628.db2.gz SSEPJAMPDWKAJN-UHFFFAOYSA-N 1 1 334.420 2.340 20 5 EEBDMO COC(=O)C[C@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000179148893 464068800 /nfs/dbraw/zinc/06/88/00/464068800.db2.gz JPZLIIJJCAPJQG-CYBMUJFWSA-N 1 1 349.387 2.259 20 5 EEBDMO CC1(C)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1O ZINC000279692415 464128079 /nfs/dbraw/zinc/12/80/79/464128079.db2.gz GEUZFPIZYTXDSR-OAHLLOKOSA-N 1 1 331.372 2.495 20 5 EEBDMO C[C@@]1(O)CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000279974059 464176498 /nfs/dbraw/zinc/17/64/98/464176498.db2.gz HTILFBRAWKJLFN-OAHLLOKOSA-N 1 1 341.795 2.424 20 5 EEBDMO C[C@@]1(O)CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000279974059 464176502 /nfs/dbraw/zinc/17/65/02/464176502.db2.gz HTILFBRAWKJLFN-OAHLLOKOSA-N 1 1 341.795 2.424 20 5 EEBDMO C[C@@H]1C[N@H+](CC2CCN(c3ncccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000263768473 464183318 /nfs/dbraw/zinc/18/33/18/464183318.db2.gz RXNRJJYXUUHNMT-OKILXGFUSA-N 1 1 334.420 2.315 20 5 EEBDMO CCC(CC)NC(=O)[C@@H](C)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173466246 464266217 /nfs/dbraw/zinc/26/62/17/464266217.db2.gz GSLXLYUBNHIKNO-OCCSQVGLSA-N 1 1 349.435 2.169 20 5 EEBDMO CCC(CC)NC(=O)[C@@H](C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173466246 464266222 /nfs/dbraw/zinc/26/62/22/464266222.db2.gz GSLXLYUBNHIKNO-OCCSQVGLSA-N 1 1 349.435 2.169 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC[N@H+]1CCCOCC1 ZINC000188411791 464273552 /nfs/dbraw/zinc/27/35/52/464273552.db2.gz XGJBJODMJILJEW-UHFFFAOYSA-N 1 1 336.392 2.055 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000281201462 464368751 /nfs/dbraw/zinc/36/87/51/464368751.db2.gz PJEZGPNMMSJWLK-CYBMUJFWSA-N 1 1 341.433 2.008 20 5 EEBDMO O=C(NCCC[NH+]1CCCCC1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000298680561 465470108 /nfs/dbraw/zinc/47/01/08/465470108.db2.gz JSHBYOCJCJZNQZ-UHFFFAOYSA-N 1 1 331.376 2.077 20 5 EEBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000343054819 465473098 /nfs/dbraw/zinc/47/30/98/465473098.db2.gz PYTPODLEHUZWPM-AWEZNQCLSA-N 1 1 345.403 2.776 20 5 EEBDMO COc1cc(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)cc([N+](=O)[O-])c1C ZINC000189186502 464452439 /nfs/dbraw/zinc/45/24/39/464452439.db2.gz PUPHCVRGPZMTID-MFKMUULPSA-N 1 1 333.388 2.267 20 5 EEBDMO C[NH+](C)[C@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000298701975 465476197 /nfs/dbraw/zinc/47/61/97/465476197.db2.gz SHPIFSGMSUSEKC-CYBMUJFWSA-N 1 1 343.343 2.097 20 5 EEBDMO CCOCCCNC(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285408920 464553697 /nfs/dbraw/zinc/55/36/97/464553697.db2.gz UREHYAORUMXCBH-AWEZNQCLSA-N 1 1 337.420 2.000 20 5 EEBDMO CCOCCCNC(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285408920 464553701 /nfs/dbraw/zinc/55/37/01/464553701.db2.gz UREHYAORUMXCBH-AWEZNQCLSA-N 1 1 337.420 2.000 20 5 EEBDMO COCc1cc([N+](=O)[O-])ccc1NCCN1CC[N@@H+](C)C(C)(C)C1 ZINC000281738170 464565923 /nfs/dbraw/zinc/56/59/23/464565923.db2.gz WURYKMYVHVIHTI-UHFFFAOYSA-N 1 1 336.436 2.179 20 5 EEBDMO O=[N+]([O-])c1cccnc1N[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1CO ZINC000265806731 464693193 /nfs/dbraw/zinc/69/31/93/464693193.db2.gz SAAUZNRCWNWBKA-HOTGVXAUSA-N 1 1 342.399 2.285 20 5 EEBDMO COC[C@]1(C(=O)OC)CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000295142949 464721439 /nfs/dbraw/zinc/72/14/39/464721439.db2.gz ZWEKZXMIWDTQKT-UABRLCRWSA-N 1 1 334.372 2.120 20 5 EEBDMO COc1cccc(C(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000248842192 464808497 /nfs/dbraw/zinc/80/84/97/464808497.db2.gz GIEWZFCDTRYDME-QWHCGFSZSA-N 1 1 335.404 2.454 20 5 EEBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000276230623 464856063 /nfs/dbraw/zinc/85/60/63/464856063.db2.gz KKULNUJODCQWOQ-NSHDSACASA-N 1 1 333.310 2.419 20 5 EEBDMO C[C@@H]1CN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000295538793 464874461 /nfs/dbraw/zinc/87/44/61/464874461.db2.gz KJQBQHFNJPNVLI-AWEZNQCLSA-N 1 1 347.415 2.306 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000177178106 464950339 /nfs/dbraw/zinc/95/03/39/464950339.db2.gz GGUUFIAQVLUBEQ-RYUDHWBXSA-N 1 1 335.429 2.428 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCC[C@H]1O ZINC000286678168 465001982 /nfs/dbraw/zinc/00/19/82/465001982.db2.gz VJLQVAOUOHUKHZ-DGCLKSJQSA-N 1 1 327.768 2.032 20 5 EEBDMO C[C@@H]1[C@H](NC(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC000359816068 465492717 /nfs/dbraw/zinc/49/27/17/465492717.db2.gz VWFBFEGHGKKTPX-UKRRQHHQSA-N 1 1 342.399 2.326 20 5 EEBDMO C[C@H](CNC(=O)COc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)C1 ZINC000298947395 465548767 /nfs/dbraw/zinc/54/87/67/465548767.db2.gz FACFYOLSXANICJ-ZIAGYGMSSA-N 1 1 335.404 2.210 20 5 EEBDMO C[C@@H]1C[N@@H+](C[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000299190923 465643842 /nfs/dbraw/zinc/64/38/42/465643842.db2.gz HDNBFYIDXUUPBJ-JKIFEVAISA-N 1 1 347.415 2.309 20 5 EEBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000299190923 465643850 /nfs/dbraw/zinc/64/38/50/465643850.db2.gz HDNBFYIDXUUPBJ-JKIFEVAISA-N 1 1 347.415 2.309 20 5 EEBDMO Cc1cccc(C[N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)n1 ZINC000348583709 465701332 /nfs/dbraw/zinc/70/13/32/465701332.db2.gz YXRPKSZLVJPYQT-INIZCTEOSA-N 1 1 331.372 2.170 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000340141032 465805985 /nfs/dbraw/zinc/80/59/85/465805985.db2.gz HPFOXQDOSOUBOA-HUUCEWRRSA-N 1 1 332.404 2.063 20 5 EEBDMO O=C(C[N@H+]1CCC[C@@H]1C1CCOCC1)Nc1ccccc1[N+](=O)[O-] ZINC000348929481 465878388 /nfs/dbraw/zinc/87/83/88/465878388.db2.gz UXTXVGKTEOJVJK-OAHLLOKOSA-N 1 1 333.388 2.424 20 5 EEBDMO CC(C)[C@H](O)CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353515858 465946443 /nfs/dbraw/zinc/94/64/43/465946443.db2.gz FYIRZMVVVZOKMH-CVEARBPZSA-N 1 1 332.404 2.414 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+](C)[C@H]1CCCN(c2ccccc2)C1 ZINC000361388172 465954231 /nfs/dbraw/zinc/95/42/31/465954231.db2.gz CJUBDVMMBMWWBX-HNNXBMFYSA-N 1 1 329.404 2.429 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+](C)[C@H]1CCCN(c2ccccc2)C1 ZINC000361388172 465954241 /nfs/dbraw/zinc/95/42/41/465954241.db2.gz CJUBDVMMBMWWBX-HNNXBMFYSA-N 1 1 329.404 2.429 20 5 EEBDMO C[C@H]1C[C@@H]1[N@@H+]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000346239175 466018711 /nfs/dbraw/zinc/01/87/11/466018711.db2.gz OXWUVMUQCDIYAD-MKBNYLNASA-N 1 1 333.388 2.103 20 5 EEBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000346239175 466018717 /nfs/dbraw/zinc/01/87/17/466018717.db2.gz OXWUVMUQCDIYAD-MKBNYLNASA-N 1 1 333.388 2.103 20 5 EEBDMO C[N@H+]1CCO[C@@H]2CN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)C[C@H]21 ZINC000301902479 466057808 /nfs/dbraw/zinc/05/78/08/466057808.db2.gz ODILAEYPWBLVJR-GDBMZVCRSA-N 1 1 335.404 2.291 20 5 EEBDMO Cc1c(C(=O)N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000371994927 466108689 /nfs/dbraw/zinc/10/86/89/466108689.db2.gz LZTIBJAERUAPJB-WBVHZDCISA-N 1 1 347.415 2.276 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CCC[C@H]([NH+]3CCCC3)C2)c1[N+](=O)[O-] ZINC000331774291 466240244 /nfs/dbraw/zinc/24/02/44/466240244.db2.gz GGXGEYTZYWETBJ-LBPRGKRZSA-N 1 1 335.408 2.142 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CN(C)c2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000361887584 466380179 /nfs/dbraw/zinc/38/01/79/466380179.db2.gz FQKVPRIAPITZAK-CABCVRRESA-N 1 1 348.447 2.362 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000555878972 468499894 /nfs/dbraw/zinc/49/98/94/468499894.db2.gz SMDQAJZNNHTSAY-CYBMUJFWSA-N 1 1 331.376 2.171 20 5 EEBDMO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CS(=O)(=O)c3ccccc32)cc1 ZINC000320782315 466613997 /nfs/dbraw/zinc/61/39/97/466613997.db2.gz JIPGUDNMAWJGMY-OAHLLOKOSA-N 1 1 332.381 2.256 20 5 EEBDMO O=C([C@@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1)N1CCCC1 ZINC000347447317 466636295 /nfs/dbraw/zinc/63/62/95/466636295.db2.gz IJPCDPUZZUWWEM-LLVKDONJSA-N 1 1 339.342 2.317 20 5 EEBDMO O=C([C@@H]1CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1)N1CCCC1 ZINC000347447317 466636300 /nfs/dbraw/zinc/63/63/00/466636300.db2.gz IJPCDPUZZUWWEM-LLVKDONJSA-N 1 1 339.342 2.317 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])C[C@H]1C ZINC000410636728 466720429 /nfs/dbraw/zinc/72/04/29/466720429.db2.gz NGATVSHBOLVQEB-GHMZBOCLSA-N 1 1 339.367 2.297 20 5 EEBDMO Cc1c(CC(=O)N2CC[NH2+]C[C@@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000423939181 466920660 /nfs/dbraw/zinc/92/06/60/466920660.db2.gz AEVGGSGSGMNSKZ-QGZVFWFLSA-N 1 1 340.383 2.014 20 5 EEBDMO NC(=O)c1ccc(C[N@@H+]2C[C@@H](O)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000411944317 466942881 /nfs/dbraw/zinc/94/28/81/466942881.db2.gz NFHPFKFVRWCPNH-JKSUJKDBSA-N 1 1 341.367 2.002 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2C[C@@H](O)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000411944317 466942885 /nfs/dbraw/zinc/94/28/85/466942885.db2.gz NFHPFKFVRWCPNH-JKSUJKDBSA-N 1 1 341.367 2.002 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(c2[nH+]ccn2C)CC1 ZINC000373882119 466953813 /nfs/dbraw/zinc/95/38/13/466953813.db2.gz OEEXJPAMTHAABT-UHFFFAOYSA-N 1 1 343.387 2.036 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC2(CCC[N@H+]2C)CC1 ZINC000370651378 466954230 /nfs/dbraw/zinc/95/42/30/466954230.db2.gz PYXOALKYJCDBDJ-AWEZNQCLSA-N 1 1 346.431 2.482 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](CO)[C@H]1C ZINC000412063471 466990152 /nfs/dbraw/zinc/99/01/52/466990152.db2.gz BCLCUMJFZJZLDK-KGLIPLIRSA-N 1 1 335.404 2.325 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000377684787 467115724 /nfs/dbraw/zinc/11/57/24/467115724.db2.gz XXUMKZYGXAGTIW-QGZVFWFLSA-N 1 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CC(C)c1n[nH]c(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1[N+](=O)[O-] ZINC000434029636 467372634 /nfs/dbraw/zinc/37/26/34/467372634.db2.gz DCNSGMSTTRGKDT-CYBMUJFWSA-N 1 1 349.435 2.245 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@H](C[N@H+](C)CC3CC3)C2)c1[N+](=O)[O-] ZINC000434029636 467372638 /nfs/dbraw/zinc/37/26/38/467372638.db2.gz DCNSGMSTTRGKDT-CYBMUJFWSA-N 1 1 349.435 2.245 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1[N+](=O)[O-] ZINC000434029636 467372642 /nfs/dbraw/zinc/37/26/42/467372642.db2.gz DCNSGMSTTRGKDT-CYBMUJFWSA-N 1 1 349.435 2.245 20 5 EEBDMO CC/C=C\CC[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000420971421 467523152 /nfs/dbraw/zinc/52/31/52/467523152.db2.gz ICGADPVZTJJCQX-PLNGDYQASA-N 1 1 341.433 2.161 20 5 EEBDMO C[N@@H+](CCNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C1CC1 ZINC000437973228 467558913 /nfs/dbraw/zinc/55/89/13/467558913.db2.gz GDFWEKDFFUKZJD-UHFFFAOYSA-N 1 1 332.404 2.363 20 5 EEBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000450348934 467832709 /nfs/dbraw/zinc/83/27/09/467832709.db2.gz MJXZFNVPORJGTG-QWHCGFSZSA-N 1 1 333.388 2.109 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000450348934 467832711 /nfs/dbraw/zinc/83/27/11/467832711.db2.gz MJXZFNVPORJGTG-QWHCGFSZSA-N 1 1 333.388 2.109 20 5 EEBDMO C[C@@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO ZINC000450793826 467908866 /nfs/dbraw/zinc/90/88/66/467908866.db2.gz MJYZDCHXADNWPS-BETUJISGSA-N 1 1 330.388 2.034 20 5 EEBDMO COc1cc(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c(F)cc1[N+](=O)[O-] ZINC000450792478 467909059 /nfs/dbraw/zinc/90/90/59/467909059.db2.gz NRRKPVFCOGXEAL-PHIMTYICSA-N 1 1 325.340 2.018 20 5 EEBDMO CCCC[N@@H+](C)CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000493953723 468009432 /nfs/dbraw/zinc/00/94/32/468009432.db2.gz WJZIVHQDXVSXTK-UHFFFAOYSA-N 1 1 343.449 2.222 20 5 EEBDMO C[N@H+](Cc1ccccc1)C[C@H](O)CNCc1cccc([N+](=O)[O-])c1 ZINC000591729125 468512230 /nfs/dbraw/zinc/51/22/30/468512230.db2.gz 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C[C@H](CO)C1CC[NH+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000593084456 468864554 /nfs/dbraw/zinc/86/45/54/468864554.db2.gz PKLIZWPTGALQPX-OLZOCXBDSA-N 1 1 335.404 2.262 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC000595504193 468879848 /nfs/dbraw/zinc/87/98/48/468879848.db2.gz FYKMOGKAEUFTSQ-KBXCAEBGSA-N 1 1 346.431 2.340 20 5 EEBDMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C(C)(C)CN1CCOCC1 ZINC000595540614 468893756 /nfs/dbraw/zinc/89/37/56/468893756.db2.gz IHTXJCOTBVEJGH-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598562084 468914296 /nfs/dbraw/zinc/91/42/96/468914296.db2.gz SSHRHGVCYBDZQN-INIZCTEOSA-N 1 1 331.416 2.376 20 5 EEBDMO COc1ccc(C(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000598562114 468914419 /nfs/dbraw/zinc/91/44/19/468914419.db2.gz UGTMHHJAMNLALY-AWEZNQCLSA-N 1 1 347.415 2.455 20 5 EEBDMO C[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1CO ZINC000598675992 468955267 /nfs/dbraw/zinc/95/52/67/468955267.db2.gz CBIMVFPHHSHXFC-XJKSGUPXSA-N 1 1 344.415 2.446 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000595784849 469009489 /nfs/dbraw/zinc/00/94/89/469009489.db2.gz BXXRTSBYHSTRGP-ZBFHGGJFSA-N 1 1 335.404 2.038 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000585718722 469020832 /nfs/dbraw/zinc/02/08/32/469020832.db2.gz UZWKWMQGBPVINF-MRXNPFEDSA-N 1 1 349.431 2.290 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000585718722 469020835 /nfs/dbraw/zinc/02/08/35/469020835.db2.gz UZWKWMQGBPVINF-MRXNPFEDSA-N 1 1 349.431 2.290 20 5 EEBDMO C[N@H+](CC1=CCSC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000595887963 469064953 /nfs/dbraw/zinc/06/49/53/469064953.db2.gz JMAOIVQUVODSNF-HNNXBMFYSA-N 1 1 333.413 2.305 20 5 EEBDMO C[N@@H+](CC1=CCSC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000595887963 469064957 /nfs/dbraw/zinc/06/49/57/469064957.db2.gz 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Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](CCO)C1 ZINC000609849089 469965608 /nfs/dbraw/zinc/96/56/08/469965608.db2.gz YWYAFLFGJLWEBS-AWEZNQCLSA-N 1 1 335.404 2.326 20 5 EEBDMO C[C@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccccn1 ZINC000181772920 533818018 /nfs/dbraw/zinc/81/80/18/533818018.db2.gz ZMPSVIYLVNBPOP-LBPRGKRZSA-N 1 1 326.356 2.230 20 5 EEBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)c2cc(F)c([N+](=O)[O-])cc2F)C[C@@H]1C ZINC000765927224 577509151 /nfs/dbraw/zinc/50/91/51/577509151.db2.gz FUNUKVXHQFASRW-VHSXEESVSA-N 1 1 327.331 2.428 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc(F)c([N+](=O)[O-])cc2F)C[C@@H]1C ZINC000765927224 577509152 /nfs/dbraw/zinc/50/91/52/577509152.db2.gz FUNUKVXHQFASRW-VHSXEESVSA-N 1 1 327.331 2.428 20 5 EEBDMO COc1cc(CN2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000761074514 577675639 /nfs/dbraw/zinc/67/56/39/577675639.db2.gz BYUDUAHFLKJSRU-SNVBAGLBSA-N 1 1 345.346 2.341 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000749146892 577971716 /nfs/dbraw/zinc/97/17/16/577971716.db2.gz RYIXBPQRFOJPDO-ZDUSSCGKSA-N 1 1 346.431 2.265 20 5 EEBDMO COc1c(O)ccc(C[N@@H+]2CCC[C@@H](n3ccnc3)C2)c1[N+](=O)[O-] ZINC000891904273 676897503 /nfs/dbraw/zinc/89/75/03/676897503.db2.gz GYPGRKSCUWRCOJ-CYBMUJFWSA-N 1 1 332.360 2.343 20 5 EEBDMO COc1c(O)ccc(C[N@H+]2CCC[C@@H](n3ccnc3)C2)c1[N+](=O)[O-] ZINC000891904273 676897504 /nfs/dbraw/zinc/89/75/04/676897504.db2.gz GYPGRKSCUWRCOJ-CYBMUJFWSA-N 1 1 332.360 2.343 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)ccc1CN[C@@H]1CCC[N@@H+](CCCO)C1 ZINC000894674054 683023656 /nfs/dbraw/zinc/02/36/56/683023656.db2.gz SHUPOOJPEZINSC-CQSZACIVSA-N 1 1 327.812 2.185 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)ccc1CN[C@@H]1CCC[N@H+](CCCO)C1 ZINC000894674054 683023659 /nfs/dbraw/zinc/02/36/59/683023659.db2.gz SHUPOOJPEZINSC-CQSZACIVSA-N 1 1 327.812 2.185 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[C@H]([C@H]2CCC[N@@H+](CC[N+](=O)[O-])C2)C1 ZINC000930655126 684328214 /nfs/dbraw/zinc/32/82/14/684328214.db2.gz NTBUSZVTTKFNHT-KBPBESRZSA-N 1 1 327.425 2.232 20 5 EEBDMO C[C@H](Nc1ncc([N+](=O)[O-])c2ccccc21)[C@@H]1C[N@@H+](C)CCN1C ZINC000895247919 684384320 /nfs/dbraw/zinc/38/43/20/684384320.db2.gz KERLVWXXPVJWGR-LRDDRELGSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1ncc([N+](=O)[O-])c2ccccc21)[C@@H]1CN(C)CC[N@@H+]1C ZINC000895247919 684384322 /nfs/dbraw/zinc/38/43/22/684384322.db2.gz KERLVWXXPVJWGR-LRDDRELGSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1ncc([N+](=O)[O-])c2ccccc21)[C@@H]1CN(C)CC[N@H+]1C ZINC000895247919 684384326 /nfs/dbraw/zinc/38/43/26/684384326.db2.gz KERLVWXXPVJWGR-LRDDRELGSA-N 1 1 329.404 2.189 20 5 EEBDMO CSCC(=O)N1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000985244485 686128104 /nfs/dbraw/zinc/12/81/04/686128104.db2.gz BACRBCADNGWSGB-UHFFFAOYSA-N 1 1 337.445 2.381 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+]([C@H]3CCOC3)CC2)c(C(F)F)c1 ZINC000865624843 1198303069 /nfs/dbraw/zinc/30/30/69/1198303069.db2.gz RDFUTHIQZMPZSR-LBPRGKRZSA-N 1 1 327.331 2.443 20 5 EEBDMO CCOC(=O)Cc1ccc(N2CC[N@@H+](CC)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000825873211 1199611487 /nfs/dbraw/zinc/61/14/87/1199611487.db2.gz SLINKRAJDTYLJM-ZDUSSCGKSA-N 1 1 335.404 2.231 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@@H](n2cc(CO)nn2)C1 ZINC000877551460 1199964047 /nfs/dbraw/zinc/96/40/47/1199964047.db2.gz AGVLLXVFLABVKN-OAHLLOKOSA-N 1 1 345.403 2.133 20 5 EEBDMO CC(C)(O)C1CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000877753732 1200076606 /nfs/dbraw/zinc/07/66/06/1200076606.db2.gz LRCDMTWPYUQNAS-UHFFFAOYSA-N 1 1 336.388 2.444 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H](C)C[N@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000811600011 1200165047 /nfs/dbraw/zinc/16/50/47/1200165047.db2.gz BCTGOPOBTRHWHA-JTQLQIEISA-N 1 1 338.364 2.270 20 5 EEBDMO Cc1c(CO)cc([N+](=O)[O-])c(N[C@@H](C)C[N@H+](C)C(C)C)c1[N+](=O)[O-] ZINC000811848637 1200376731 /nfs/dbraw/zinc/37/67/31/1200376731.db2.gz MZJQJGLWFCRIPH-JTQLQIEISA-N 1 1 340.380 2.444 20 5 EEBDMO CC[N@H+]1CCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1C ZINC000878298602 1200383776 /nfs/dbraw/zinc/38/37/76/1200383776.db2.gz JTLNTXHAACHKKO-GFCCVEGCSA-N 1 1 331.376 2.171 20 5 EEBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1[C@H]2CCCO[C@H]21 ZINC000813174360 1201142702 /nfs/dbraw/zinc/14/27/02/1201142702.db2.gz YSLGRPWXRCXARZ-YLFCFFPRSA-N 1 1 346.383 2.137 20 5 EEBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1[C@H]2CCCO[C@H]21 ZINC000813174360 1201142705 /nfs/dbraw/zinc/14/27/05/1201142705.db2.gz YSLGRPWXRCXARZ-YLFCFFPRSA-N 1 1 346.383 2.137 20 5 EEBDMO CN(CCC[NH+]1CCOCC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000193466167 1210847385 /nfs/dbraw/zinc/84/73/85/1210847385.db2.gz IICMYDRUKDWKNP-UHFFFAOYSA-N 1 1 327.812 2.402 20 5 EEBDMO C[N@H+](CCCN1CCOCC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000193466167 1210847388 /nfs/dbraw/zinc/84/73/88/1210847388.db2.gz IICMYDRUKDWKNP-UHFFFAOYSA-N 1 1 327.812 2.402 20 5 EEBDMO C[N@@H+](CCCN1CCOCC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000193466167 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UDHRFJRPXQRPSW-OKILXGFUSA-N 1 1 335.429 2.347 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)N[C@H]1C[C@H](Nc2cccc(F)c2[N+](=O)[O-])C1 ZINC001097037236 1243603243 /nfs/dbraw/zinc/60/32/43/1243603243.db2.gz JWRUTNSUEHAKPX-HAQNSBGRSA-N 1 1 338.383 2.133 20 5 EEBDMO O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000102886028 1284594428 /nfs/dbraw/zinc/59/44/28/1284594428.db2.gz NXOCOISYJYOZMZ-HNNXBMFYSA-N 1 1 329.356 2.413 20 5 EEBDMO O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[N@H+]1CCC[C@H]1C1CCC1 ZINC000102886028 1284594433 /nfs/dbraw/zinc/59/44/33/1284594433.db2.gz NXOCOISYJYOZMZ-HNNXBMFYSA-N 1 1 329.356 2.413 20 5 EEBDMO O=c1cc(O[C@@H]2CC[NH2+]CC2(F)F)c2cc([N+](=O)[O-])ccc2[nH]1 ZINC001218005378 1297545703 /nfs/dbraw/zinc/54/57/03/1297545703.db2.gz FIMSUPBDURPGLX-GFCCVEGCSA-N 1 1 325.271 2.225 20 5 EEBDMO Cc1ccc(C[N@H+]2CCC3(CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C3)C2)cc1C ZINC001072724830 1296055111 /nfs/dbraw/zinc/05/51/11/1296055111.db2.gz GCCIXXAXBVQASD-IAGOWNOFSA-N 1 1 343.427 2.003 20 5 EEBDMO Cc1ccc(C[N@@H+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1C ZINC001072724830 1296055123 /nfs/dbraw/zinc/05/51/23/1296055123.db2.gz GCCIXXAXBVQASD-IAGOWNOFSA-N 1 1 343.427 2.003 20 5 EEBDMO Cc1ccc(C[N@H+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1C ZINC001072724830 1296055132 /nfs/dbraw/zinc/05/51/32/1296055132.db2.gz GCCIXXAXBVQASD-IAGOWNOFSA-N 1 1 343.427 2.003 20 5 EEBDMO CCCN(CCNC(=O)Cn1c[nH+]cc1C)c1ccc([N+](=O)[O-])cc1 ZINC001101205752 1299665750 /nfs/dbraw/zinc/66/57/50/1299665750.db2.gz DKSUPPQMTBKEAG-UHFFFAOYSA-N 1 1 345.403 2.133 20 5 EEBDMO COC(=O)c1cc(OC)c(O[C@H]2CCC[N@@H+](C)CC2)c([N+](=O)[O-])c1 ZINC001226362527 1301377851 /nfs/dbraw/zinc/37/78/51/1301377851.db2.gz UZXNHRRFZVYOEJ-LBPRGKRZSA-N 1 1 338.360 2.253 20 5 EEBDMO CC[N@H+](C)CCC(=O)NC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001229896163 1302980019 /nfs/dbraw/zinc/98/00/19/1302980019.db2.gz WDXPMZPVXUDTLS-UHFFFAOYSA-N 1 1 348.447 2.017 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001229896163 1302980022 /nfs/dbraw/zinc/98/00/22/1302980022.db2.gz WDXPMZPVXUDTLS-UHFFFAOYSA-N 1 1 348.447 2.017 20 5 EEBDMO O=C(NCC1([NH2+]Cc2ccc(F)cc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530634 1305285514 /nfs/dbraw/zinc/28/55/14/1305285514.db2.gz IKHHETGIFUDBNW-HZPDHXFCSA-N 1 1 349.406 2.400 20 5 EEBDMO COc1ccccc1[C@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])[NH+]1CCCCC1 ZINC000839551035 1315214379 /nfs/dbraw/zinc/21/43/79/1315214379.db2.gz JNYGAHZUKZZMLR-OAGGEKHMSA-N 1 1 347.415 2.004 20 5 EEBDMO Cc1cc(C)n(CCNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)n1 ZINC001154786109 1317311312 /nfs/dbraw/zinc/31/13/12/1317311312.db2.gz IYVJOZYFSCRERY-FNORWQNLSA-N 1 1 330.392 2.448 20 5 EEBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001254556895 1318120367 /nfs/dbraw/zinc/12/03/67/1318120367.db2.gz NAQCLNGEBUPETM-JCGIZDLHSA-N 1 1 345.443 2.321 20 5 EEBDMO CCOC(=O)[C@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CCS1 ZINC001254612649 1318145695 /nfs/dbraw/zinc/14/56/95/1318145695.db2.gz XMXIOKKDFXITTF-HUUCEWRRSA-N 1 1 336.413 2.043 20 5 EEBDMO CSc1nc(Cl)nc(N2C[C@H]3CCC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-] ZINC001157264653 1318530816 /nfs/dbraw/zinc/53/08/16/1318530816.db2.gz FVLFNGLJIOVPNT-BDAKNGLRSA-N 1 1 343.840 2.291 20 5 EEBDMO C[C@H]1C[NH+](CCc2nnc(Cc3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC001258012327 1319127563 /nfs/dbraw/zinc/12/75/63/1319127563.db2.gz PUAFGMQBOPPNID-STQMWFEESA-N 1 1 346.387 2.220 20 5 EEBDMO CC[C@H]([NH2+]CCn1c(C)ncc1[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC001307927579 1331556906 /nfs/dbraw/zinc/55/69/06/1331556906.db2.gz JOBNWVYOOOYUOD-ZDUSSCGKSA-N 1 1 347.423 2.159 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(Cl)cc1S(=O)(=O)NCC[N@H+](C)C(C)C ZINC001309405089 1331628570 /nfs/dbraw/zinc/62/85/70/1331628570.db2.gz FZVXJFJWVSWPOU-UHFFFAOYSA-N 1 1 349.840 2.175 20 5 EEBDMO Cc1[nH+]ccn1CCCCNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001609457218 1351984719 /nfs/dbraw/zinc/98/47/19/1351984719.db2.gz FHCWDRGXEAQOKG-UHFFFAOYSA-N 1 1 342.363 2.172 20 5 EEBDMO CN1CC[N@@H+](C)C[C@@H]1CNc1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC001335843870 1336436141 /nfs/dbraw/zinc/43/61/41/1336436141.db2.gz SCZVULVFFVXZQR-NSHDSACASA-N 1 1 332.326 2.271 20 5 EEBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1C1CCCC1 ZINC001336712659 1336584510 /nfs/dbraw/zinc/58/45/10/1336584510.db2.gz MBOMXYNCZWZSHN-LBPRGKRZSA-N 1 1 332.404 2.147 20 5 EEBDMO C[C@@]([NH3+])(C(=O)N1CCc2c1cccc2F)c1cccc([N+](=O)[O-])c1 ZINC001576080152 1343963254 /nfs/dbraw/zinc/96/32/54/1343963254.db2.gz DJUBKSXHSPWHQX-KRWDZBQOSA-N 1 1 329.331 2.497 20 5 EEBDMO CC1(C)C[NH+](Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CC(C)(C)O1 ZINC001590104706 1349157229 /nfs/dbraw/zinc/15/72/29/1349157229.db2.gz SJRJDOMIFMVPHZ-UHFFFAOYSA-N 1 1 346.391 2.164 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] ZINC001590260755 1349238672 /nfs/dbraw/zinc/23/86/72/1349238672.db2.gz RVCAGJCTDYFNAB-NEPJUHHUSA-N 1 1 345.407 2.307 20 5 EEBDMO O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001593467792 1349803652 /nfs/dbraw/zinc/80/36/52/1349803652.db2.gz VKLXYIJKXPNOKW-BETUJISGSA-N 1 1 328.376 2.397 20 5 EEBDMO C[C@H]1CCSCC[N@H+]1Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001603910487 1350800530 /nfs/dbraw/zinc/80/05/30/1350800530.db2.gz OXMWMBALYXNVDI-JTQLQIEISA-N 1 1 334.405 2.102 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839536978 1372908971 /nfs/dbraw/zinc/90/89/71/1372908971.db2.gz RGYIVLXJZXEZNB-WDEREUQCSA-N 1 1 340.811 2.211 20 5 EEBDMO CC(C)N(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cn[nH]c1 ZINC001755809766 1407863148 /nfs/dbraw/zinc/86/31/48/1407863148.db2.gz XOKKAKRHSYKQGN-UHFFFAOYSA-N 1 1 345.403 2.301 20 5 EEBDMO Cc1ccnc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)c1[N+](=O)[O-] ZINC001164791493 721399052 /nfs/dbraw/zinc/39/90/52/721399052.db2.gz YTVXDDQRPDQACT-CHWSQXEVSA-N 1 1 345.428 2.323 20 5 EEBDMO CCN(CCn1cccn1)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 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FVWVDOJPQRRRDO-WFASDCNBSA-N 1 1 326.418 2.035 20 5 EEBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](S(C)(=O)=O)C1 ZINC001173232412 797312642 /nfs/dbraw/zinc/31/26/42/797312642.db2.gz FVWVDOJPQRRRDO-WFASDCNBSA-N 1 1 326.418 2.035 20 5 EEBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CC(N2C[C@@H](C)O[C@H](C)C2)C1 ZINC001173238508 797323845 /nfs/dbraw/zinc/32/38/45/797323845.db2.gz ULCFILPDUFZXGI-RBSFLKMASA-N 1 1 333.432 2.319 20 5 EEBDMO Cc1nc(Nc2cc([N+](=O)[O-])ccc2F)cc(N2CCOCC2)[nH+]1 ZINC001175734170 798210236 /nfs/dbraw/zinc/21/02/36/798210236.db2.gz MUOSQOQOIZXIRP-UHFFFAOYSA-N 1 1 333.323 2.413 20 5 EEBDMO C[NH+]1CCN(c2cc(Nc3ccc(/C=C/[N+](=O)[O-])cc3)ncn2)CC1 ZINC001175899237 798281410 /nfs/dbraw/zinc/28/14/10/798281410.db2.gz QBFNGLBDEUDENT-VOTSOKGWSA-N 1 1 340.387 2.219 20 5 EEBDMO [NH3+][C@@H](CC(F)F)c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000843185154 798616971 /nfs/dbraw/zinc/61/69/71/798616971.db2.gz MVCDJKFJCWXKFY-QMMMGPOBSA-N 1 1 327.291 2.287 20 5 EEBDMO 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CC[C@]1(CO)CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000249554555 464889358 /nfs/dbraw/zinc/88/93/58/464889358.db2.gz JGLCIWPKVIAKAP-DYVFJYSZSA-N 1 1 335.404 2.406 20 5 EEBDMO COc1cc(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000249743514 464911649 /nfs/dbraw/zinc/91/16/49/464911649.db2.gz LCOUMBLYSXFQRQ-OLZOCXBDSA-N 1 1 335.404 2.454 20 5 EEBDMO Cc1c(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177128776 464938146 /nfs/dbraw/zinc/93/81/46/464938146.db2.gz UMRKFYMETWLOFH-ONGXEEELSA-N 1 1 348.359 2.166 20 5 EEBDMO COc1cc(C[N@@H+](C)C[C@@H]2CCN(C(C)=O)C2)c([N+](=O)[O-])cc1F ZINC000184270855 464959013 /nfs/dbraw/zinc/95/90/13/464959013.db2.gz FBZIDWAIJIUWPO-LBPRGKRZSA-N 1 1 339.367 2.043 20 5 EEBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000286559352 464960233 /nfs/dbraw/zinc/96/02/33/464960233.db2.gz TUGZQNNHUDZCAX-HOCLYGCPSA-N 1 1 335.404 2.009 20 5 EEBDMO 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EEBDMO COc1c(O)ccc(C[N@@H+]2CCS[C@@H]3COCC[C@H]32)c1[N+](=O)[O-] ZINC000892211425 678258161 /nfs/dbraw/zinc/25/81/61/678258161.db2.gz LSXWGOIMMQTRFE-DGCLKSJQSA-N 1 1 340.401 2.015 20 5 EEBDMO COc1c(O)ccc(C[N@H+]2CCS[C@@H]3COCC[C@H]32)c1[N+](=O)[O-] ZINC000892211425 678258164 /nfs/dbraw/zinc/25/81/64/678258164.db2.gz LSXWGOIMMQTRFE-DGCLKSJQSA-N 1 1 340.401 2.015 20 5 EEBDMO CCc1ccc(C[NH+]2CCN(c3c([N+](=O)[O-])cnn3C)CC2)s1 ZINC000892612843 681967095 /nfs/dbraw/zinc/96/70/95/681967095.db2.gz NJOYZMUQFCYLMD-UHFFFAOYSA-N 1 1 335.433 2.274 20 5 EEBDMO CC(C)(C)[C@@H]1CSCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000931595952 693752830 /nfs/dbraw/zinc/75/28/30/693752830.db2.gz FFUBOCDYEZVFNU-ZDUSSCGKSA-N 1 1 325.434 2.220 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCC2(CC2)CC1 ZINC001029304610 683939885 /nfs/dbraw/zinc/93/98/85/683939885.db2.gz BJKGMAOPTNVMMT-YYIAUSFCSA-N 1 1 347.459 2.297 20 5 EEBDMO 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334.420 2.439 20 5 EEBDMO CN(C)c1cc(NC(=O)c2cc3nsnc3c([N+](=O)[O-])c2)cc[nH+]1 ZINC000778309729 1208109941 /nfs/dbraw/zinc/10/99/41/1208109941.db2.gz NCAHCILXNRSEHZ-UHFFFAOYSA-N 1 1 344.356 2.313 20 5 EEBDMO Cc1ccccc1C[NH2+]C1CC2(CC(NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC000963789802 1218040954 /nfs/dbraw/zinc/04/09/54/1218040954.db2.gz BKRLJPUZJKKZAZ-UOAXPGHYSA-N 1 1 343.427 2.177 20 5 EEBDMO CC(F)(F)C(=O)N1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC001048643102 1238172004 /nfs/dbraw/zinc/17/20/04/1238172004.db2.gz FTUAJPJBHPCMEN-BETUJISGSA-N 1 1 339.342 2.140 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1Nc1cnc(N2CC[NH+](C)CC2)nc1 ZINC001211285308 1295800513 /nfs/dbraw/zinc/80/05/13/1295800513.db2.gz CVANRYLXIXQJNY-UHFFFAOYSA-N 1 1 328.376 2.189 20 5 EEBDMO CN(CC[N@@H+](C)CCO)C(=O)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001220438412 1298409756 /nfs/dbraw/zinc/40/97/56/1298409756.db2.gz SQPVCKBDGKPVMM-UHFFFAOYSA-N 1 1 346.387 2.136 20 5 EEBDMO COC(=O)c1cc(OC)c(O[C@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC001226362750 1301378249 /nfs/dbraw/zinc/37/82/49/1301378249.db2.gz ZAJRKXWKBJSYCV-LBPRGKRZSA-N 1 1 338.360 2.252 20 5 EEBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@H]2Oc1[nH]c(=O)nc2ccc([N+](=O)[O-])cc21 ZINC001227094580 1301683990 /nfs/dbraw/zinc/68/39/90/1301683990.db2.gz HWIDJNOERPOSGC-HBYGRHMLSA-N 1 1 344.371 2.353 20 5 EEBDMO CC[NH+](CC)CC(=O)NC1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC001229679171 1302912976 /nfs/dbraw/zinc/91/29/76/1302912976.db2.gz RUMUCNWMGJENIA-UHFFFAOYSA-N 1 1 348.447 2.017 20 5 EEBDMO CC(C)OCCC(=O)NCCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001234188211 1304788375 /nfs/dbraw/zinc/78/83/75/1304788375.db2.gz BBRUDKMNIMGQSX-UHFFFAOYSA-N 1 1 337.420 2.348 20 5 EEBDMO C[N@@H+](CCCNC(=O)COC1CCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001234414155 1304913825 /nfs/dbraw/zinc/91/38/25/1304913825.db2.gz FXSXMIUFQMTIIK-UHFFFAOYSA-N 1 1 349.431 2.492 20 5 EEBDMO CC(C)[N@H+]1CCO[C@H](COC(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)C1 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CCC[C@@]1(CO)CC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000344252574 161211586 /nfs/dbraw/zinc/21/15/86/161211586.db2.gz HZNBQVOTRGCTJD-QGZVFWFLSA-N 1 1 335.404 2.326 20 5 EEBDMO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCCCS2(=O)=O)c(Cl)c1 ZINC000344347661 161218738 /nfs/dbraw/zinc/21/87/38/161218738.db2.gz GIUYKOXAPVRXIP-LBPRGKRZSA-N 1 1 332.809 2.305 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@]1(C)CCCO ZINC000345959771 161345629 /nfs/dbraw/zinc/34/56/29/161345629.db2.gz ZCYCBWBSKHBTMZ-KRWDZBQOSA-N 1 1 335.404 2.469 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@]1(C)CCCO ZINC000345959771 161345630 /nfs/dbraw/zinc/34/56/30/161345630.db2.gz ZCYCBWBSKHBTMZ-KRWDZBQOSA-N 1 1 335.404 2.469 20 5 EEBDMO COC(=O)[C@H]1CC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H]1C ZINC000346614650 161386092 /nfs/dbraw/zinc/38/60/92/161386092.db2.gz IGOSAIATZRQBOV-KOLCDFICSA-N 1 1 326.324 2.126 20 5 EEBDMO COC(=O)[C@H]1CC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H]1C ZINC000346614650 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/nfs/dbraw/zinc/39/08/14/162390814.db2.gz UBEOOQLKGSXWCA-QWRGUYRKSA-N 1 1 343.330 2.483 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1Cc1c([N+](=O)[O-])ncn1C ZINC000355345624 163153967 /nfs/dbraw/zinc/15/39/67/163153967.db2.gz TVQBZAQBFTYPDX-AWEZNQCLSA-N 1 1 329.404 2.035 20 5 EEBDMO COC(=O)COc1ccc(C[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)cc1[N+](=O)[O-] ZINC000355741231 163286282 /nfs/dbraw/zinc/28/62/82/163286282.db2.gz UPPKKXLKJDIVPX-BETUJISGSA-N 1 1 334.372 2.234 20 5 EEBDMO C[C@H](O)c1ncc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)s1 ZINC000368035376 166039419 /nfs/dbraw/zinc/03/94/19/166039419.db2.gz FJMMSBFHMMEHKV-JTQLQIEISA-N 1 1 337.405 2.138 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000359928089 164198412 /nfs/dbraw/zinc/19/84/12/164198412.db2.gz YIHNSEWJWDMTIR-NEPJUHHUSA-N 1 1 335.404 2.467 20 5 EEBDMO C[C@H]1C[C@@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000360654127 164358951 /nfs/dbraw/zinc/35/89/51/164358951.db2.gz SNEKLJCIPLVMMW-ONGXEEELSA-N 1 1 347.824 2.009 20 5 EEBDMO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCn1ccc([N+](=O)[O-])n1 ZINC000274871037 269067565 /nfs/dbraw/zinc/06/75/65/269067565.db2.gz XBAJPDIVSSPIGD-NVXWUHKLSA-N 1 1 343.431 2.292 20 5 EEBDMO COCc1cc([N+](=O)[O-])ccc1N(C)CC[N@@H+]1CCOC(C)(C)C1 ZINC000278831356 269244729 /nfs/dbraw/zinc/24/47/29/269244729.db2.gz KBQGJRSKXQNCQN-UHFFFAOYSA-N 1 1 337.420 2.288 20 5 EEBDMO COCc1cc([N+](=O)[O-])ccc1N(C)CC[N@H+]1CCOC(C)(C)C1 ZINC000278831356 269244731 /nfs/dbraw/zinc/24/47/31/269244731.db2.gz KBQGJRSKXQNCQN-UHFFFAOYSA-N 1 1 337.420 2.288 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21 ZINC000277411165 274290963 /nfs/dbraw/zinc/29/09/63/274290963.db2.gz HWXNEAOSYGPTDC-DOMZBBRYSA-N 1 1 333.388 2.160 20 5 EEBDMO C[C@@H]1[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)CC[N@H+]1Cc1ccccc1 ZINC000288276844 275041697 /nfs/dbraw/zinc/04/16/97/275041697.db2.gz QXDPEGVJQPSBNW-DGCLKSJQSA-N 1 1 328.376 2.042 20 5 EEBDMO C[N@@H+](C[C@H](O)COc1ccc([N+](=O)[O-])cc1Br)C1CC1 ZINC000290810063 275242144 /nfs/dbraw/zinc/24/21/44/275242144.db2.gz RBNVIILFMKPKFP-NSHDSACASA-N 1 1 345.193 2.191 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CC[C@@](CO)(c3ccccc3)C2)c1 ZINC000291621987 275323838 /nfs/dbraw/zinc/32/38/38/275323838.db2.gz CTWJIVDHRQBRDB-RBUKOAKNSA-N 1 1 342.395 2.264 20 5 EEBDMO COc1ccccc1C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C1CC1 ZINC000159763897 278049008 /nfs/dbraw/zinc/04/90/08/278049008.db2.gz FZFAJPLUFRHFAH-UHFFFAOYSA-N 1 1 343.383 2.430 20 5 EEBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000293654595 293262428 /nfs/dbraw/zinc/26/24/28/293262428.db2.gz HEGOMMVIYDIOCO-KRWDZBQOSA-N 1 1 333.388 2.161 20 5 EEBDMO COCCCN1CCC([NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000293722185 293278937 /nfs/dbraw/zinc/27/89/37/293278937.db2.gz MNBKAPJDWAFHFP-ZDUSSCGKSA-N 1 1 336.436 2.329 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)c1 ZINC000294133525 293378651 /nfs/dbraw/zinc/37/86/51/293378651.db2.gz MNDLWZVSGMDUAS-QGZVFWFLSA-N 1 1 333.388 2.161 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](CC2CCC(=O)CC2)CC1 ZINC000294944604 293587258 /nfs/dbraw/zinc/58/72/58/293587258.db2.gz LUUKKRKTQVQWMV-UHFFFAOYSA-N 1 1 345.399 2.112 20 5 EEBDMO COC(=O)Cc1ccc(N[C@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000296624316 294024703 /nfs/dbraw/zinc/02/47/03/294024703.db2.gz VFKCOUYUNXHBEU-GJZGRUSLSA-N 1 1 333.388 2.349 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccco3)CC2)c2nonc21 ZINC000298604069 294540319 /nfs/dbraw/zinc/54/03/19/294540319.db2.gz NOKWQTZMMBIOHD-UHFFFAOYSA-N 1 1 329.316 2.046 20 5 EEBDMO Cc1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000299644601 294794226 /nfs/dbraw/zinc/79/42/26/294794226.db2.gz QVVNQPIMDCOFAR-UHFFFAOYSA-N 1 1 347.331 2.055 20 5 EEBDMO Cc1cc(C)c(OC[C@H](O)C[NH+]2C[C@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000339332421 312254141 /nfs/dbraw/zinc/25/41/41/312254141.db2.gz OHIASTZXHGXXLX-SOUVJXGZSA-N 1 1 338.404 2.061 20 5 EEBDMO Cc1ccc([C@@H](C)NCCC[N@H+]2CCC[C@@H](C(N)=O)C2)cc1[N+](=O)[O-] ZINC000346058067 312271932 /nfs/dbraw/zinc/27/19/32/312271932.db2.gz APUSDRMRUOBGQT-GDBMZVCRSA-N 1 1 348.447 2.141 20 5 EEBDMO Cc1c([C@H]2OCC[C@@H]2[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cnn1C ZINC000431974196 314671198 /nfs/dbraw/zinc/67/11/98/314671198.db2.gz RVRHHQTVLFRQNX-GOEBONIOSA-N 1 1 334.351 2.396 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC000565548352 319192945 /nfs/dbraw/zinc/19/29/45/319192945.db2.gz GWGQGMVDHZQEDA-DZGCQCFKSA-N 1 1 332.404 2.010 20 5 EEBDMO O=C(C[N@H+]1CCC[C@@H]1[C@H]1CCCOC1)Nc1ccccc1[N+](=O)[O-] ZINC000574873212 320065143 /nfs/dbraw/zinc/06/51/43/320065143.db2.gz GNBKJVROQARBPM-DZGCQCFKSA-N 1 1 333.388 2.424 20 5 EEBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@]1(CO)CCOC1 ZINC000339080529 465071025 /nfs/dbraw/zinc/07/10/25/465071025.db2.gz FPXXPXOOUSZQAD-ZDUSSCGKSA-N 1 1 334.294 2.197 20 5 EEBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@]1(CO)CCOC1 ZINC000339080529 465071029 /nfs/dbraw/zinc/07/10/29/465071029.db2.gz FPXXPXOOUSZQAD-ZDUSSCGKSA-N 1 1 334.294 2.197 20 5 EEBDMO COc1ccc(C[N@H+]2CCC[C@@H](CCNC(C)=O)C2)cc1[N+](=O)[O-] ZINC000347627814 465132199 /nfs/dbraw/zinc/13/21/99/465132199.db2.gz HHPOPLQQYZESTR-AWEZNQCLSA-N 1 1 335.404 2.342 20 5 EEBDMO C[N@H+]1CCCC[C@H]1CCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000351399513 465142112 /nfs/dbraw/zinc/14/21/12/465142112.db2.gz BDJHNLQYDCYODH-GJZGRUSLSA-N 1 1 333.436 2.350 20 5 EEBDMO CS(=O)(=O)c1ccc(F)c(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000337236781 465260746 /nfs/dbraw/zinc/26/07/46/465260746.db2.gz CKOSIYCSIRHBQZ-UHFFFAOYSA-N 1 1 338.360 2.427 20 5 EEBDMO C[C@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[N@@H+](C)C1CC1 ZINC000087138187 462592039 /nfs/dbraw/zinc/59/20/39/462592039.db2.gz LVSJQPQWCSFTSM-GFCCVEGCSA-N 1 1 332.404 2.145 20 5 EEBDMO Cc1cccc(NCCNC(=O)CCc2cccc([N+](=O)[O-])c2)[nH+]1 ZINC000087402398 462606032 /nfs/dbraw/zinc/60/60/32/462606032.db2.gz SKWBUKHWEQSCAZ-UHFFFAOYSA-N 1 1 328.372 2.459 20 5 EEBDMO Cc1cc(N2CC[NH+](Cc3cccc(O)c3)CC2)ncc1[N+](=O)[O-] ZINC000074745878 462630243 /nfs/dbraw/zinc/63/02/43/462630243.db2.gz ARUIWQJRUHLJFD-UHFFFAOYSA-N 1 1 328.372 2.326 20 5 EEBDMO Cc1ccnc(NC[C@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000089643926 462703553 /nfs/dbraw/zinc/70/35/53/462703553.db2.gz LMSLVWAGJLSRCI-HZPDHXFCSA-N 1 1 342.399 2.346 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NCCCCn1cc[nH+]c1C ZINC000130372389 462752831 /nfs/dbraw/zinc/75/28/31/462752831.db2.gz SAXFLVWXGGGIEE-UHFFFAOYSA-N 1 1 332.360 2.319 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOC[C@H]1C1CC1 ZINC000090007124 462763991 /nfs/dbraw/zinc/76/39/91/462763991.db2.gz LITPPHYFAZSXST-HNNXBMFYSA-N 1 1 349.387 2.043 20 5 EEBDMO Cc1cc(C(=O)NC2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)no1 ZINC000065954123 462842717 /nfs/dbraw/zinc/84/27/17/462842717.db2.gz NXCZBBHMVAZYIF-UHFFFAOYSA-N 1 1 344.371 2.286 20 5 EEBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 ZINC000066047345 462848483 /nfs/dbraw/zinc/84/84/83/462848483.db2.gz SAXPGKMBFNQQDW-QLFBSQMISA-N 1 1 349.435 2.045 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)NCCNc2ccccc2[N+](=O)[O-])C1 ZINC000067682743 463035771 /nfs/dbraw/zinc/03/57/71/463035771.db2.gz FVFDHEUNENBRMP-AWEZNQCLSA-N 1 1 349.435 2.036 20 5 EEBDMO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H](CO)C(C)(C)C ZINC000134432193 463040053 /nfs/dbraw/zinc/04/00/53/463040053.db2.gz SIPNMYYGQZQXRU-CYBMUJFWSA-N 1 1 334.376 2.484 20 5 EEBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H](CO)C(C)(C)C ZINC000134432193 463040058 /nfs/dbraw/zinc/04/00/58/463040058.db2.gz SIPNMYYGQZQXRU-CYBMUJFWSA-N 1 1 334.376 2.484 20 5 EEBDMO CC[N@H+]1CCC[C@@H](CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000121160706 463090276 /nfs/dbraw/zinc/09/02/76/463090276.db2.gz SRXPDAGDDVWSIX-ZDUSSCGKSA-N 1 1 344.415 2.467 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000135635638 463187770 /nfs/dbraw/zinc/18/77/70/463187770.db2.gz CEJVRMOLBNWXOX-PXAZEXFGSA-N 1 1 344.415 2.417 20 5 EEBDMO CN(CC(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000080086849 463280730 /nfs/dbraw/zinc/28/07/30/463280730.db2.gz HWZGHUQLTLFHJE-CQSZACIVSA-N 1 1 346.431 2.164 20 5 EEBDMO CNC(=O)c1ccc(NCCNc2cccc(C)[nH+]2)c([N+](=O)[O-])c1 ZINC000069702448 463306312 /nfs/dbraw/zinc/30/63/12/463306312.db2.gz GOXQDSUOOKCGEQ-UHFFFAOYSA-N 1 1 329.360 2.182 20 5 EEBDMO C[N@@H+](CCNC(=O)Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000056191933 463382951 /nfs/dbraw/zinc/38/29/51/463382951.db2.gz QGUDGGXSADUDHL-UHFFFAOYSA-N 1 1 327.384 2.386 20 5 EEBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 ZINC000081128870 463397329 /nfs/dbraw/zinc/39/73/29/463397329.db2.gz APJNWSDOPPQRGV-AWEZNQCLSA-N 1 1 328.372 2.269 20 5 EEBDMO O=C(CC[N@@H+]1CC[C@@H](N2CCCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000170743579 463701783 /nfs/dbraw/zinc/70/17/83/463701783.db2.gz UHPIQFCYTMGAHH-MRXNPFEDSA-N 1 1 332.404 2.094 20 5 EEBDMO O=C(CC[N@H+]1CC[C@@H](N2CCCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000170743579 463701785 /nfs/dbraw/zinc/70/17/85/463701785.db2.gz UHPIQFCYTMGAHH-MRXNPFEDSA-N 1 1 332.404 2.094 20 5 EEBDMO O=C(C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000177525329 463728177 /nfs/dbraw/zinc/72/81/77/463728177.db2.gz IXJRERGGZMUEGV-TXEJJXNPSA-N 1 1 347.371 2.384 20 5 EEBDMO Cc1sc(C(=O)N2CC[NH2+]C[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000261628542 463807211 /nfs/dbraw/zinc/80/72/11/463807211.db2.gz ATNAESHHRJKLKL-ZDUSSCGKSA-N 1 1 332.385 2.146 20 5 EEBDMO Cc1cccc(CC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1 ZINC000568744797 468381778 /nfs/dbraw/zinc/38/17/78/468381778.db2.gz GBINSEYSUPIYSV-OAHLLOKOSA-N 1 1 327.388 2.422 20 5 EEBDMO COCC1=CC[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000185837597 463887952 /nfs/dbraw/zinc/88/79/52/463887952.db2.gz ZGPOTBGBBCSCSO-UHFFFAOYSA-N 1 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325.752 2.179 20 5 EEBDMO CN(C(=O)/C=C\c1ccccc1[N+](=O)[O-])C(C)(C)C[NH+]1CCOCC1 ZINC000493827634 467992061 /nfs/dbraw/zinc/99/20/61/467992061.db2.gz SXCOTWSEQMIHTI-HJWRWDBZSA-N 1 1 347.415 2.177 20 5 EEBDMO CC(C)[C@H]1CN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000487956551 468062767 /nfs/dbraw/zinc/06/27/67/468062767.db2.gz LTPLRJJNDNSSPB-XJKSGUPXSA-N 1 1 334.420 2.194 20 5 EEBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C1CCOCC1 ZINC000533310326 468187930 /nfs/dbraw/zinc/18/79/30/468187930.db2.gz OWZSXBARYORPMX-UHFFFAOYSA-N 1 1 335.360 2.004 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](c2nccn2C)C1 ZINC000533865449 468226459 /nfs/dbraw/zinc/22/64/59/468226459.db2.gz NSUJCNMBQLOQIS-CHWSQXEVSA-N 1 1 343.387 2.145 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](c2nccn2C)C1 ZINC000533865449 468226464 /nfs/dbraw/zinc/22/64/64/468226464.db2.gz NSUJCNMBQLOQIS-CHWSQXEVSA-N 1 1 343.387 2.145 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594235244 468523788 /nfs/dbraw/zinc/52/37/88/468523788.db2.gz UNTPPHXROYKWIV-DLBZAZTESA-N 1 1 346.431 2.453 20 5 EEBDMO Nc1c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc(F)cc1[N+](=O)[O-] ZINC000594418559 468579406 /nfs/dbraw/zinc/57/94/06/468579406.db2.gz KDNJFASVYGAOGC-OLZOCXBDSA-N 1 1 336.367 2.063 20 5 EEBDMO Cc1cc(OCC(=O)N2CCC[C@@]3(CC[N@H+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000597710178 468647337 /nfs/dbraw/zinc/64/73/37/468647337.db2.gz JAHHKBSMXATSAK-SFHVURJKSA-N 1 1 347.415 2.226 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]2OCC[C@@H]2C1 ZINC000570629412 468667506 /nfs/dbraw/zinc/66/75/06/468667506.db2.gz DNLVJIJXKBVWMV-CJNGLKHVSA-N 1 1 333.388 2.343 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000597860247 468696441 /nfs/dbraw/zinc/69/64/41/468696441.db2.gz MOXNEUMJZIIQLM-LLVKDONJSA-N 1 1 349.387 2.174 20 5 EEBDMO O=C(CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12)NC1CCCCC1 ZINC000601108570 468743689 /nfs/dbraw/zinc/74/36/89/468743689.db2.gz JSQKSJYRPSGBCE-UHFFFAOYSA-N 1 1 328.372 2.426 20 5 EEBDMO C[C@H](Nc1ccnc2ccc([N+](=O)[O-])cc21)[C@H](C)[NH+]1CCOCC1 ZINC000601113918 468745767 /nfs/dbraw/zinc/74/57/67/468745767.db2.gz JITNXDKERPHEFY-STQMWFEESA-N 1 1 330.388 2.086 20 5 EEBDMO CCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)c1[N+](=O)[O-] ZINC000598220047 468796696 /nfs/dbraw/zinc/79/66/96/468796696.db2.gz OJCYUEVDIYTYFG-LLVKDONJSA-N 1 1 335.408 2.017 20 5 EEBDMO Cc1noc(C[NH+]2C[C@H]3CN(c4ccccc4)C[C@@H]3C2)c1[N+](=O)[O-] ZINC000595293426 468802119 /nfs/dbraw/zinc/80/21/19/468802119.db2.gz NLGPCUFINSRQOH-KBPBESRZSA-N 1 1 328.372 2.459 20 5 EEBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2n[nH]cc2C1 ZINC000598941547 469058883 /nfs/dbraw/zinc/05/88/83/469058883.db2.gz XBTWNQIEETVVTE-NSHDSACASA-N 1 1 329.360 2.093 20 5 EEBDMO CC(C)[C@@H]1c2ccccc2CC[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000610783300 469070509 /nfs/dbraw/zinc/07/05/09/469070509.db2.gz JCIBHBVCWZURQV-SJLPKXTDSA-N 1 1 344.415 2.408 20 5 EEBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1c(Cl)cncc1[N+](=O)[O-] ZINC000596172089 469185639 /nfs/dbraw/zinc/18/56/39/469185639.db2.gz JLKZPRCVTSRBJD-UHFFFAOYSA-N 1 1 342.827 2.438 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21 ZINC000602997566 469213372 /nfs/dbraw/zinc/21/33/72/469213372.db2.gz MZKAMAGUHRSTPM-UAGQMJEPSA-N 1 1 347.415 2.467 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21 ZINC000602997566 469213375 /nfs/dbraw/zinc/21/33/75/469213375.db2.gz MZKAMAGUHRSTPM-UAGQMJEPSA-N 1 1 347.415 2.467 20 5 EEBDMO CCOC(=O)c1ccnc(N2CCC[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-] ZINC000596269588 469227279 /nfs/dbraw/zinc/22/72/79/469227279.db2.gz UQOYUSQLRISBRV-GFCCVEGCSA-N 1 1 336.392 2.087 20 5 EEBDMO C[C@@H]1CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C ZINC000615496292 469249842 /nfs/dbraw/zinc/24/98/42/469249842.db2.gz SFFIVPMFTVXIAE-NEPJUHHUSA-N 1 1 332.404 2.016 20 5 EEBDMO C[C@H]1C[N@H+](CCNc2ncnc3sc([N+](=O)[O-])cc32)[C@@H](C)CO1 ZINC000596434469 469264869 /nfs/dbraw/zinc/26/48/69/469264869.db2.gz YPXZGWASBCEJSF-UWVGGRQHSA-N 1 1 337.405 2.121 20 5 EEBDMO C[C@H]1C[N@@H+](CCNc2ncnc3sc([N+](=O)[O-])cc32)[C@@H](C)CO1 ZINC000596434469 469264870 /nfs/dbraw/zinc/26/48/70/469264870.db2.gz YPXZGWASBCEJSF-UWVGGRQHSA-N 1 1 337.405 2.121 20 5 EEBDMO C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@H]1CCCC[C@H]1O ZINC000611521402 469270978 /nfs/dbraw/zinc/27/09/78/469270978.db2.gz MEYJULKWXLZAGT-IUODEOHRSA-N 1 1 336.388 2.349 20 5 EEBDMO COc1ccc(OCC[N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])cc1 ZINC000611529256 469273333 /nfs/dbraw/zinc/27/33/33/469273333.db2.gz DJUSKGYAKLAKNI-UHFFFAOYSA-N 1 1 334.376 2.119 20 5 EEBDMO NC(=O)c1cc(NC[C@H]2CC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000596558210 469300399 /nfs/dbraw/zinc/30/03/99/469300399.db2.gz OZQKWGMSXOKSKX-OAHLLOKOSA-N 1 1 340.383 2.380 20 5 EEBDMO CC(C)(C)Oc1cc(N2CC[N@@H+]3CCOC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000612451151 469469912 /nfs/dbraw/zinc/46/99/12/469469912.db2.gz HYMSRJLWLNLHBT-AWEZNQCLSA-N 1 1 335.404 2.293 20 5 EEBDMO CC(C)(C)Oc1cc(N2CC[N@H+]3CCOC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000612451151 469469915 /nfs/dbraw/zinc/46/99/15/469469915.db2.gz HYMSRJLWLNLHBT-AWEZNQCLSA-N 1 1 335.404 2.293 20 5 EEBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 ZINC000610296529 470001527 /nfs/dbraw/zinc/00/15/27/470001527.db2.gz ALKAZCADLSVMFH-CQSZACIVSA-N 1 1 328.372 2.269 20 5 EEBDMO COc1cc(C[NH+]2CCC(C3OCCO3)CC2)c([N+](=O)[O-])cc1F ZINC000184195780 533799065 /nfs/dbraw/zinc/79/90/65/533799065.db2.gz GSNFXLUKHSBKKG-UHFFFAOYSA-N 1 1 340.351 2.327 20 5 EEBDMO CC1([C@@H]2CCC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)OCCO1 ZINC000183865495 528053285 /nfs/dbraw/zinc/05/32/85/528053285.db2.gz YPNIIWZXZIFFGI-ZBFHGGJFSA-N 1 1 336.388 2.103 20 5 EEBDMO CN(C)c1[nH+]cc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)n1C ZINC000265143346 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CCC[N@H+]1CC[C@@H](Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C1 ZINC000894592848 682989376 /nfs/dbraw/zinc/98/93/76/682989376.db2.gz NZPVDYGCTNTRFH-GFCCVEGCSA-N 1 1 330.388 2.343 20 5 EEBDMO COc1c(O)ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c1[N+](=O)[O-] ZINC000894707784 683043627 /nfs/dbraw/zinc/04/36/27/683043627.db2.gz PFJQBTMTGAZXJA-MJBXVCDLSA-N 1 1 336.388 2.434 20 5 EEBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c2cnccc12)[C@H]1C[N@@H+](C)CCN1C ZINC000895248222 684374740 /nfs/dbraw/zinc/37/47/40/684374740.db2.gz KQWSWUSHYKISIH-SJKOYZFVSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c2cnccc12)[C@H]1CN(C)CC[N@@H+]1C ZINC000895248222 684374746 /nfs/dbraw/zinc/37/47/46/684374746.db2.gz KQWSWUSHYKISIH-SJKOYZFVSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c2cnccc12)[C@H]1CN(C)CC[N@H+]1C ZINC000895248222 684374751 /nfs/dbraw/zinc/37/47/51/684374751.db2.gz KQWSWUSHYKISIH-SJKOYZFVSA-N 1 1 329.404 2.189 20 5 EEBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCN(C(=O)c2cc[nH]n2)CC1 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COc1ccc2ncc([N+](=O)[O-])c(NCC[N@H+]3CCC[C@@H]3C)c2c1 ZINC001306982510 1331505452 /nfs/dbraw/zinc/50/54/52/1331505452.db2.gz GHFJUFGKYHIREW-LBPRGKRZSA-N 1 1 330.388 2.470 20 5 EEBDMO C[N@@H+](CCCCNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)C1CC1 ZINC001609275254 1351918575 /nfs/dbraw/zinc/91/85/75/1351918575.db2.gz QCPLICJYKANSNZ-UHFFFAOYSA-N 1 1 331.380 2.061 20 5 EEBDMO C[N@@H+](Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[C@H](CO)CC(C)(C)C ZINC001609278825 1351920363 /nfs/dbraw/zinc/92/03/63/1351920363.db2.gz XXHXWGAXJUYERB-ZDUSSCGKSA-N 1 1 348.407 2.004 20 5 EEBDMO CCOC(=O)C[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001328599213 1334486794 /nfs/dbraw/zinc/48/67/94/1334486794.db2.gz YNUDEFYYSPSODX-CYBMUJFWSA-N 1 1 349.387 2.341 20 5 EEBDMO O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@H](CO)CC3CCOCC3)c2c1 ZINC001329733076 1334704557 /nfs/dbraw/zinc/70/45/57/1334704557.db2.gz PTXYWQFYUUCTKP-AWEZNQCLSA-N 1 1 345.399 2.402 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCN1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848491636 1338708894 /nfs/dbraw/zinc/70/88/94/1338708894.db2.gz XKFBNAGYAGOCPQ-OAHLLOKOSA-N 1 1 329.404 2.442 20 5 EEBDMO C[C@@]([NH3+])(C(=O)N1CC[C@H](C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC001576081160 1343963243 /nfs/dbraw/zinc/96/32/43/1343963243.db2.gz JHXLNPDWBVTODD-GWCFXTLKSA-N 1 1 331.294 2.180 20 5 EEBDMO [NH3+]CCN(CCCCCCc1cn[nH]n1)c1ccc([N+](=O)[O-])cc1 ZINC001577740949 1344189125 /nfs/dbraw/zinc/18/91/25/1344189125.db2.gz YSNGOFAPFMNBEJ-UHFFFAOYSA-N 1 1 332.408 2.281 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC001593479937 1349813484 /nfs/dbraw/zinc/81/34/84/1349813484.db2.gz CLDSYFPTJZEQNT-STQMWFEESA-N 1 1 343.391 2.204 20 5 EEBDMO Cc1cc(NCC[N@@H+]2CCCC[C@H]2C)cc(-c2nn[nH]n2)c1[N+](=O)[O-] ZINC001605734627 1351219592 /nfs/dbraw/zinc/21/95/92/1351219592.db2.gz HTZZSOBGSFDBBU-GFCCVEGCSA-N 1 1 345.407 2.370 20 5 EEBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@]1(C)CO ZINC000852701208 1369295195 /nfs/dbraw/zinc/29/51/95/1369295195.db2.gz AAIKDBMEZUFXEQ-BZNIZROVSA-N 1 1 339.367 2.013 20 5 EEBDMO CC(C)(C[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1)C(N)=O ZINC000830562880 1372336374 /nfs/dbraw/zinc/33/63/74/1372336374.db2.gz ATPZBUGDOBAOTR-BBRMVZONSA-N 1 1 349.431 2.242 20 5 EEBDMO CC(=O)Nc1cccc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)c1 ZINC001575025545 1403531053 /nfs/dbraw/zinc/53/10/53/1403531053.db2.gz ORJQLXLXMIQLIM-KRWDZBQOSA-N 1 1 342.355 2.366 20 5 EEBDMO COc1cc2ncnc(N3C[C@@H](C)[N@@H+](C)C[C@@H]3C)c2cc1[N+](=O)[O-] ZINC001164642506 719201143 /nfs/dbraw/zinc/20/11/43/719201143.db2.gz WAZMNJJEVHNCSB-MNOVXSKESA-N 1 1 331.376 2.075 20 5 EEBDMO COc1cc(C)nc(N2CC3(C2)CC[N@@H+](CC2CC2)C3)c1[N+](=O)[O-] ZINC001164772156 721287453 /nfs/dbraw/zinc/28/74/53/721287453.db2.gz FQGXTXKEDGLBKI-UHFFFAOYSA-N 1 1 332.404 2.229 20 5 EEBDMO Cc1cc(C(=O)NCC2C[NH+](Cc3ccc([N+](=O)[O-])cc3)C2)c(C)[nH]1 ZINC001032012278 782298629 /nfs/dbraw/zinc/29/86/29/782298629.db2.gz HFRXELCFPWIMFZ-UHFFFAOYSA-N 1 1 342.399 2.402 20 5 EEBDMO O=[N+]([O-])c1cnc(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)c(C(F)(F)F)c1 ZINC000840252603 782457984 /nfs/dbraw/zinc/45/79/84/782457984.db2.gz XSUJRRTZDHHLOJ-GXSJLCMTSA-N 1 1 346.309 2.284 20 5 EEBDMO Cc1noc(C)c1C(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001031540618 769486633 /nfs/dbraw/zinc/48/66/33/769486633.db2.gz OKAQSFJFLBBHPN-UHFFFAOYSA-N 1 1 344.371 2.061 20 5 EEBDMO CN(C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CCC[N@@H+](C)C1 ZINC000893603199 774534991 /nfs/dbraw/zinc/53/49/91/774534991.db2.gz UVFCJNLFSTUNQM-CYBMUJFWSA-N 1 1 340.811 2.484 20 5 EEBDMO CC1(C)C(=O)N[C@H]1C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000846929302 790733101 /nfs/dbraw/zinc/73/31/01/790733101.db2.gz KEQAQHFVUZYZRB-HNNXBMFYSA-N 1 1 335.379 2.471 20 5 EEBDMO CC1(C)CC[N@@H+](CCNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000893875789 780265915 /nfs/dbraw/zinc/26/59/15/780265915.db2.gz FJEJLWYETKXLNZ-UHFFFAOYSA-N 1 1 334.420 2.168 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC/C=C\CNc1cccc(F)c1[N+](=O)[O-] ZINC001107321615 786858924 /nfs/dbraw/zinc/85/89/24/786858924.db2.gz HNGALVOPIUUCLI-PLNGDYQASA-N 1 1 338.383 2.160 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC/C=C/CNc1cccc(F)c1[N+](=O)[O-] ZINC001107321617 786859012 /nfs/dbraw/zinc/85/90/12/786859012.db2.gz HNGALVOPIUUCLI-SNAWJCMRSA-N 1 1 338.383 2.160 20 5 EEBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CC1CCOCC1 ZINC000129640993 789287132 /nfs/dbraw/zinc/28/71/32/789287132.db2.gz JKOBMIKLLPZTPS-UHFFFAOYSA-N 1 1 339.367 2.421 20 5 EEBDMO CC(=O)OC1CC[NH+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000153588048 795948228 /nfs/dbraw/zinc/94/82/28/795948228.db2.gz NNRCTOIWZSWMCQ-UHFFFAOYSA-N 1 1 346.343 2.172 20 5 EEBDMO CC(C)C(=O)N[C@@H]1[C@H]2C[N@H+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)C[C@H]21 ZINC001173224877 797309208 /nfs/dbraw/zinc/30/92/08/797309208.db2.gz IOVJQZDFYQBCJG-KKBVYLPWSA-N 1 1 331.416 2.228 20 5 EEBDMO O=C(NCCCCCC[NH2+]Cc1ccc(F)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001178458659 799484088 /nfs/dbraw/zinc/48/40/88/799484088.db2.gz QLBNNAGTFXOFOR-HZPDHXFCSA-N 1 1 337.395 2.257 20 5 EEBDMO C[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CCN1C(=O)OC(C)(C)C ZINC001169011717 803571104 /nfs/dbraw/zinc/57/11/04/803571104.db2.gz MHYJJSHQWYHBTE-MCIONIFRSA-N 1 1 327.425 2.373 20 5 EEBDMO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169037178 803580813 /nfs/dbraw/zinc/58/08/13/803580813.db2.gz QZHZUODDWXYGON-MGPQQGTHSA-N 1 1 327.425 2.373 20 5 EEBDMO O=C1NC[C@H](c2ccccc2)[C@]12CC[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169018187 803586369 /nfs/dbraw/zinc/58/63/69/803586369.db2.gz CBTJUARQTABEJR-KNIMUDFMSA-N 1 1 343.427 2.038 20 5 EEBDMO COc1cccc(O[C@@H]2CCC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)n1 ZINC001169050660 803595281 /nfs/dbraw/zinc/59/52/81/803595281.db2.gz CGFXXDFQKMKNSY-SOUVJXGZSA-N 1 1 335.404 2.379 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CC[C@@H](n3cc(Br)cn3)C2)C1 ZINC001169054383 803597093 /nfs/dbraw/zinc/59/70/93/803597093.db2.gz LPVMQKUDXSRIMZ-WCFLWFBJSA-N 1 1 343.225 2.338 20 5 EEBDMO Cc1nn(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c2ncc([N+](=O)[O-])cc12 ZINC000789509349 808033700 /nfs/dbraw/zinc/03/37/00/808033700.db2.gz UMCAPBRSTZHVPL-GJZGRUSLSA-N 1 1 331.376 2.249 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)C[C@@H]21 ZINC000333221184 539801862 /nfs/dbraw/zinc/80/18/62/539801862.db2.gz WBPOXGWPOUBBHL-KUHUBIRLSA-N 1 1 347.418 2.457 20 5 EEBDMO COc1cc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc([N+](=O)[O-])c1C ZINC000189498044 236961519 /nfs/dbraw/zinc/96/15/19/236961519.db2.gz SOFLHQDRKGKSLH-DZGCQCFKSA-N 1 1 347.415 2.468 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOC(C)(C)C1 ZINC000030196628 201065883 /nfs/dbraw/zinc/06/58/83/201065883.db2.gz BLBFOUVLWQONEE-UHFFFAOYSA-N 1 1 337.376 2.043 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC000426930818 241358156 /nfs/dbraw/zinc/35/81/56/241358156.db2.gz FFMLNKJYBHCERF-OLZOCXBDSA-N 1 1 335.404 2.454 20 5 EEBDMO C[NH+](C)CC(=O)Nc1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000073305278 203263079 /nfs/dbraw/zinc/26/30/79/203263079.db2.gz CXCPFTVELHXVRH-UHFFFAOYSA-N 1 1 348.384 2.409 20 5 EEBDMO COc1ccc(NC(=O)NCC[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000459539532 245160859 /nfs/dbraw/zinc/16/08/59/245160859.db2.gz UDHHHHOHLBYOFV-LBPRGKRZSA-N 1 1 336.392 2.457 20 5 EEBDMO C[NH+](C)Cc1cnc(CN2CC(Oc3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000459625717 245191777 /nfs/dbraw/zinc/19/17/77/245191777.db2.gz YDWJMGQUQONESO-UHFFFAOYSA-N 1 1 348.428 2.376 20 5 EEBDMO O=[N+]([O-])c1cc(Br)ccc1NCCC[NH+]1CCOCC1 ZINC000037387660 204263759 /nfs/dbraw/zinc/26/37/59/204263759.db2.gz RHSCGSDERXNMPG-UHFFFAOYSA-N 1 1 344.209 2.492 20 5 EEBDMO CSCC[C@H](C)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000126333490 205050843 /nfs/dbraw/zinc/05/08/43/205050843.db2.gz ZQJWAORQBLOEBQ-JSGCOSHPSA-N 1 1 328.434 2.408 20 5 EEBDMO CCC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCOC ZINC000130949243 205265673 /nfs/dbraw/zinc/26/56/73/205265673.db2.gz DJVRWIWLMZVXOP-INIZCTEOSA-N 1 1 335.404 2.168 20 5 EEBDMO Cc1c(C[N@H+](C)C[C@H](O)COCCOC(C)C)cccc1[N+](=O)[O-] ZINC000265220033 247309874 /nfs/dbraw/zinc/30/98/74/247309874.db2.gz GOBLQIDUVGBJGG-INIZCTEOSA-N 1 1 340.420 2.138 20 5 EEBDMO C[C@H]1CSCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000249028701 206328783 /nfs/dbraw/zinc/32/87/83/206328783.db2.gz LTZCIUQGVYCFRP-CHWSQXEVSA-N 1 1 326.418 2.019 20 5 EEBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000266010129 248025709 /nfs/dbraw/zinc/02/57/09/248025709.db2.gz PYBWCZPVELHDQJ-CYBMUJFWSA-N 1 1 346.431 2.265 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CC[C@H](CN3CCOCC3)C2)c1 ZINC000266031443 248047003 /nfs/dbraw/zinc/04/70/03/248047003.db2.gz SBHULYJJMQNSDU-CYBMUJFWSA-N 1 1 339.823 2.402 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CC[C@H](CN3CCOCC3)C2)c1 ZINC000266031443 248047008 /nfs/dbraw/zinc/04/70/08/248047008.db2.gz SBHULYJJMQNSDU-CYBMUJFWSA-N 1 1 339.823 2.402 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C[N@H+]1Cc1ccccc1 ZINC000268126612 256116333 /nfs/dbraw/zinc/11/63/33/256116333.db2.gz DABPIYCOYSCYAO-OCCSQVGLSA-N 1 1 328.372 2.316 20 5 EEBDMO COc1cc(C[NH2+]C[C@](C)(O)C(F)(F)F)c([N+](=O)[O-])cc1OC ZINC000270562907 256148654 /nfs/dbraw/zinc/14/86/54/256148654.db2.gz QLNILVPICJIYMM-LBPRGKRZSA-N 1 1 338.282 2.015 20 5 EEBDMO C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1cnn(C)c1 ZINC000273407437 256293828 /nfs/dbraw/zinc/29/38/28/256293828.db2.gz SGIGYGIPMCYWRB-VIFPVBQESA-N 1 1 337.767 2.271 20 5 EEBDMO CC(C)(C)C[N@@H+](CCCO)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000273421642 256295092 /nfs/dbraw/zinc/29/50/92/256295092.db2.gz YYSLCBVGTGGYBB-AWEZNQCLSA-N 1 1 340.420 2.065 20 5 EEBDMO CC[C@@H](O)[C@H]1CCCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000114459771 140760679 /nfs/dbraw/zinc/76/06/79/140760679.db2.gz LJKHTMMYKCKDEQ-UKRRQHHQSA-N 1 1 335.404 2.467 20 5 EEBDMO CC[C@@H](O)[C@H]1CCCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000114459771 140760681 /nfs/dbraw/zinc/76/06/81/140760681.db2.gz LJKHTMMYKCKDEQ-UKRRQHHQSA-N 1 1 335.404 2.467 20 5 EEBDMO CC(C)[N@@H+]1C[C@H](NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)[C@@H](C)C1 ZINC000125610183 292298332 /nfs/dbraw/zinc/29/83/32/292298332.db2.gz RSKSRHKJNLWJEZ-BBRMVZONSA-N 1 1 346.431 2.391 20 5 EEBDMO CCOc1cc(NCCC[NH+]2CCN(CC)CC2)ccc1[N+](=O)[O-] ZINC000092607663 159224143 /nfs/dbraw/zinc/22/41/43/159224143.db2.gz IKMMEXXNHCJMHN-UHFFFAOYSA-N 1 1 336.436 2.433 20 5 EEBDMO O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000106787519 159321265 /nfs/dbraw/zinc/32/12/65/159321265.db2.gz SFYPXRCOBUOBQD-ZDUSSCGKSA-N 1 1 333.388 2.107 20 5 EEBDMO CC[N@@H+](CCNC(=O)NCc1cc([N+](=O)[O-])ccc1OC)C(C)C ZINC000338829582 160805261 /nfs/dbraw/zinc/80/52/61/160805261.db2.gz MKNSUKCXOIZDQX-UHFFFAOYSA-N 1 1 338.408 2.133 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3C[C@@H]4CC[C@H](O)[C@@H]4C3)co2)cc1 ZINC000344062288 161194766 /nfs/dbraw/zinc/19/47/66/161194766.db2.gz NDRJKEKROGIXGQ-MAZHCROVSA-N 1 1 329.356 2.453 20 5 EEBDMO CCCc1n[nH]c(C(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000344722176 161239605 /nfs/dbraw/zinc/23/96/05/161239605.db2.gz JEYADLYDFZOOAZ-GFCCVEGCSA-N 1 1 349.435 2.217 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[N@@H+](C3CCC3)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000344722176 161239606 /nfs/dbraw/zinc/23/96/06/161239606.db2.gz JEYADLYDFZOOAZ-GFCCVEGCSA-N 1 1 349.435 2.217 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000344722176 161239607 /nfs/dbraw/zinc/23/96/07/161239607.db2.gz JEYADLYDFZOOAZ-GFCCVEGCSA-N 1 1 349.435 2.217 20 5 EEBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)CN1CCN(C)CC1 ZINC000344844886 161250654 /nfs/dbraw/zinc/25/06/54/161250654.db2.gz CSIWDLJHUICMMQ-UVQBRAAOSA-N 1 1 332.448 2.224 20 5 EEBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000344946641 161258455 /nfs/dbraw/zinc/25/84/55/161258455.db2.gz XGOSWMOEWZLBPM-VXGBXAGGSA-N 1 1 339.417 2.037 20 5 EEBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000352574332 162195478 /nfs/dbraw/zinc/19/54/78/162195478.db2.gz GDRXZFLBOZQXFS-CYBMUJFWSA-N 1 1 343.449 2.302 20 5 EEBDMO Cc1cc(CNC(=O)c2ccc([N+](=O)[O-])n2C)cc(N2CCCC2)[nH+]1 ZINC000355524330 163219138 /nfs/dbraw/zinc/21/91/38/163219138.db2.gz UOACRRQFGBNXNS-UHFFFAOYSA-N 1 1 343.387 2.167 20 5 EEBDMO CNc1c(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)cccc1[N+](=O)[O-] ZINC000356272816 163387877 /nfs/dbraw/zinc/38/78/77/163387877.db2.gz DCWAMRBHPXFFRW-QGZVFWFLSA-N 1 1 332.404 2.194 20 5 EEBDMO COc1ccc(NC(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000360407729 164302771 /nfs/dbraw/zinc/30/27/71/164302771.db2.gz OVWOSRZNZWPFIE-QWHCGFSZSA-N 1 1 334.376 2.352 20 5 EEBDMO O=C1[C@@H]([N@@H+]2CCOCC3(CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000368107133 166051486 /nfs/dbraw/zinc/05/14/86/166051486.db2.gz KFPFCAAACLCPNO-INIZCTEOSA-N 1 1 345.399 2.203 20 5 EEBDMO O=C1[C@@H]([N@H+]2CCOCC3(CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000368107133 166051488 /nfs/dbraw/zinc/05/14/88/166051488.db2.gz KFPFCAAACLCPNO-INIZCTEOSA-N 1 1 345.399 2.203 20 5 EEBDMO COc1cc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc([N+](=O)[O-])c1C ZINC000364478917 165151981 /nfs/dbraw/zinc/15/19/81/165151981.db2.gz OWCHPOWXWMPPFN-ZIAGYGMSSA-N 1 1 333.388 2.268 20 5 EEBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000369793241 166332070 /nfs/dbraw/zinc/33/20/70/166332070.db2.gz KINHYWSYGCMKSG-HUUCEWRRSA-N 1 1 332.404 2.063 20 5 EEBDMO Cc1ccccc1C[N@H+]1CCCN(CCn2cc([N+](=O)[O-])cn2)CC1 ZINC000370000603 166373377 /nfs/dbraw/zinc/37/33/77/166373377.db2.gz ZBFCGYIRIRCBPI-UHFFFAOYSA-N 1 1 343.431 2.308 20 5 EEBDMO O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000376622887 167362626 /nfs/dbraw/zinc/36/26/26/167362626.db2.gz YCAHTMZOHRDWIX-CYBMUJFWSA-N 1 1 333.388 2.107 20 5 EEBDMO CC[N@H+]1CCC[C@@H](CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000122181460 222032439 /nfs/dbraw/zinc/03/24/39/222032439.db2.gz ICORSAMKCGPHSO-LBPRGKRZSA-N 1 1 341.433 2.142 20 5 EEBDMO CCC(=O)c1ccc(N2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)c([N+](=O)[O-])c1 ZINC000375662437 273601067 /nfs/dbraw/zinc/60/10/67/273601067.db2.gz GJCSLQBWKVMFDW-CRAIPNDOSA-N 1 1 347.415 2.223 20 5 EEBDMO C[NH+](C)Cc1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)cc1Cl ZINC000279966867 274564198 /nfs/dbraw/zinc/56/41/98/274564198.db2.gz JBCIVYHWOKRNEQ-UHFFFAOYSA-N 1 1 337.767 2.145 20 5 EEBDMO NC(=O)c1ccc(N2CC[NH+](Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000058159148 274940708 /nfs/dbraw/zinc/94/07/08/274940708.db2.gz SGASQDIVDMGFDN-UHFFFAOYSA-N 1 1 340.383 2.016 20 5 EEBDMO O=C1[C@H]([N@@H+]2CCOCC3(CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000368107234 275029460 /nfs/dbraw/zinc/02/94/60/275029460.db2.gz KFPFCAAACLCPNO-MRXNPFEDSA-N 1 1 345.399 2.203 20 5 EEBDMO O=C1[C@H]([N@H+]2CCOCC3(CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000368107234 275029462 /nfs/dbraw/zinc/02/94/62/275029462.db2.gz KFPFCAAACLCPNO-MRXNPFEDSA-N 1 1 345.399 2.203 20 5 EEBDMO COc1ccc2c(c1)C1(CC1)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C2 ZINC000289430503 275115493 /nfs/dbraw/zinc/11/54/93/275115493.db2.gz CTXRTVIYAULMTQ-UHFFFAOYSA-N 1 1 328.372 2.347 20 5 EEBDMO COc1ccc2c(c1)C1(CC1)C[N@H+](CCn1cc([N+](=O)[O-])cn1)C2 ZINC000289430503 275115494 /nfs/dbraw/zinc/11/54/94/275115494.db2.gz CTXRTVIYAULMTQ-UHFFFAOYSA-N 1 1 328.372 2.347 20 5 EEBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CCC[C@H](C3CC3)C2)cc1 ZINC000289446432 275116439 /nfs/dbraw/zinc/11/64/39/275116439.db2.gz OVKBZRDTCZDKSN-AWEZNQCLSA-N 1 1 338.429 2.491 20 5 EEBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CCC[C@H](C3CC3)C2)cc1 ZINC000289446432 275116440 /nfs/dbraw/zinc/11/64/40/275116440.db2.gz OVKBZRDTCZDKSN-AWEZNQCLSA-N 1 1 338.429 2.491 20 5 EEBDMO CC(C)[C@@](C)([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(N)=O ZINC000289468938 275118652 /nfs/dbraw/zinc/11/86/52/275118652.db2.gz YXANDFJKQOTTPQ-MRXNPFEDSA-N 1 1 332.360 2.239 20 5 EEBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1[nH]nc(CCC)c1[N+](=O)[O-] ZINC000290451660 275208653 /nfs/dbraw/zinc/20/86/53/275208653.db2.gz BUKPISZTYHBHQJ-LLVKDONJSA-N 1 1 325.413 2.121 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000290908804 275251360 /nfs/dbraw/zinc/25/13/60/275251360.db2.gz LLDRADIFOHTTIV-LBPRGKRZSA-N 1 1 341.383 2.349 20 5 EEBDMO COc1cc(C[N@@H+]2CC[C@H](n3cccn3)C2)c([N+](=O)[O-])cc1OC ZINC000291294969 275291308 /nfs/dbraw/zinc/29/13/08/275291308.db2.gz PZBWWGXBGFMVJR-ZDUSSCGKSA-N 1 1 332.360 2.256 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@H](n3cccn3)C2)c([N+](=O)[O-])cc1OC ZINC000291294969 275291310 /nfs/dbraw/zinc/29/13/10/275291310.db2.gz PZBWWGXBGFMVJR-ZDUSSCGKSA-N 1 1 332.360 2.256 20 5 EEBDMO C[C@H]1CN(c2cccc(F)c2)CC[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000292060177 275369845 /nfs/dbraw/zinc/36/98/45/275369845.db2.gz BOLQCBKVAIISMJ-ZDUSSCGKSA-N 1 1 333.367 2.141 20 5 EEBDMO C[C@H]1CN(c2cccc(F)c2)CC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000292060177 275369847 /nfs/dbraw/zinc/36/98/47/275369847.db2.gz BOLQCBKVAIISMJ-ZDUSSCGKSA-N 1 1 333.367 2.141 20 5 EEBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000345668316 278366170 /nfs/dbraw/zinc/36/61/70/278366170.db2.gz SGAMTCHLEOELCS-LBPRGKRZSA-N 1 1 328.372 2.309 20 5 EEBDMO C[C@@H]1CN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C ZINC000293284423 293170083 /nfs/dbraw/zinc/17/00/83/293170083.db2.gz CTSODVSRLIDFRN-PHIMTYICSA-N 1 1 340.811 2.211 20 5 EEBDMO Cc1nc(N2CC[N@H+](Cc3ccccc3)C[C@H]2C)ncc1[N+](=O)[O-] ZINC000297130090 294159863 /nfs/dbraw/zinc/15/98/63/294159863.db2.gz MYVFTWFGJXLSDS-CYBMUJFWSA-N 1 1 327.388 2.404 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)OC[C@H]1C ZINC000297943062 294379330 /nfs/dbraw/zinc/37/93/30/294379330.db2.gz SCAXDENRAGRHMY-NEPJUHHUSA-N 1 1 337.376 2.041 20 5 EEBDMO O=[N+]([O-])c1cccnc1NCCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000299550584 294771311 /nfs/dbraw/zinc/77/13/11/294771311.db2.gz LGDLFHODUCBOGN-UHFFFAOYSA-N 1 1 342.403 2.009 20 5 EEBDMO CC(C)[N@@H+]1CCO[C@H](c2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)C1 ZINC000351191234 312370742 /nfs/dbraw/zinc/37/07/42/312370742.db2.gz OTPBPIFWXCOITB-ZDUSSCGKSA-N 1 1 333.348 2.009 20 5 EEBDMO CC(C)[N@H+]1CCO[C@H](c2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)C1 ZINC000351191234 312370743 /nfs/dbraw/zinc/37/07/43/312370743.db2.gz OTPBPIFWXCOITB-ZDUSSCGKSA-N 1 1 333.348 2.009 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)C[C@H](CO)C2)cccc1[N+](=O)[O-] ZINC000420947647 314006522 /nfs/dbraw/zinc/00/65/22/314006522.db2.gz UEILNLCKAFEIOO-OCCSQVGLSA-N 1 1 335.404 2.182 20 5 EEBDMO CC[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](CC)O1 ZINC000420956026 314008744 /nfs/dbraw/zinc/00/87/44/314008744.db2.gz MMGOOVXPICXNTO-KFWWJZLASA-N 1 1 338.404 2.224 20 5 EEBDMO CC[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](CC)O1 ZINC000420956026 314008747 /nfs/dbraw/zinc/00/87/47/314008747.db2.gz MMGOOVXPICXNTO-KFWWJZLASA-N 1 1 338.404 2.224 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+](CCc1ccccc1)[C@H]1CCOC1 ZINC000437510857 315038493 /nfs/dbraw/zinc/03/84/93/315038493.db2.gz ACEVXKLWGWIAEG-HNNXBMFYSA-N 1 1 330.388 2.162 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+](CCc1ccccc1)[C@H]1CCOC1 ZINC000437510857 315038496 /nfs/dbraw/zinc/03/84/96/315038496.db2.gz ACEVXKLWGWIAEG-HNNXBMFYSA-N 1 1 330.388 2.162 20 5 EEBDMO CO[C@@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)[C@@H](C)C1 ZINC000441376042 315183771 /nfs/dbraw/zinc/18/37/71/315183771.db2.gz IZOMSUHBDFYLPG-GXTWGEPZSA-N 1 1 349.387 2.392 20 5 EEBDMO COc1ccc(CC(=O)Nc2cc[nH+]c(N(C)C)c2)cc1[N+](=O)[O-] ZINC000531363017 317789413 /nfs/dbraw/zinc/78/94/13/317789413.db2.gz FVMPLVNMYNRZEM-UHFFFAOYSA-N 1 1 330.344 2.246 20 5 EEBDMO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)NCc1ccccc1 ZINC000567001345 319339261 /nfs/dbraw/zinc/33/92/61/319339261.db2.gz PJFTYYGEKCCGJU-UHFFFAOYSA-N 1 1 343.383 2.222 20 5 EEBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)NCc1ccccc1 ZINC000567001345 319339264 /nfs/dbraw/zinc/33/92/64/319339264.db2.gz PJFTYYGEKCCGJU-UHFFFAOYSA-N 1 1 343.383 2.222 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000354630678 465064395 /nfs/dbraw/zinc/06/43/95/465064395.db2.gz VTOIUIQQVKXDKR-OLZOCXBDSA-N 1 1 341.433 2.088 20 5 EEBDMO CC(=O)NCC[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000347658571 465153522 /nfs/dbraw/zinc/15/35/22/465153522.db2.gz WDBCCWGMNMOVFA-OAHLLOKOSA-N 1 1 335.404 2.212 20 5 EEBDMO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000354826602 465174951 /nfs/dbraw/zinc/17/49/51/465174951.db2.gz IOPDSGHWZFIXOQ-HSMVNMDESA-N 1 1 348.378 2.299 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CCO)[C@@H]1CC[C@H](C)C1 ZINC000351652861 465274119 /nfs/dbraw/zinc/27/41/19/465274119.db2.gz SZUHAFXCNXQOLT-GXTWGEPZSA-N 1 1 335.404 2.325 20 5 EEBDMO CCCC[N@H+](C)C[C@H](C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000341945554 465276821 /nfs/dbraw/zinc/27/68/21/465276821.db2.gz OQQQQUAMUZKUME-NSHDSACASA-N 1 1 347.412 2.133 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000341945554 465276822 /nfs/dbraw/zinc/27/68/22/465276822.db2.gz OQQQQUAMUZKUME-NSHDSACASA-N 1 1 347.412 2.133 20 5 EEBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1ccc(N)c([N+](=O)[O-])n1 ZINC000590571434 468276322 /nfs/dbraw/zinc/27/63/22/468276322.db2.gz FSSCZJCFKOJDOF-UHFFFAOYSA-N 1 1 329.404 3.024 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@H](CNC(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000087008050 462582616 /nfs/dbraw/zinc/58/26/16/462582616.db2.gz CPHRVECNZKHWTM-QGZVFWFLSA-N 1 1 349.431 2.000 20 5 EEBDMO Cc1cc(C)c(OC[C@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000153650834 462675004 /nfs/dbraw/zinc/67/50/04/462675004.db2.gz OHIASTZXHGXXLX-RBSFLKMASA-N 1 1 338.404 2.061 20 5 EEBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000115443560 462715439 /nfs/dbraw/zinc/71/54/39/462715439.db2.gz NCBCMKCIVORXPU-CQSZACIVSA-N 1 1 334.420 2.197 20 5 EEBDMO C[C@H](Nc1ccc(Br)cc1[N+](=O)[O-])[C@H]1C[N@H+](C)CCO1 ZINC000154770254 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JLZAEXHNFSYYKV-ZDUSSCGKSA-N 1 1 336.310 2.011 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CCC(F)(F)F)C[C@H](O)CO ZINC000350009031 466348235 /nfs/dbraw/zinc/34/82/35/466348235.db2.gz JLZAEXHNFSYYKV-ZDUSSCGKSA-N 1 1 336.310 2.011 20 5 EEBDMO C[C@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@@H](C)CO1 ZINC000332056972 466364999 /nfs/dbraw/zinc/36/49/99/466364999.db2.gz OXTDNTRWFRJRDP-RYUDHWBXSA-N 1 1 335.360 2.002 20 5 EEBDMO C[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@@H](C)CO1 ZINC000332056972 466365007 /nfs/dbraw/zinc/36/50/07/466365007.db2.gz OXTDNTRWFRJRDP-RYUDHWBXSA-N 1 1 335.360 2.002 20 5 EEBDMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[N@H+](CC(C)(C)O)[C@@H](C)C1 ZINC000340866866 466397533 /nfs/dbraw/zinc/39/75/33/466397533.db2.gz KLBUFFROZLIKRO-LBPRGKRZSA-N 1 1 335.404 2.079 20 5 EEBDMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[N@@H+](CC(C)(C)O)[C@@H](C)C1 ZINC000340866866 466397542 /nfs/dbraw/zinc/39/75/42/466397542.db2.gz KLBUFFROZLIKRO-LBPRGKRZSA-N 1 1 335.404 2.079 20 5 EEBDMO CCC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CC(=O)N(C)C1=O ZINC000338963862 466526973 /nfs/dbraw/zinc/52/69/73/466526973.db2.gz RAHGYANXMZQWSS-VFADXPBXSA-N 1 1 331.372 2.077 20 5 EEBDMO CCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CC(=O)N(C)C1=O ZINC000338963862 466526980 /nfs/dbraw/zinc/52/69/80/466526980.db2.gz RAHGYANXMZQWSS-VFADXPBXSA-N 1 1 331.372 2.077 20 5 EEBDMO C[C@@H]1COc2ccccc2C[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000374657729 466707294 /nfs/dbraw/zinc/70/72/94/466707294.db2.gz ABAIPYURNMFFPA-CYBMUJFWSA-N 1 1 329.356 2.040 20 5 EEBDMO C[C@@H]1COc2ccccc2C[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000374657729 466707295 /nfs/dbraw/zinc/70/72/95/466707295.db2.gz ABAIPYURNMFFPA-CYBMUJFWSA-N 1 1 329.356 2.040 20 5 EEBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000364914036 466721089 /nfs/dbraw/zinc/72/10/89/466721089.db2.gz IIFGDKMLFBNUIZ-MRXNPFEDSA-N 1 1 326.356 2.094 20 5 EEBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000364914036 466721092 /nfs/dbraw/zinc/72/10/92/466721092.db2.gz IIFGDKMLFBNUIZ-MRXNPFEDSA-N 1 1 326.356 2.094 20 5 EEBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c1 ZINC000373205566 466727780 /nfs/dbraw/zinc/72/77/80/466727780.db2.gz UIIWRJSDYAVNFU-QZTJIDSGSA-N 1 1 346.358 2.361 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@](O)(C2CC2)C1 ZINC000373228828 466735165 /nfs/dbraw/zinc/73/51/65/466735165.db2.gz JGAQXSXMTHMLHM-KRWDZBQOSA-N 1 1 333.388 2.079 20 5 EEBDMO Cc1c(CC(=O)N2CC[NH2+]C[C@H]2c2cccnc2)cccc1[N+](=O)[O-] ZINC000423616787 466787583 /nfs/dbraw/zinc/78/75/83/466787583.db2.gz SIOIEXBVOKRKSX-KRWDZBQOSA-N 1 1 340.383 2.014 20 5 EEBDMO CC(C)OC(=O)[C@H](C)[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411322954 466806819 /nfs/dbraw/zinc/80/68/19/466806819.db2.gz WYNBPMTYGTVJTM-LBPRGKRZSA-N 1 1 337.376 2.195 20 5 EEBDMO CC(C)OC(=O)[C@H](C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411322954 466806821 /nfs/dbraw/zinc/80/68/21/466806821.db2.gz WYNBPMTYGTVJTM-LBPRGKRZSA-N 1 1 337.376 2.195 20 5 EEBDMO CCOC(=O)c1cc(NC[C@H]2C[N@H+]3CCC[C@H]3CO2)ccc1[N+](=O)[O-] ZINC000373676366 466885149 /nfs/dbraw/zinc/88/51/49/466885149.db2.gz WEMRIIRJPKHNKS-KBPBESRZSA-N 1 1 349.387 2.047 20 5 EEBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000411965635 466950620 /nfs/dbraw/zinc/95/06/20/466950620.db2.gz KIVOHVLHZVCZMT-GOSISDBHSA-N 1 1 325.368 2.224 20 5 EEBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C(C)(C)CN1CCOCC1 ZINC000412087489 467002979 /nfs/dbraw/zinc/00/29/79/467002979.db2.gz GZMMWGKNSFSMAQ-UHFFFAOYSA-N 1 1 337.420 2.016 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1CN1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC000425497431 467099330 /nfs/dbraw/zinc/09/93/30/467099330.db2.gz CPRVESXTZVMEOV-JKSUJKDBSA-N 1 1 341.415 2.035 20 5 EEBDMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c2ncccc12 ZINC000419002700 467160819 /nfs/dbraw/zinc/16/08/19/467160819.db2.gz PWLLGJNQRNEWDB-STQMWFEESA-N 1 1 330.388 2.034 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@@H+]2CCCO)c2cccnc21 ZINC000413328780 467216868 /nfs/dbraw/zinc/21/68/68/467216868.db2.gz OAINWDIFELTDMJ-ZDUSSCGKSA-N 1 1 330.388 2.402 20 5 EEBDMO COCC(COC)[NH+]1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000413472338 467249413 /nfs/dbraw/zinc/24/94/13/467249413.db2.gz KDQPZDRAICTDIA-UHFFFAOYSA-N 1 1 343.811 2.032 20 5 EEBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H](O)COCC(F)(F)F)C1CC1 ZINC000432775842 467263070 /nfs/dbraw/zinc/26/30/70/467263070.db2.gz KLEPJQYTEJHZOW-ZDUSSCGKSA-N 1 1 348.321 2.499 20 5 EEBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429018806 467291836 /nfs/dbraw/zinc/29/18/36/467291836.db2.gz IAMCSJWRNGYNKZ-KEYYUXOJSA-N 1 1 346.431 2.195 20 5 EEBDMO CN(CCC(=O)Nc1ccccc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000420322544 467356490 /nfs/dbraw/zinc/35/64/90/467356490.db2.gz SRDPBLHKWXICKS-PBWFPOADSA-N 1 1 332.404 2.138 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)CN1CCOCC1 ZINC000434697905 467420308 /nfs/dbraw/zinc/42/03/08/467420308.db2.gz BXCFELCKBPDAKI-CQSZACIVSA-N 1 1 337.420 2.146 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)CN1CCOCC1 ZINC000434697905 467420312 /nfs/dbraw/zinc/42/03/12/467420312.db2.gz BXCFELCKBPDAKI-CQSZACIVSA-N 1 1 337.420 2.146 20 5 EEBDMO C[C@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])C[NH+]1CCOCC1 ZINC000436384105 467533040 /nfs/dbraw/zinc/53/30/40/467533040.db2.gz FQFHBDBEOSSVEO-SNVBAGLBSA-N 1 1 348.325 2.389 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C[C@H](O)C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449738339 467704213 /nfs/dbraw/zinc/70/42/13/467704213.db2.gz BDRTWGIHRBYWTH-HOTGVXAUSA-N 1 1 330.388 2.168 20 5 EEBDMO COc1cc(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000457095803 467751446 /nfs/dbraw/zinc/75/14/46/467751446.db2.gz QIEUGFLJRZRVSK-NSHDSACASA-N 1 1 339.367 2.297 20 5 EEBDMO CC(C)(O)C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1CCOCC1 ZINC000531416220 468050677 /nfs/dbraw/zinc/05/06/77/468050677.db2.gz XNMOHEINNWLJGE-UHFFFAOYSA-N 1 1 338.404 2.226 20 5 EEBDMO C[C@@H]1[C@H](CO)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000488761109 468102663 /nfs/dbraw/zinc/10/26/63/468102663.db2.gz FSTNYYYYGPTDDR-OCCSQVGLSA-N 1 1 331.372 2.495 20 5 EEBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000520314407 468242226 /nfs/dbraw/zinc/24/22/26/468242226.db2.gz DLXLGGQJIPCWHR-LLVKDONJSA-N 1 1 337.376 2.174 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000520710196 468266147 /nfs/dbraw/zinc/26/61/47/468266147.db2.gz TYYJHDMSJKUWQZ-CYBMUJFWSA-N 1 1 331.376 2.171 20 5 EEBDMO COc1cc(C(=O)NC[C@@H]2CCCC[N@@H+](C)C2)c([N+](=O)[O-])cc1F ZINC000600312327 468528835 /nfs/dbraw/zinc/52/88/35/468528835.db2.gz FEEPDNUSRAHKJF-NSHDSACASA-N 1 1 339.367 2.204 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H]1CC[N@H+](C(C)(C)C)C1 ZINC000594802253 468692094 /nfs/dbraw/zinc/69/20/94/468692094.db2.gz WOCMVPMWKXGIPI-GFCCVEGCSA-N 1 1 341.433 2.054 20 5 EEBDMO CNc1c(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000597861854 468697358 /nfs/dbraw/zinc/69/73/58/468697358.db2.gz XHTOUBANEJAXEQ-LBPRGKRZSA-N 1 1 334.420 2.487 20 5 EEBDMO COCC(C)(C)[NH+]1CCN(C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000584287780 468837179 /nfs/dbraw/zinc/83/71/79/468837179.db2.gz HPFOSKRGXPKDGA-CQSZACIVSA-N 1 1 349.431 2.268 20 5 EEBDMO C[C@@H]1[C@H](C)N(C(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C ZINC000593187950 468899343 /nfs/dbraw/zinc/89/93/43/468899343.db2.gz WKIQPOPTRRMZFG-MJBXVCDLSA-N 1 1 335.404 2.303 20 5 EEBDMO COC(=O)c1ccnc(N[C@@H]2C[N@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000598609259 468931952 /nfs/dbraw/zinc/93/19/52/468931952.db2.gz WJBABIBENAUWID-CQSZACIVSA-N 1 1 342.355 2.375 20 5 EEBDMO COC(=O)c1ccnc(N[C@@H]2C[N@@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000598609259 468931955 /nfs/dbraw/zinc/93/19/55/468931955.db2.gz WJBABIBENAUWID-CQSZACIVSA-N 1 1 342.355 2.375 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000602803917 469086589 /nfs/dbraw/zinc/08/65/89/469086589.db2.gz GZDDLTJCOZDLNS-OAHLLOKOSA-N 1 1 334.351 2.392 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000602843317 469112575 /nfs/dbraw/zinc/11/25/75/469112575.db2.gz GMZBAJMYEDHGQP-HNNXBMFYSA-N 1 1 343.431 2.306 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21 ZINC000602997485 469212817 /nfs/dbraw/zinc/21/28/17/469212817.db2.gz LHAURXHQJQGHHF-YCPHGPKFSA-N 1 1 347.415 2.467 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21 ZINC000602997485 469212822 /nfs/dbraw/zinc/21/28/22/469212822.db2.gz LHAURXHQJQGHHF-YCPHGPKFSA-N 1 1 347.415 2.467 20 5 EEBDMO O=[N+]([O-])c1ncccc1NCc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000611617953 469293774 /nfs/dbraw/zinc/29/37/74/469293774.db2.gz DQTWFUARKSUQSI-OAHLLOKOSA-N 1 1 328.372 2.169 20 5 EEBDMO O=[N+]([O-])c1ccc(CN2CC[NH+]([C@@H]3CCOC3)CC2)c(Cl)c1 ZINC000611792637 469324401 /nfs/dbraw/zinc/32/44/01/469324401.db2.gz BQPMWHPHUBXKMI-CQSZACIVSA-N 1 1 325.796 2.155 20 5 EEBDMO COc1ncc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000602475316 469332392 /nfs/dbraw/zinc/33/23/92/469332392.db2.gz SOPMTLOVOBUMKX-JTQLQIEISA-N 1 1 335.389 2.141 20 5 EEBDMO COc1ncc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000602475316 469332396 /nfs/dbraw/zinc/33/23/96/469332396.db2.gz SOPMTLOVOBUMKX-JTQLQIEISA-N 1 1 335.389 2.141 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[N@@H+]3CCOC[C@H]3C2)nc1-c1ccccc1 ZINC000612451362 469469976 /nfs/dbraw/zinc/46/99/76/469469976.db2.gz ZRPYLHHERXZTKJ-OAHLLOKOSA-N 1 1 340.383 2.178 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[N@H+]3CCOC[C@H]3C2)nc1-c1ccccc1 ZINC000612451362 469469980 /nfs/dbraw/zinc/46/99/80/469469980.db2.gz ZRPYLHHERXZTKJ-OAHLLOKOSA-N 1 1 340.383 2.178 20 5 EEBDMO C[C@@H]1[C@@H](C)[C@H](C)C[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000419394545 485685937 /nfs/dbraw/zinc/68/59/37/485685937.db2.gz PLIQNKFBMQSQCT-OUAUKWLOSA-N 1 1 335.360 2.238 20 5 EEBDMO O=C(CC[N@@H+]1CCC[C@H]1c1ncc[nH]1)Nc1ccccc1[N+](=O)[O-] ZINC000411427561 534403269 /nfs/dbraw/zinc/40/32/69/534403269.db2.gz IUBMNFDANQPFEG-AWEZNQCLSA-N 1 1 329.360 2.484 20 5 EEBDMO O=C(CC[N@H+]1CCC[C@H]1c1ncc[nH]1)Nc1ccccc1[N+](=O)[O-] ZINC000411427561 534403277 /nfs/dbraw/zinc/40/32/77/534403277.db2.gz IUBMNFDANQPFEG-AWEZNQCLSA-N 1 1 329.360 2.484 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000111352976 535489442 /nfs/dbraw/zinc/48/94/42/535489442.db2.gz FEUWQSYERCOZGF-CQSZACIVSA-N 1 1 341.433 2.056 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000456380931 536134736 /nfs/dbraw/zinc/13/47/36/536134736.db2.gz NNOSWGBBIMCHNN-AWEZNQCLSA-N 1 1 335.404 2.225 20 5 EEBDMO CC(C)[N@@H+](CC1CC1)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000726586622 576277957 /nfs/dbraw/zinc/27/79/57/576277957.db2.gz LPRXKRUWBLJIBI-UHFFFAOYSA-N 1 1 346.387 2.441 20 5 EEBDMO CC[C@@H]1CCC[N@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000727824936 576451598 /nfs/dbraw/zinc/45/15/98/576451598.db2.gz MCQPVHYNIMLFLZ-GFCCVEGCSA-N 1 1 332.360 2.195 20 5 EEBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776588133 577463499 /nfs/dbraw/zinc/46/34/99/577463499.db2.gz LBRPDBNIOVZZEN-QAPCUYQASA-N 1 1 333.432 2.292 20 5 EEBDMO COCCOC1CC[NH+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)CC1 ZINC000764992670 577492434 /nfs/dbraw/zinc/49/24/34/577492434.db2.gz GMUPJXVSKQRKTK-UHFFFAOYSA-N 1 1 348.403 2.338 20 5 EEBDMO Cc1[nH+]ccn1CCCNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC000742411356 577872636 /nfs/dbraw/zinc/87/26/36/577872636.db2.gz QRTMCDRDJPVRLC-UHFFFAOYSA-N 1 1 343.387 2.494 20 5 EEBDMO CC[NH+](CC)[C@H](C(=O)OCCn1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000748123208 577955574 /nfs/dbraw/zinc/95/55/74/577955574.db2.gz SOAFVNFXMMMVDD-INIZCTEOSA-N 1 1 346.387 2.418 20 5 EEBDMO CN(CC(C)(C)C[NH+](C)C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000890884242 675696295 /nfs/dbraw/zinc/69/62/95/675696295.db2.gz GWGHSYPFSQPSLF-UHFFFAOYSA-N 1 1 333.392 2.131 20 5 EEBDMO CC1(C)CCC(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1 ZINC000983655113 683068997 /nfs/dbraw/zinc/06/89/97/683068997.db2.gz PYNSISYDKRUUJB-KLHDSHLOSA-N 1 1 337.464 2.352 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21)C1CCCC1 ZINC001025646259 683206757 /nfs/dbraw/zinc/20/67/57/683206757.db2.gz YVSFIFVSXWMZRS-QLPKVWCKSA-N 1 1 329.400 2.331 20 5 EEBDMO Cc1ccc(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4cccc([N+](=O)[O-])c4)C[C@H]32)o1 ZINC001025665438 683227291 /nfs/dbraw/zinc/22/72/91/683227291.db2.gz VBBFULLSQCRQLS-QLPKVWCKSA-N 1 1 341.367 2.356 20 5 EEBDMO Cc1cccc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c1 ZINC001029964492 688718651 /nfs/dbraw/zinc/71/86/51/688718651.db2.gz LXWGJFXHUXMEMJ-QZTJIDSGSA-N 1 1 345.443 2.331 20 5 EEBDMO Cc1cccc(C[N@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001029964492 688718653 /nfs/dbraw/zinc/71/86/53/688718653.db2.gz LXWGJFXHUXMEMJ-QZTJIDSGSA-N 1 1 345.443 2.331 20 5 EEBDMO Cc1cccc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001029964492 688718655 /nfs/dbraw/zinc/71/86/55/688718655.db2.gz LXWGJFXHUXMEMJ-QZTJIDSGSA-N 1 1 345.443 2.331 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CC[C@@H](C4OCCO4)C3)c2)cc1 ZINC000905697019 1189892745 /nfs/dbraw/zinc/89/27/45/1189892745.db2.gz TTZLOOOTJYHPKV-CQSZACIVSA-N 1 1 344.371 2.111 20 5 EEBDMO CCc1nn(C)c(N2CC3(C2)C[NH+](Cc2ccccc2)C3)c1[N+](=O)[O-] ZINC000866000066 1198450143 /nfs/dbraw/zinc/45/01/43/1198450143.db2.gz PEKCZAXEGHXBHV-UHFFFAOYSA-N 1 1 341.415 2.213 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC[C@@H](CS(C)(=O)=O)C1 ZINC000877548627 1199962154 /nfs/dbraw/zinc/96/21/54/1199962154.db2.gz OJNMMZMQXHNBAH-CQSZACIVSA-N 1 1 340.445 2.468 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@@H](CS(C)(=O)=O)C1 ZINC000877548627 1199962163 /nfs/dbraw/zinc/96/21/63/1199962163.db2.gz OJNMMZMQXHNBAH-CQSZACIVSA-N 1 1 340.445 2.468 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000870087634 1200456131 /nfs/dbraw/zinc/45/61/31/1200456131.db2.gz IPTOXUDACCDCLO-OAHLLOKOSA-N 1 1 341.367 2.396 20 5 EEBDMO O=[N+]([O-])c1c(F)nccc1N1CC[NH+](CCOc2ccccc2)CC1 ZINC000881768959 1201755953 /nfs/dbraw/zinc/75/59/53/1201755953.db2.gz FWJVPBROKLTZDN-UHFFFAOYSA-N 1 1 346.362 2.330 20 5 EEBDMO O=[N+]([O-])c1cnc(N2CCC[C@H]([NH+]3CCOCC3)C2)c2ccccc21 ZINC000884518762 1202330331 /nfs/dbraw/zinc/33/03/31/1202330331.db2.gz ZBOVIZNRFKQQGI-AWEZNQCLSA-N 1 1 342.399 2.444 20 5 EEBDMO CCOCCC[N@H+]1CC[C@H](NCc2cccnc2[N+](=O)[O-])[C@H](C)C1 ZINC000886140958 1202476946 /nfs/dbraw/zinc/47/69/46/1202476946.db2.gz SWOHRHJOQGRRGU-ZBFHGGJFSA-N 1 1 336.436 2.216 20 5 EEBDMO CC[C@H](C)[C@@H](C(=O)OC)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000929987621 1206525883 /nfs/dbraw/zinc/52/58/83/1206525883.db2.gz KRLRKXAJBPFBBR-ZOWXZIJZSA-N 1 1 336.392 2.064 20 5 EEBDMO CC[C@H](C)[C@@H](C(=O)OC)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000929987621 1206525888 /nfs/dbraw/zinc/52/58/88/1206525888.db2.gz KRLRKXAJBPFBBR-ZOWXZIJZSA-N 1 1 336.392 2.064 20 5 EEBDMO COc1ccc(NC(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000930768498 1206581496 /nfs/dbraw/zinc/58/14/96/1206581496.db2.gz HXIYEWMQVPDHAG-GXFFZTMASA-N 1 1 334.376 2.208 20 5 EEBDMO CC(C)(C)NC(=O)[C@@H]1CCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000932440631 1207606958 /nfs/dbraw/zinc/60/69/58/1207606958.db2.gz NTQDBVLTMHGRGC-GJZGRUSLSA-N 1 1 335.404 2.007 20 5 EEBDMO CC(C)(C)NC(=O)[C@@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000932440631 1207606961 /nfs/dbraw/zinc/60/69/61/1207606961.db2.gz NTQDBVLTMHGRGC-GJZGRUSLSA-N 1 1 335.404 2.007 20 5 EEBDMO Cc1cc(N(C)CCCNC(=O)C[N@@H+](C)C2CCC2)ccc1[N+](=O)[O-] ZINC001095769874 1208501902 /nfs/dbraw/zinc/50/19/02/1208501902.db2.gz NBLKETUDGUJGRM-UHFFFAOYSA-N 1 1 348.447 2.330 20 5 EEBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCS[C@@H]3COCC[C@H]32)c1 ZINC000246786334 1213156827 /nfs/dbraw/zinc/15/68/27/1213156827.db2.gz IPTYOFBNEOEKBW-HUUCEWRRSA-N 1 1 334.401 2.108 20 5 EEBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCS[C@@H]3COCC[C@H]32)c1 ZINC000246786334 1213156831 /nfs/dbraw/zinc/15/68/31/1213156831.db2.gz IPTYOFBNEOEKBW-HUUCEWRRSA-N 1 1 334.401 2.108 20 5 EEBDMO Cc1cccc(C)c1C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001017544893 1227507326 /nfs/dbraw/zinc/50/73/26/1227507326.db2.gz DISAPCSAAHDPJQ-KYHPRHEASA-N 1 1 343.427 2.144 20 5 EEBDMO Cc1cccc(C)c1C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001017544893 1227507333 /nfs/dbraw/zinc/50/73/33/1227507333.db2.gz DISAPCSAAHDPJQ-KYHPRHEASA-N 1 1 343.427 2.144 20 5 EEBDMO Cc1cccc(C)c1C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001017544893 1227507339 /nfs/dbraw/zinc/50/73/39/1227507339.db2.gz DISAPCSAAHDPJQ-KYHPRHEASA-N 1 1 343.427 2.144 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CC1CC2(CCC2)C1 ZINC001039583269 1230702738 /nfs/dbraw/zinc/70/27/38/1230702738.db2.gz JTMVJHPGRNGGKB-YYIAUSFCSA-N 1 1 347.459 2.297 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@H+]2CC1CC2(CCC2)C1 ZINC001039583269 1230702739 /nfs/dbraw/zinc/70/27/39/1230702739.db2.gz JTMVJHPGRNGGKB-YYIAUSFCSA-N 1 1 347.459 2.297 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CC1CC2(CCC2)C1 ZINC001039583269 1230702741 /nfs/dbraw/zinc/70/27/41/1230702741.db2.gz JTMVJHPGRNGGKB-YYIAUSFCSA-N 1 1 347.459 2.297 20 5 EEBDMO Cc1cc(C)cc(C[NH+]2CCC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001001395034 1242188893 /nfs/dbraw/zinc/18/88/93/1242188893.db2.gz IMFMOBNQAXGUMT-QZTJIDSGSA-N 1 1 345.443 2.297 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C)n2)C1 ZINC001097205230 1243821059 /nfs/dbraw/zinc/82/10/59/1243821059.db2.gz BSPHNHRSPMMDTM-OKILXGFUSA-N 1 1 349.435 2.089 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](Nc2ccc(C)cc2[N+](=O)[O-])C1 ZINC001097212308 1243833399 /nfs/dbraw/zinc/83/33/99/1243833399.db2.gz QWINVXRKSRPLCJ-OKILXGFUSA-N 1 1 334.420 2.304 20 5 EEBDMO C[N@@H+](C[C@@H]1CCCOC1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000107670735 1290597812 /nfs/dbraw/zinc/59/78/12/1290597812.db2.gz JOOHKWOBRSKWSJ-ZDUSSCGKSA-N 1 1 331.376 2.169 20 5 EEBDMO Cn1ccnc1[C@@H](O)C1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000851861947 1291895502 /nfs/dbraw/zinc/89/55/02/1291895502.db2.gz UJGYHWZDIIWFQV-INIZCTEOSA-N 1 1 348.378 2.413 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(c3cccc(Br)c3[N+](=O)[O-])C[C@@H]21 ZINC000856764175 1293623924 /nfs/dbraw/zinc/62/39/24/1293623924.db2.gz ZOWWQWUSLPVQGZ-SKDRFNHKSA-N 1 1 326.194 2.498 20 5 EEBDMO Cn1nccc1[C@H](O)C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000856800689 1293638608 /nfs/dbraw/zinc/63/86/08/1293638608.db2.gz FLMGPCRQSYUGEZ-QGZVFWFLSA-N 1 1 348.378 2.413 20 5 EEBDMO CC/C(C)=C\C(=O)NCC1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1 ZINC001223081448 1299972761 /nfs/dbraw/zinc/97/27/61/1299972761.db2.gz GWJHVFKCDAUJTD-LCYFTJDESA-N 1 1 349.435 2.013 20 5 EEBDMO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1n[nH]c(=O)c3cccc([N+](=O)[O-])c31)C2 ZINC001229372986 1302751074 /nfs/dbraw/zinc/75/10/74/1302751074.db2.gz FVBICHZURZBSEM-URLYPYJESA-N 1 1 330.344 2.248 20 5 EEBDMO CCCSc1nc(O[C@@H]2CCC[N@@H+](C)CC2)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229791762 1302946467 /nfs/dbraw/zinc/94/64/67/1302946467.db2.gz LPKUZHWRIQVCCO-SNVBAGLBSA-N 1 1 342.421 2.456 20 5 EEBDMO CCC[N@H+](C)CC(=O)NC1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC001230112827 1303066987 /nfs/dbraw/zinc/06/69/87/1303066987.db2.gz BPGBVERQOJQYSJ-UHFFFAOYSA-N 1 1 348.447 2.017 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NC1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC001230112827 1303066994 /nfs/dbraw/zinc/06/69/94/1303066994.db2.gz BPGBVERQOJQYSJ-UHFFFAOYSA-N 1 1 348.447 2.017 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CCOCC2)cc1O[C@H]1CCc2[nH+]ccn2C1 ZINC001234364057 1304900964 /nfs/dbraw/zinc/90/09/64/1304900964.db2.gz NYBMAJFQPCPOEA-AWEZNQCLSA-N 1 1 344.371 2.022 20 5 EEBDMO COc1cc(N2CCC([NH+]3C[C@@H](C)N[C@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC001246966421 1310483670 /nfs/dbraw/zinc/48/36/70/1310483670.db2.gz UJDIMHXAIVIUGV-ZIAGYGMSSA-N 1 1 348.447 2.254 20 5 EEBDMO O=C1C[C@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@H+]1CCC[C@H]1C1CC1 ZINC000839986984 1315269487 /nfs/dbraw/zinc/26/94/87/1315269487.db2.gz CSURSXMQRQUNQE-RDJZCZTQSA-N 1 1 331.372 2.364 20 5 EEBDMO O=C(Cc1cncs1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000842366336 1315690272 /nfs/dbraw/zinc/69/02/72/1315690272.db2.gz IJEJTNOINXUJRB-AWEZNQCLSA-N 1 1 347.396 2.412 20 5 EEBDMO O=C(Cc1cncs1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000842366336 1315690277 /nfs/dbraw/zinc/69/02/77/1315690277.db2.gz IJEJTNOINXUJRB-AWEZNQCLSA-N 1 1 347.396 2.412 20 5 EEBDMO C[N@@H+](CCC1OCCO1)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254479996 1318084253 /nfs/dbraw/zinc/08/42/53/1318084253.db2.gz SXGYXYAAXLBSFN-UHFFFAOYSA-N 1 1 335.404 2.258 20 5 EEBDMO COCCCN1CCC([NH2+][C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254573470 1318126217 /nfs/dbraw/zinc/12/62/17/1318126217.db2.gz ABSXGJYGKDWGLM-QGZVFWFLSA-N 1 1 333.432 2.153 20 5 EEBDMO O=C(NCCC[NH2+]CCCc1ccc(Cl)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001157775372 1318853334 /nfs/dbraw/zinc/85/33/34/1318853334.db2.gz PXOGGWIYMSSTGU-HUUCEWRRSA-N 1 1 339.823 2.034 20 5 EEBDMO N[C@@H](CCC[NH3+])Nc1ccc(-c2ccc(Cl)c([N+](=O)[O-])c2)nn1 ZINC001159789324 1319992728 /nfs/dbraw/zinc/99/27/28/1319992728.db2.gz SJMHLBBGBGOEPG-CYBMUJFWSA-N 1 1 336.783 2.141 20 5 EEBDMO COC(=O)c1ccnc(N[C@H]2CC[N@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-] ZINC001163363981 1321105650 /nfs/dbraw/zinc/10/56/50/1321105650.db2.gz BHDQCKCZVZEGRU-AAEUAGOBSA-N 1 1 336.392 2.307 20 5 EEBDMO [NH3+][C@@H]1CN(c2ccc(-c3ccc([N+](=O)[O-])cc3)nn2)CCC1(F)F ZINC001164327483 1321352471 /nfs/dbraw/zinc/35/24/71/1321352471.db2.gz ONFITOOIPIMCIY-CYBMUJFWSA-N 1 1 335.314 2.225 20 5 EEBDMO C[C@@H](Nc1nccc2cc([N+](=O)[O-])ccc21)[C@@H]1C[N@@H+](C)CCN1C ZINC001262705884 1322354059 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UIBMFJVPPXIRNX-ZDUSSCGKSA-N 1 1 326.356 2.205 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC001336802057 1336597367 /nfs/dbraw/zinc/59/73/67/1336597367.db2.gz AOKOHMRFBMQASB-QAPCUYQASA-N 1 1 333.432 2.340 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CCC[N@@H+](CC3CC3)C2)c1 ZINC001336802057 1336597371 /nfs/dbraw/zinc/59/73/71/1336597371.db2.gz AOKOHMRFBMQASB-QAPCUYQASA-N 1 1 333.432 2.340 20 5 EEBDMO Cc1nn(C)c(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)c1Cl ZINC001579891172 1344428246 /nfs/dbraw/zinc/42/82/46/1344428246.db2.gz DSTTWJYLYANHOD-CQSZACIVSA-N 1 1 337.767 2.103 20 5 EEBDMO C[N@@H+](C[C@@H]1CCCOC1)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000154741136 769166344 /nfs/dbraw/zinc/16/63/44/769166344.db2.gz FPZCFDQUQCNYRQ-AWEZNQCLSA-N 1 1 348.403 2.153 20 5 EEBDMO CCN(CCNc1ccc([N+](=O)[O-])c(C)n1)C(=O)C[N@@H+](C)C1CCC1 ZINC001106979793 782761802 /nfs/dbraw/zinc/76/18/02/782761802.db2.gz XZOIMRCOIJVQLG-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000919695554 770204892 /nfs/dbraw/zinc/20/48/92/770204892.db2.gz CBZQZCKUKPBPED-UHFFFAOYSA-N 1 1 343.368 2.475 20 5 EEBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000195129967 770315777 /nfs/dbraw/zinc/31/57/77/770315777.db2.gz WZFDIDHVTTWEEV-HNNXBMFYSA-N 1 1 344.371 2.337 20 5 EEBDMO Cc1ccn(C)c1C(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001031633307 770500297 /nfs/dbraw/zinc/50/02/97/770500297.db2.gz QQPDDYGAWQLQGU-UHFFFAOYSA-N 1 1 342.399 2.104 20 5 EEBDMO Cc1cc(C)c(C(=O)NCC2C[NH+](Cc3cccc([N+](=O)[O-])c3)C2)[nH]1 ZINC001031774750 775383930 /nfs/dbraw/zinc/38/39/30/775383930.db2.gz GEVUFBANDSEIKR-UHFFFAOYSA-N 1 1 342.399 2.402 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CCC1CCCC1)C2 ZINC000981763793 778159495 /nfs/dbraw/zinc/15/94/95/778159495.db2.gz LKODAHJWNPGPNV-HZPDHXFCSA-N 1 1 335.448 2.156 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@H+](CCC1CCCC1)C2 ZINC000981763793 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NCOQATYSPNYPAM-UHFFFAOYSA-N 1 1 342.779 2.056 20 5 EEBDMO CN(C(=O)c1cnco1)C1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001005790867 783778054 /nfs/dbraw/zinc/77/80/54/783778054.db2.gz YIZUORYCAASWOA-UHFFFAOYSA-N 1 1 344.371 2.319 20 5 EEBDMO O=C(C1CC1)N1CCC2(C[NH+](Cc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001035630577 784827643 /nfs/dbraw/zinc/82/76/43/784827643.db2.gz QMZYNFSULPJRDF-UHFFFAOYSA-N 1 1 329.400 2.429 20 5 EEBDMO N[C@@H](CCC[NH3+])Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC001170897915 785236501 /nfs/dbraw/zinc/23/65/01/785236501.db2.gz QJQRQKHSTNPFBR-CQSZACIVSA-N 1 1 331.376 2.004 20 5 EEBDMO CC(C)[N@@H+](CCO)CC1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000910852635 787066702 /nfs/dbraw/zinc/06/67/02/787066702.db2.gz USHNFMHWPISNKS-UHFFFAOYSA-N 1 1 349.431 2.150 20 5 EEBDMO COC(=O)[C@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2)C(F)(F)F ZINC001171014663 787698657 /nfs/dbraw/zinc/69/86/57/787698657.db2.gz IBPLDVIXXLKNLD-LBPRGKRZSA-N 1 1 347.293 2.099 20 5 EEBDMO COC(=O)[C@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2)C(F)(F)F ZINC001171014663 787698663 /nfs/dbraw/zinc/69/86/63/787698663.db2.gz IBPLDVIXXLKNLD-LBPRGKRZSA-N 1 1 347.293 2.099 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3cccc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC000823790720 787946739 /nfs/dbraw/zinc/94/67/39/787946739.db2.gz KIXLCLSPZHCJSI-YQFWSFKMSA-N 1 1 329.400 2.108 20 5 EEBDMO Cc1cccc(NCCNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])[nH+]1 ZINC000845645046 789909495 /nfs/dbraw/zinc/90/94/95/789909495.db2.gz STMKKRHTEHXLGF-UHFFFAOYSA-N 1 1 332.335 2.208 20 5 EEBDMO C[C@H](OC(=O)C[NH+]1[C@@H](C)CC[C@@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000785727381 806557466 /nfs/dbraw/zinc/55/74/66/806557466.db2.gz GLYNQRHTQCGVCZ-AVGNSLFASA-N 1 1 349.387 2.338 20 5 EEBDMO COC(=O)[C@@H]1CC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173182399 797280290 /nfs/dbraw/zinc/28/02/90/797280290.db2.gz ROTPVNMUMVSQJD-GHMZBOCLSA-N 1 1 340.351 2.168 20 5 EEBDMO O=C(NC[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)s2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086082894 802110586 /nfs/dbraw/zinc/11/05/86/802110586.db2.gz HBKVJLNYGMKQLE-RBLKWDMZSA-N 1 1 343.836 2.051 20 5 EEBDMO Cc1cc(C)c(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)c1 ZINC001086082807 802111070 /nfs/dbraw/zinc/11/10/70/802111070.db2.gz DVBVUNICQUPWMR-KYHPRHEASA-N 1 1 345.443 2.261 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@]3(C2)CCCN(c2ncccn2)C3)C1 ZINC001169019350 803587615 /nfs/dbraw/zinc/58/76/15/803587615.db2.gz HXUIYMWGAKSEHL-SOLBZPMBSA-N 1 1 345.447 2.214 20 5 EEBDMO C[C@]1(O)CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000791632210 809355086 /nfs/dbraw/zinc/35/50/86/809355086.db2.gz OHXXBTBYNSUBLM-HNNXBMFYSA-N 1 1 341.795 2.424 20 5 EEBDMO C[C@]1(O)CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000791632210 809355095 /nfs/dbraw/zinc/35/50/95/809355095.db2.gz OHXXBTBYNSUBLM-HNNXBMFYSA-N 1 1 341.795 2.424 20 5 EEBDMO 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CC[C@]1(O)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000879313588 1200990463 /nfs/dbraw/zinc/99/04/63/1200990463.db2.gz MLSLCPMKEPVGOK-INIZCTEOSA-N 1 1 339.367 2.299 20 5 EEBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)Cc2cccc([N+](=O)[O-])c2C)C[C@@H]1C ZINC000121148860 1201560569 /nfs/dbraw/zinc/56/05/69/1201560569.db2.gz VBNYXHGNMHTKPF-OKILXGFUSA-N 1 1 349.431 2.013 20 5 EEBDMO O=[N+]([O-])c1c(F)nccc1NCC[NH+]1CCN(c2ccccc2)CC1 ZINC000881796296 1201760957 /nfs/dbraw/zinc/76/09/57/1201760957.db2.gz VVBYYZIKPWQMGH-UHFFFAOYSA-N 1 1 345.378 2.363 20 5 EEBDMO C[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CC1(C)C ZINC000882538840 1201891804 /nfs/dbraw/zinc/89/18/04/1201891804.db2.gz BFOOMFODWQKXSO-UHFFFAOYSA-N 1 1 332.404 2.017 20 5 EEBDMO CCOCCC[N@H+]1CC[C@H](NCc2cccnc2[N+](=O)[O-])[C@@H](C)C1 ZINC000886140957 1202476783 /nfs/dbraw/zinc/47/67/83/1202476783.db2.gz SWOHRHJOQGRRGU-HOCLYGCPSA-N 1 1 336.436 2.216 20 5 EEBDMO CCOCCO[C@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000138481021 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O=[N+]([O-])c1c[n+]([O-])ccc1O[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1 ZINC001229455309 1302790842 /nfs/dbraw/zinc/79/08/42/1302790842.db2.gz DBSKQPYUWXGVQE-CQSZACIVSA-N 1 1 347.346 2.411 20 5 EEBDMO COc1c(C)cc([N+](=O)[O-])c(O[C@@H]2CCc3[nH+]ccn3C2)c1[N+](=O)[O-] ZINC001229868688 1302971214 /nfs/dbraw/zinc/97/12/14/1302971214.db2.gz MQJIKNJRTUQLEY-SNVBAGLBSA-N 1 1 348.315 2.410 20 5 EEBDMO O=C1NC[C@@H]2CC[N@@H+](Cc3ccc4ccc5cccnc5c4n3)C[C@H]12 ZINC001232223736 1304042784 /nfs/dbraw/zinc/04/27/84/1304042784.db2.gz VBKOVOOEDNMLAQ-RDJZCZTQSA-N 1 1 332.407 2.351 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](N(C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000840150895 1315309651 /nfs/dbraw/zinc/30/96/51/1315309651.db2.gz AXGUICPAEFOUKL-OAHLLOKOSA-N 1 1 344.419 2.225 20 5 EEBDMO C[NH+]1CCN(c2ccc3nc(-c4ccc([N+](=O)[O-])o4)[nH]c3c2)CC1 ZINC001250669363 1317287781 /nfs/dbraw/zinc/28/77/81/1317287781.db2.gz MEMOXAJPGJDGDM-UHFFFAOYSA-N 1 1 327.344 2.483 20 5 EEBDMO Cc1[nH+]ccn1CCNC(F)(F)c1ccc([N+](=O)[O-])c(Cl)n1 ZINC001156002104 1317824693 /nfs/dbraw/zinc/82/46/93/1317824693.db2.gz QKKQVELATSYCJG-UHFFFAOYSA-N 1 1 331.710 2.487 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CC[C@@]34CCOC4)CC2)ccc1[N+](=O)[O-] ZINC001256102009 1318650289 /nfs/dbraw/zinc/65/02/89/1318650289.db2.gz UDZFQUMWOFMUQX-SFHVURJKSA-N 1 1 347.415 2.437 20 5 EEBDMO CC(C)[C@]1(CO)CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000351948217 1318740532 /nfs/dbraw/zinc/74/05/32/1318740532.db2.gz BYLMMDUQFSRHQL-SUMWQHHRSA-N 1 1 335.404 2.262 20 5 EEBDMO CCOc1nc(NCC[C@H]2CC[NH2+]CC2(F)F)ccc1[N+](=O)[O-] ZINC001162813670 1320966064 /nfs/dbraw/zinc/96/60/64/1320966064.db2.gz YAFIQXWCDIXAQV-SNVBAGLBSA-N 1 1 330.335 2.435 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](Nc2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC001163367005 1321106278 /nfs/dbraw/zinc/10/62/78/1321106278.db2.gz XNDSRKQNEWPLDY-WDEREUQCSA-N 1 1 328.800 2.412 20 5 EEBDMO CSc1nc(Cl)nc(N2CCn3c(C)[nH+]cc3C2)c1[N+](=O)[O-] ZINC001165386107 1321512966 /nfs/dbraw/zinc/51/29/66/1321512966.db2.gz XUHBZJRBOFGBHV-UHFFFAOYSA-N 1 1 340.796 2.285 20 5 EEBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1ncc([N+](=O)[O-])cc1Cl)CC2 ZINC001166032744 1321639357 /nfs/dbraw/zinc/63/93/57/1321639357.db2.gz RXVBVOOJFANAOI-UHFFFAOYSA-N 1 1 339.783 2.278 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001322194423 1333225301 /nfs/dbraw/zinc/22/53/01/1333225301.db2.gz LNKWGXRGGXFYSG-LSDHHAIUSA-N 1 1 330.388 2.247 20 5 EEBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] ZINC001591183821 1349445285 /nfs/dbraw/zinc/44/52/85/1349445285.db2.gz ITMXKOPTYFPHFS-AWEZNQCLSA-N 1 1 345.407 2.307 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001603894773 1350797193 /nfs/dbraw/zinc/79/71/93/1350797193.db2.gz ISNBWWMIRRFLTQ-GFCCVEGCSA-N 1 1 345.407 2.451 20 5 EEBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH+]3CCC4(CC3)OCCCO4)nc2c1 ZINC000815156106 1367815940 /nfs/dbraw/zinc/81/59/40/1367815940.db2.gz USUYPBMDKMEUOW-UHFFFAOYSA-N 1 1 332.360 2.200 20 5 EEBDMO C[C@]1(CO)C[C@@H](O)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000888092306 1371273097 /nfs/dbraw/zinc/27/30/97/1371273097.db2.gz UGULNNOYZWEEES-SJKOYZFVSA-N 1 1 332.356 2.172 20 5 EEBDMO Cc1ncc(C(=O)NCC2C[NH+](Cc3cccc([N+](=O)[O-])c3)C2)s1 ZINC001031574554 769782261 /nfs/dbraw/zinc/78/22/61/769782261.db2.gz WNPOVEBKNAKAJP-UHFFFAOYSA-N 1 1 346.412 2.222 20 5 EEBDMO O=C(NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccc(Cl)[nH]1 ZINC001031958409 780706579 /nfs/dbraw/zinc/70/65/79/780706579.db2.gz UNKCCBJGSGZVLH-UHFFFAOYSA-N 1 1 348.790 2.438 20 5 EEBDMO CC(C)(C(=O)OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000805611251 783793104 /nfs/dbraw/zinc/79/31/04/783793104.db2.gz VFVSXESAUPYAPZ-UHFFFAOYSA-N 1 1 337.332 2.421 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC000906847957 784192407 /nfs/dbraw/zinc/19/24/07/784192407.db2.gz RMNANQNYYGWMGW-SNVBAGLBSA-N 1 1 340.811 2.244 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000825110777 788440972 /nfs/dbraw/zinc/44/09/72/788440972.db2.gz INQUESLSKXZHMB-YOEHRIQHSA-N 1 1 349.431 2.399 20 5 EEBDMO CC(C)OCC(=O)N1CC2(C1)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C2 ZINC001147153227 791715203 /nfs/dbraw/zinc/71/52/03/791715203.db2.gz PUADRGIJEQWHNO-UHFFFAOYSA-N 1 1 347.415 2.054 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172912137 791791351 /nfs/dbraw/zinc/79/13/51/791791351.db2.gz LQHDRZNTBWYBFM-HNNXBMFYSA-N 1 1 344.419 2.083 20 5 EEBDMO C[N@@H+](CC(=O)NCCCNc1cccc(F)c1[N+](=O)[O-])C1CCC1 ZINC001094853533 796782385 /nfs/dbraw/zinc/78/23/85/796782385.db2.gz QQQSAWGKQQCUGO-UHFFFAOYSA-N 1 1 338.383 2.136 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N1CCC(Nc2nc(C)ccc2[N+](=O)[O-])CC1 ZINC001095233912 797565968 /nfs/dbraw/zinc/56/59/68/797565968.db2.gz YXGFWCXFKPRWKB-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO COc1cccc(C[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1 ZINC001178458664 799484104 /nfs/dbraw/zinc/48/41/04/799484104.db2.gz QSVNIVANKNXAQX-IAGOWNOFSA-N 1 1 349.431 2.127 20 5 EEBDMO CCCc1ccc(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC001086083210 802112387 /nfs/dbraw/zinc/11/23/87/802112387.db2.gz QUFLPLLZLMIDJD-XMTFNYHQSA-N 1 1 345.443 2.289 20 5 EEBDMO [NH3+]C[C@H](N[C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001168977425 803543589 /nfs/dbraw/zinc/54/35/89/803543589.db2.gz JRFCJXHEEGKSIL-SWHYSGLUSA-N 1 1 342.237 2.484 20 5 EEBDMO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169037172 803580678 /nfs/dbraw/zinc/58/06/78/803580678.db2.gz QZHZUODDWXYGON-BFHYXJOUSA-N 1 1 327.425 2.373 20 5 EEBDMO CC(C)(C)OC(=O)NC[C@]1(F)CC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169041019 803583743 /nfs/dbraw/zinc/58/37/43/803583743.db2.gz AJHXVUOQCKJHEE-XJKCOSOUSA-N 1 1 345.415 2.371 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)C1 ZINC001169044674 803585403 /nfs/dbraw/zinc/58/54/03/803585403.db2.gz IPGCPYHSHPFUOL-OKYOBFRVSA-N 1 1 329.444 2.496 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+]2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)C1 ZINC001169044674 803585404 /nfs/dbraw/zinc/58/54/04/803585404.db2.gz IPGCPYHSHPFUOL-OKYOBFRVSA-N 1 1 329.444 2.496 20 5 EEBDMO O=c1ccc2c(n1CC1CC1)CC[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)CC2 ZINC001169018256 803587110 /nfs/dbraw/zinc/58/71/10/803587110.db2.gz AGNMVOBMDBTHOM-DOTOQJQBSA-N 1 1 345.443 2.104 20 5 EEBDMO C[N@@H+]([C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169049028 803594678 /nfs/dbraw/zinc/59/46/78/803594678.db2.gz VRJIZNIHWWPBOQ-ZSAUSMIDSA-N 1 1 339.436 2.229 20 5 EEBDMO O=C1c2ccccc2CN1[C@H]1CC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169054231 803596426 /nfs/dbraw/zinc/59/64/26/803596426.db2.gz KZJVGACDVOXPTB-BMFZPTHFSA-N 1 1 329.400 2.162 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H](n3cncn3)C2)c([N+](=O)[O-])c1 ZINC001170344410 809916012 /nfs/dbraw/zinc/91/60/12/809916012.db2.gz BUZABINFALJLBQ-DZGCQCFKSA-N 1 1 345.403 2.463 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(c2nnc([C@H](C)[N+](=O)[O-])n2CC(C)C)C[C@@H]1C ZINC001517388990 1119032779 /nfs/dbraw/zinc/03/27/79/1119032779.db2.gz CFENIANFRDCTPB-IHRRRGAJSA-N 1 1 338.456 2.191 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(C)(CO)CC2)cccc1[N+](=O)[O-] ZINC000186930276 236068537 /nfs/dbraw/zinc/06/85/37/236068537.db2.gz BYJSKFPRTSTLRR-ZDUSSCGKSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NCC1([NH+]2CCOCC2)CCOCC1 ZINC000413395576 238593196 /nfs/dbraw/zinc/59/31/96/238593196.db2.gz CTVOQHGOOIOXIW-UHFFFAOYSA-N 1 1 335.404 2.197 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1 ZINC000073900281 203275104 /nfs/dbraw/zinc/27/51/04/203275104.db2.gz WLUFVXRJNUOHMZ-OAHLLOKOSA-N 1 1 334.420 2.468 20 5 EEBDMO COc1ccccc1C[N@@H+](CCO)CCOc1ccc([N+](=O)[O-])cc1 ZINC000103143761 204063343 /nfs/dbraw/zinc/06/33/43/204063343.db2.gz PAZKXEIRMOQKBK-UHFFFAOYSA-N 1 1 346.383 2.477 20 5 EEBDMO Nc1c(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000126509693 205059957 /nfs/dbraw/zinc/05/99/57/205059957.db2.gz JURBETSASGQQGT-WFASDCNBSA-N 1 1 344.415 2.266 20 5 EEBDMO Cc1nccn1CCC[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000130782048 205256915 /nfs/dbraw/zinc/25/69/15/205256915.db2.gz NXLZMBAGDPAZPE-CYBMUJFWSA-N 1 1 345.403 2.449 20 5 EEBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2N2CCOC2=O)CC[N@H+]1C ZINC000491986778 246245654 /nfs/dbraw/zinc/24/56/54/246245654.db2.gz NGUWITJSPGOWBD-NEPJUHHUSA-N 1 1 334.376 2.446 20 5 EEBDMO CCS[C@H]1CCCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000159816088 206265651 /nfs/dbraw/zinc/26/56/51/206265651.db2.gz KQYZGMACFVSIHK-AWEZNQCLSA-N 1 1 325.434 2.364 20 5 EEBDMO CC(C)[C@H](CO)[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000176247034 207206836 /nfs/dbraw/zinc/20/68/36/207206836.db2.gz BQABTLUHEONHIZ-INIZCTEOSA-N 1 1 332.404 2.310 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H](COCc3ccccc3)C2)n1 ZINC000176269770 207209576 /nfs/dbraw/zinc/20/95/76/207209576.db2.gz AVVCHOVJBBIXDA-INIZCTEOSA-N 1 1 330.388 2.330 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1ncc([N+](=O)[O-])c(N)n1 ZINC000267261569 256042979 /nfs/dbraw/zinc/04/29/79/256042979.db2.gz WVFGZLJHRANNGB-OCCSQVGLSA-N 1 1 342.403 2.290 20 5 EEBDMO COCC[N@H+]1CC[C@H](NC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC000267968912 256100622 /nfs/dbraw/zinc/10/06/22/256100622.db2.gz MHQNXAKGZPQAST-ZDUSSCGKSA-N 1 1 336.392 2.054 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C[N@H+]1C1CC1 ZINC000267991574 256103390 /nfs/dbraw/zinc/10/33/90/256103390.db2.gz QDSILANTCNOITP-WDEREUQCSA-N 1 1 328.372 2.431 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)NCCc3cccc([N+](=O)[O-])c3)CC[C@@H]21 ZINC000270447089 256136399 /nfs/dbraw/zinc/13/63/99/256136399.db2.gz DTUWHBQJGKFNAD-WBVHZDCISA-N 1 1 346.431 2.263 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1[C@H](C)CCC[C@@H]1CO ZINC000270452448 256137141 /nfs/dbraw/zinc/13/71/41/256137141.db2.gz LEWFAHVBHJTDCS-UKRRQHHQSA-N 1 1 335.404 2.467 20 5 EEBDMO Cc1n[nH]c(C(=O)N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000268126290 256116117 /nfs/dbraw/zinc/11/61/17/256116117.db2.gz AOWYQHVWVIAAAK-BXUZGUMPSA-N 1 1 343.387 2.019 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000268159192 256120633 /nfs/dbraw/zinc/12/06/33/256120633.db2.gz HTJOETVBCLAZPW-ABAIWWIYSA-N 1 1 335.429 2.286 20 5 EEBDMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000270554755 256147968 /nfs/dbraw/zinc/14/79/68/256147968.db2.gz RYVWCZDZMBPBBJ-CZUORRHYSA-N 1 1 332.404 2.015 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)CCc1cnccn1 ZINC000271297904 256230447 /nfs/dbraw/zinc/23/04/47/256230447.db2.gz DNOYKDYHQVYKET-UHFFFAOYSA-N 1 1 343.387 2.196 20 5 EEBDMO COc1ccc(NC(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)cc1[N+](=O)[O-] ZINC000272824287 256241767 /nfs/dbraw/zinc/24/17/67/256241767.db2.gz 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CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[N@@H+](CCOC)C1 ZINC000361210840 153456054 /nfs/dbraw/zinc/45/60/54/153456054.db2.gz DETAIUZNKVEXCE-JKSUJKDBSA-N 1 1 349.431 2.000 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2CCc2ccccc2)c1 ZINC000246736379 160292455 /nfs/dbraw/zinc/29/24/55/160292455.db2.gz NSRMAGVOWFHSRT-SJLPKXTDSA-N 1 1 344.415 2.249 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(C(=O)CCNc3ccccc3[N+](=O)[O-])CC[C@H]21 ZINC000247122756 160311090 /nfs/dbraw/zinc/31/10/90/160311090.db2.gz AMBINQFYKMCYML-GOEBONIOSA-N 1 1 346.431 2.340 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCS1 ZINC000247496033 160326452 /nfs/dbraw/zinc/32/64/52/160326452.db2.gz LHIXDIFUZSHEDL-GDBMZVCRSA-N 1 1 340.445 2.408 20 5 EEBDMO C[C@H]1[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CCC[N@H+]1C ZINC000343483828 161140248 /nfs/dbraw/zinc/14/02/48/161140248.db2.gz FDHYRIHVJSVGQI-HZMBPMFUSA-N 1 1 325.796 2.390 20 5 EEBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nnnn1CC1CC1 ZINC000344834954 161249433 /nfs/dbraw/zinc/24/94/33/161249433.db2.gz QIIRASPNZFUUCL-GHXNOFRVSA-N 1 1 328.376 2.184 20 5 EEBDMO COC(=O)[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]1C ZINC000346642529 161388214 /nfs/dbraw/zinc/38/82/14/161388214.db2.gz MLIUKZAOCHAVTQ-GWCFXTLKSA-N 1 1 346.343 2.028 20 5 EEBDMO COC(=O)[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]1C ZINC000346642529 161388215 /nfs/dbraw/zinc/38/82/15/161388215.db2.gz MLIUKZAOCHAVTQ-GWCFXTLKSA-N 1 1 346.343 2.028 20 5 EEBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000346677327 161391361 /nfs/dbraw/zinc/39/13/61/161391361.db2.gz FRZCTMVRHRJAHG-AWEZNQCLSA-N 1 1 342.399 2.280 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000346677327 161391362 /nfs/dbraw/zinc/39/13/62/161391362.db2.gz FRZCTMVRHRJAHG-AWEZNQCLSA-N 1 1 342.399 2.280 20 5 EEBDMO O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc([N+](=O)[O-])c[nH]1 ZINC000352139851 162082983 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326.418 2.064 20 5 EEBDMO C[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC[S@](=O)C1 ZINC000375934380 167229440 /nfs/dbraw/zinc/22/94/40/167229440.db2.gz VOHFBQYNHHKNII-XMHCIUCPSA-N 1 1 326.418 2.064 20 5 EEBDMO CSc1ccc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000272697291 269010050 /nfs/dbraw/zinc/01/00/50/269010050.db2.gz YBRDGMCFMBSBEL-FZMZJTMJSA-N 1 1 335.429 2.483 20 5 EEBDMO C[C@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C1=CC[N@H+](C)CC1 ZINC000272786687 269020945 /nfs/dbraw/zinc/02/09/45/269020945.db2.gz BLQCCFVBMKEATE-VIFPVBQESA-N 1 1 345.446 2.122 20 5 EEBDMO C[C@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000272786687 269020948 /nfs/dbraw/zinc/02/09/48/269020948.db2.gz BLQCCFVBMKEATE-VIFPVBQESA-N 1 1 345.446 2.122 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000275764057 269140198 /nfs/dbraw/zinc/14/01/98/269140198.db2.gz PBSJYHHDZWKMHB-GXTWGEPZSA-N 1 1 334.376 2.352 20 5 EEBDMO CCC[C@]1(CO)CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000277678785 269171088 /nfs/dbraw/zinc/17/10/88/269171088.db2.gz GFXJZLYMJISLOO-QGZVFWFLSA-N 1 1 335.404 2.469 20 5 EEBDMO O=C1NCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]1Cc1ccccc1 ZINC000343918863 275023215 /nfs/dbraw/zinc/02/32/15/275023215.db2.gz BSUGIRZCLYTEOM-GOSISDBHSA-N 1 1 339.395 2.180 20 5 EEBDMO O=C1NCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]1Cc1ccccc1 ZINC000343918863 275023216 /nfs/dbraw/zinc/02/32/16/275023216.db2.gz BSUGIRZCLYTEOM-GOSISDBHSA-N 1 1 339.395 2.180 20 5 EEBDMO C[C@H]1[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)CC[N@H+]1Cc1ccccc1 ZINC000288276839 275041700 /nfs/dbraw/zinc/04/17/00/275041700.db2.gz QXDPEGVJQPSBNW-AAEUAGOBSA-N 1 1 328.376 2.042 20 5 EEBDMO CC[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000288371818 275051488 /nfs/dbraw/zinc/05/14/88/275051488.db2.gz JWYSWLRPHVTTCR-NSHDSACASA-N 1 1 325.796 2.343 20 5 EEBDMO C[C@@H]1C[C@H](N2CCOCC2)C[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000289966401 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1 1 349.431 2.290 20 5 EEBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1 ZINC000157252171 277157322 /nfs/dbraw/zinc/15/73/22/277157322.db2.gz RIIXWSNJKULJPJ-IAQYHMDHSA-N 1 1 348.359 2.059 20 5 EEBDMO C[C@@H](CS(C)(=O)=O)[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000113261206 278292429 /nfs/dbraw/zinc/29/24/29/278292429.db2.gz XQWVDTBPHOHFON-LBPRGKRZSA-N 1 1 326.418 2.035 20 5 EEBDMO C[C@@H](CS(C)(=O)=O)[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000113261206 278292431 /nfs/dbraw/zinc/29/24/31/278292431.db2.gz XQWVDTBPHOHFON-LBPRGKRZSA-N 1 1 326.418 2.035 20 5 EEBDMO C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000296951712 294110771 /nfs/dbraw/zinc/11/07/71/294110771.db2.gz XWYICTBSFWSIQR-KNCCTNLNSA-N 1 1 344.415 2.419 20 5 EEBDMO O=[N+]([O-])c1c(NCCc2cn3c([nH+]2)CCCC3)nc2sccn21 ZINC000301059678 294818528 /nfs/dbraw/zinc/81/85/28/294818528.db2.gz DMBFZSBWUXHXFR-UHFFFAOYSA-N 1 1 332.389 2.491 20 5 EEBDMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000332686250 312045394 /nfs/dbraw/zinc/04/53/94/312045394.db2.gz VOCHQIXXOTWESR-GHMZBOCLSA-N 1 1 339.342 2.111 20 5 EEBDMO C[C@@H]1C[C@H](NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[NH2+]1 ZINC000414952015 313114008 /nfs/dbraw/zinc/11/40/08/313114008.db2.gz QKOLWCLQOVKQST-IUODEOHRSA-N 1 1 329.404 2.225 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)C[C@@H](CO)C1 ZINC000420940753 314003668 /nfs/dbraw/zinc/00/36/68/314003668.db2.gz NDXVLFQCSWGJIF-TZMCWYRMSA-N 1 1 335.404 2.182 20 5 EEBDMO COCC(C)(C)[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000424979682 314313851 /nfs/dbraw/zinc/31/38/51/314313851.db2.gz NBXXOCXNYPOOKI-UHFFFAOYSA-N 1 1 335.404 2.086 20 5 EEBDMO CN1C(=O)NCC12CC[NH+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000425535480 314416991 /nfs/dbraw/zinc/41/69/91/314416991.db2.gz CXBDXQKWTMBQMA-UHFFFAOYSA-N 1 1 338.795 2.238 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+](CCc1ccccc1)[C@@H]1CCOC1 ZINC000437510859 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347.375 2.025 20 5 EEBDMO CCNc1ccc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000325863343 465032660 /nfs/dbraw/zinc/03/26/60/465032660.db2.gz IZVCZLUXXRBJRW-ZIAGYGMSSA-N 1 1 332.404 2.383 20 5 EEBDMO CC(C)[C@@H](CNC(=O)/C=C\c1ccccc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000491061660 468292592 /nfs/dbraw/zinc/29/25/92/468292592.db2.gz QVLRONKPPSIEHB-ZPUOCTKUSA-N 1 1 347.415 2.081 20 5 EEBDMO C[C@H]1C[C@@H](N(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C ZINC000127516540 462560430 /nfs/dbraw/zinc/56/04/30/462560430.db2.gz YVRWNHPCYMBTOJ-QWRGUYRKSA-N 1 1 331.376 2.026 20 5 EEBDMO C[C@H]1C[C@@H](N(C)C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C ZINC000127516540 462560435 /nfs/dbraw/zinc/56/04/35/462560435.db2.gz YVRWNHPCYMBTOJ-QWRGUYRKSA-N 1 1 331.376 2.026 20 5 EEBDMO C[C@H]1C[C@@H](N(C)C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C ZINC000127516540 462560441 /nfs/dbraw/zinc/56/04/41/462560441.db2.gz YVRWNHPCYMBTOJ-QWRGUYRKSA-N 1 1 331.376 2.026 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H](O)COc1ccccc1)CC2 ZINC000088605340 462638902 /nfs/dbraw/zinc/63/89/02/462638902.db2.gz WHMCHFMDCFUQRI-KRWDZBQOSA-N 1 1 328.368 2.393 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@H](O)COc1ccccc1)CC2 ZINC000088605340 462638905 /nfs/dbraw/zinc/63/89/05/462638905.db2.gz WHMCHFMDCFUQRI-KRWDZBQOSA-N 1 1 328.368 2.393 20 5 EEBDMO CO[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128492720 462645171 /nfs/dbraw/zinc/64/51/71/462645171.db2.gz QNXHGWVALCQNSK-GFCCVEGCSA-N 1 1 325.340 2.173 20 5 EEBDMO Cc1nc(NC[C@@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000089645238 462703226 /nfs/dbraw/zinc/70/32/26/462703226.db2.gz MBSPYIHKLPQORN-JKSUJKDBSA-N 1 1 342.399 2.346 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCc3ccccc3[C@@H]2CO)c1 ZINC000154633231 462790878 /nfs/dbraw/zinc/79/08/78/462790878.db2.gz XLEPEMSESDCJKH-ROUUACIJSA-N 1 1 328.368 2.220 20 5 EEBDMO CCOc1ccc([C@H](C)[NH2+][C@H](CO)c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000090884770 462815604 /nfs/dbraw/zinc/81/56/04/462815604.db2.gz TULQEUACUKKLAT-SMDDNHRTSA-N 1 1 334.376 2.111 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC[C@@H]21 ZINC000154879636 462818195 /nfs/dbraw/zinc/81/81/95/462818195.db2.gz HMLUDYPYGCZJIM-RDJZCZTQSA-N 1 1 331.416 2.470 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000066138224 462855167 /nfs/dbraw/zinc/85/51/67/462855167.db2.gz AGERWBJRCQXUBP-ZDUSSCGKSA-N 1 1 345.403 2.241 20 5 EEBDMO O=C(CC[N@H+]1CC[C@@H]2OCCC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000155530548 462904180 /nfs/dbraw/zinc/90/41/80/462904180.db2.gz FIXDXNRVZSXDEN-CJNGLKHVSA-N 1 1 333.388 2.424 20 5 EEBDMO Cc1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+]2CC2CCCCC2)c1[N+](=O)[O-] ZINC000067331897 462992960 /nfs/dbraw/zinc/99/29/60/462992960.db2.gz HFVCALYHNFSKIJ-AWEZNQCLSA-N 1 1 349.435 2.401 20 5 EEBDMO CN(C)c1ncc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000093534515 463039849 /nfs/dbraw/zinc/03/98/49/463039849.db2.gz GJNLBDLPXPYVDM-LLVKDONJSA-N 1 1 348.432 2.199 20 5 EEBDMO Cc1nn(C)c(N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000078507025 463123809 /nfs/dbraw/zinc/12/38/09/463123809.db2.gz XWWVPCUPUHKGDM-HNNXBMFYSA-N 1 1 329.404 2.347 20 5 EEBDMO CC[NH+]1CCN(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])CC1 ZINC000121396168 463129752 /nfs/dbraw/zinc/12/97/52/463129752.db2.gz LPGGLBHQHNGANB-UHFFFAOYSA-N 1 1 349.435 2.052 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000157449013 463132875 /nfs/dbraw/zinc/13/28/75/463132875.db2.gz WZTCGHIHDLTLTB-INIZCTEOSA-N 1 1 334.420 2.119 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+](Cc2ccccn2)C2CC2)c1 ZINC000026713672 463170483 /nfs/dbraw/zinc/17/04/83/463170483.db2.gz YMIJIYINGZGVQX-KRWDZBQOSA-N 1 1 343.383 2.394 20 5 EEBDMO CCC[N@H+]1CC[C@@H](CNC(=O)NCCNc2ccccc2[N+](=O)[O-])C1 ZINC000054510003 463239123 /nfs/dbraw/zinc/23/91/23/463239123.db2.gz DDHBZNKXYHZVIX-AWEZNQCLSA-N 1 1 349.435 2.038 20 5 EEBDMO C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)CC[N@H+]1Cc1ccccc1 ZINC000080231209 463297924 /nfs/dbraw/zinc/29/79/24/463297924.db2.gz MCAIDWBWYKFAGY-TZMCWYRMSA-N 1 1 342.403 2.432 20 5 EEBDMO C[C@@H]1C[N@H+](CCCNC(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000055376336 463312831 /nfs/dbraw/zinc/31/28/31/463312831.db2.gz BDVGOWRUYGQJIU-BETUJISGSA-N 1 1 336.392 2.216 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000139876848 463333730 /nfs/dbraw/zinc/33/37/30/463333730.db2.gz WSHKYJMGWAPUTH-SQWLQELKSA-N 1 1 346.431 2.338 20 5 EEBDMO C[N@H+](CCN1C(=O)c2ccccc2C1=O)Cc1ccccc1[N+](=O)[O-] ZINC000125333058 463531981 /nfs/dbraw/zinc/53/19/81/463531981.db2.gz UWILVHYDTFPTMC-UHFFFAOYSA-N 1 1 339.351 2.323 20 5 EEBDMO C[N@@H+](CCN1C(=O)c2ccccc2C1=O)Cc1ccccc1[N+](=O)[O-] ZINC000125333058 463531986 /nfs/dbraw/zinc/53/19/86/463531986.db2.gz UWILVHYDTFPTMC-UHFFFAOYSA-N 1 1 339.351 2.323 20 5 EEBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000108308113 463596789 /nfs/dbraw/zinc/59/67/89/463596789.db2.gz MZRJBTLENPMBRO-MRXNPFEDSA-N 1 1 346.431 2.387 20 5 EEBDMO CC(C)c1ccc(C(=O)N2CC[N@@H+](C[C@@H](C)O)C[C@H]2C)cc1[N+](=O)[O-] ZINC000194018158 463772889 /nfs/dbraw/zinc/77/28/89/463772889.db2.gz PFFMTUGFXZNVEE-ZIAGYGMSSA-N 1 1 349.431 2.245 20 5 EEBDMO CC(C)c1ccc(C(=O)N2CC[N@H+](C[C@@H](C)O)C[C@H]2C)cc1[N+](=O)[O-] ZINC000194018158 463772894 /nfs/dbraw/zinc/77/28/94/463772894.db2.gz PFFMTUGFXZNVEE-ZIAGYGMSSA-N 1 1 349.431 2.245 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC[C@@H]21 ZINC000194073760 463786388 /nfs/dbraw/zinc/78/63/88/463786388.db2.gz QYPWDFFRHUAGKW-WFASDCNBSA-N 1 1 334.376 2.419 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)C1 ZINC000277188846 463903902 /nfs/dbraw/zinc/90/39/02/463903902.db2.gz BEQQQSNCVNCSRD-ZDUSSCGKSA-N 1 1 335.404 2.407 20 5 EEBDMO Cn1ccnc1[C@@H](O)[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000269258568 463931448 /nfs/dbraw/zinc/93/14/48/463931448.db2.gz CQROPKUEXCBAIE-ZBFHGGJFSA-N 1 1 330.388 2.274 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CCC[C@H]1O ZINC000270202326 464218169 /nfs/dbraw/zinc/21/81/69/464218169.db2.gz XJOCLAZHNKNZFS-QMTHXVAHSA-N 1 1 341.795 2.280 20 5 EEBDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CCC[C@H]1O ZINC000270202326 464218175 /nfs/dbraw/zinc/21/81/75/464218175.db2.gz XJOCLAZHNKNZFS-QMTHXVAHSA-N 1 1 341.795 2.280 20 5 EEBDMO CC(C)[N@H+]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1 ZINC000263924221 464241331 /nfs/dbraw/zinc/24/13/31/464241331.db2.gz WYTWAIYERQPOLP-UHFFFAOYSA-N 1 1 332.404 2.400 20 5 EEBDMO Cc1cc(C)n(CC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000264333512 464295520 /nfs/dbraw/zinc/29/55/20/464295520.db2.gz NPWJIXDUHINKQN-UHFFFAOYSA-N 1 1 329.404 2.230 20 5 EEBDMO C[N@@H+](CCNC(=O)c1c(N)cccc1[N+](=O)[O-])Cc1ccccc1 ZINC000180697487 464373187 /nfs/dbraw/zinc/37/31/87/464373187.db2.gz SIGLQSWNCJKGKM-UHFFFAOYSA-N 1 1 328.372 2.039 20 5 EEBDMO Cc1cc(OCC(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000281386591 464435773 /nfs/dbraw/zinc/43/57/73/464435773.db2.gz MYRIBOOSUOLBLQ-OLZOCXBDSA-N 1 1 333.388 2.023 20 5 EEBDMO C[N@@H+](CCNC(=O)c1c(N)cccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000181161213 464451778 /nfs/dbraw/zinc/45/17/78/464451778.db2.gz QONSYVWBAGRLPA-UHFFFAOYSA-N 1 1 346.362 2.178 20 5 EEBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)C2)C1 ZINC000294310863 464461991 /nfs/dbraw/zinc/46/19/91/464461991.db2.gz WKKWJDFJTDYHAY-MRXNPFEDSA-N 1 1 348.359 2.061 20 5 EEBDMO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[C@H]1S(C)(=O)=O ZINC000245441148 464482835 /nfs/dbraw/zinc/48/28/35/464482835.db2.gz VERQFYREERTKPN-HZPDHXFCSA-N 1 1 340.445 2.425 20 5 EEBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[C@H]1S(C)(=O)=O ZINC000245441148 464482839 /nfs/dbraw/zinc/48/28/39/464482839.db2.gz VERQFYREERTKPN-HZPDHXFCSA-N 1 1 340.445 2.425 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](CCC(N)=O)C1 ZINC000175161479 464497559 /nfs/dbraw/zinc/49/75/59/464497559.db2.gz HIUMXSNWNSJZFP-CYBMUJFWSA-N 1 1 335.404 2.471 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272153539 464498412 /nfs/dbraw/zinc/49/84/12/464498412.db2.gz CZXYXADEQDFLQJ-SMDDNHRTSA-N 1 1 341.358 2.485 20 5 EEBDMO NC(=O)c1ccc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000246212326 464558933 /nfs/dbraw/zinc/55/89/33/464558933.db2.gz AONKFZLZHCTRLN-DZGCQCFKSA-N 1 1 344.415 2.147 20 5 EEBDMO CCOC(=O)c1ccnc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-] ZINC000247139359 464651984 /nfs/dbraw/zinc/65/19/84/464651984.db2.gz WDPIDLANVWJHOC-GXTWGEPZSA-N 1 1 348.403 2.087 20 5 EEBDMO CC(C)c1[nH+]ccn1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000182795175 464729323 /nfs/dbraw/zinc/72/93/23/464729323.db2.gz SNYOKOAZKBNIQB-UHFFFAOYSA-N 1 1 332.316 2.282 20 5 EEBDMO C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000285925037 464744350 /nfs/dbraw/zinc/74/43/50/464744350.db2.gz DYHFITLBQOHCHF-CYBMUJFWSA-N 1 1 343.387 2.055 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)[C@H](C)C1 ZINC000248664950 464784016 /nfs/dbraw/zinc/78/40/16/464784016.db2.gz KXLBGHYUTHZKCQ-OLZOCXBDSA-N 1 1 330.388 2.034 20 5 EEBDMO C[C@@H]1CN(Cc2ccc([N+](=O)[O-])c(F)c2)CC[N@H+]1CC(C)(C)O ZINC000282355233 464786689 /nfs/dbraw/zinc/78/66/89/464786689.db2.gz AXPJOAMROVUHQH-GFCCVEGCSA-N 1 1 325.384 2.011 20 5 EEBDMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000356734145 465513131 /nfs/dbraw/zinc/51/31/31/465513131.db2.gz CEYACBZHONYWHI-NSHDSACASA-N 1 1 346.387 2.307 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000356975111 465672361 /nfs/dbraw/zinc/67/23/61/465672361.db2.gz JKMSPRIGDZVZPA-VXGBXAGGSA-N 1 1 331.376 2.169 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@H](c2[nH+]ccn2C)C1 ZINC000593969000 468447445 /nfs/dbraw/zinc/44/74/45/468447445.db2.gz WHIYVCAYLXFTPF-ZDUSSCGKSA-N 1 1 343.387 2.065 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(CCCn2ccnc2)CC1 ZINC000361063517 465740561 /nfs/dbraw/zinc/74/05/61/465740561.db2.gz RSKGCGIPEPJLBS-UHFFFAOYSA-N 1 1 332.408 2.217 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H]1CCSC1 ZINC000299501954 465778176 /nfs/dbraw/zinc/77/81/76/465778176.db2.gz BRFWTYXZXZTAMG-LBPRGKRZSA-N 1 1 339.417 2.369 20 5 EEBDMO COc1ccc(NC(=O)C[NH2+][C@@H](C)c2cncc(F)c2)c([N+](=O)[O-])c1 ZINC000361136184 465792023 /nfs/dbraw/zinc/79/20/23/465792023.db2.gz PFDOLPPSUXWVAC-JTQLQIEISA-N 1 1 348.334 2.427 20 5 EEBDMO C[C@@H]1COCC[N@H+]1C1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000593990708 468453466 /nfs/dbraw/zinc/45/34/66/468453466.db2.gz JRPRXLIDVFSQSA-OAHLLOKOSA-N 1 1 349.431 2.159 20 5 EEBDMO COc1ccc(-c2ccc(C[N@@H+](C)CCC(N)=O)o2)c([N+](=O)[O-])c1 ZINC000348839276 465830501 /nfs/dbraw/zinc/83/05/01/465830501.db2.gz VZZNGHLMZDUPDF-UHFFFAOYSA-N 1 1 333.344 2.171 20 5 EEBDMO C[C@H](CN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000353504603 465938937 /nfs/dbraw/zinc/93/89/37/465938937.db2.gz SHQGYPQSRSVWMR-DYVFJYSZSA-N 1 1 343.431 2.490 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCCC[C@@H]3CO)n2)c1 ZINC000594015173 468461982 /nfs/dbraw/zinc/46/19/82/468461982.db2.gz VBMSQICIOHOKMZ-CQSZACIVSA-N 1 1 332.360 2.382 20 5 EEBDMO Cc1ccc(C(=O)N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000371989057 466104606 /nfs/dbraw/zinc/10/46/06/466104606.db2.gz XXMBVBORJBHORQ-CVEARBPZSA-N 1 1 347.415 2.276 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1c1c([N+](=O)[O-])ncn1C ZINC000346646761 466124225 /nfs/dbraw/zinc/12/42/25/466124225.db2.gz DAJHEINLPTYLAD-ZIAGYGMSSA-N 1 1 329.404 2.428 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](CCC(F)(F)F)C[C@@H](O)CO ZINC000350009027 466349415 /nfs/dbraw/zinc/34/94/15/466349415.db2.gz JLZAEXHNFSYYKV-CYBMUJFWSA-N 1 1 336.310 2.011 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CCC(F)(F)F)C[C@@H](O)CO ZINC000350009027 466349422 /nfs/dbraw/zinc/34/94/22/466349422.db2.gz JLZAEXHNFSYYKV-CYBMUJFWSA-N 1 1 336.310 2.011 20 5 EEBDMO C[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1CO ZINC000305465261 466410221 /nfs/dbraw/zinc/41/02/21/466410221.db2.gz WQWOHNNFXYOHIQ-RISCZKNCSA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@@H]1CCC[C@@H](CO)[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000305839134 466479310 /nfs/dbraw/zinc/47/93/10/466479310.db2.gz GMRYSTZVRNINJZ-OCCSQVGLSA-N 1 1 349.387 2.128 20 5 EEBDMO Cc1ncc([N+](=O)[O-])cc1-c1nc([C@@H]2C[N@H+]3CCC[C@]3(C)CO2)no1 ZINC000347317167 466559410 /nfs/dbraw/zinc/55/94/10/466559410.db2.gz IQODZHUXXSFYEA-XJKSGUPXSA-N 1 1 345.359 2.274 20 5 EEBDMO CC(C)Oc1cc(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000411616102 466855938 /nfs/dbraw/zinc/85/59/38/466855938.db2.gz JGBPCYDJKHYJAU-ZDUSSCGKSA-N 1 1 333.388 2.349 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+]C[C@H]1c1ccncc1 ZINC000423963580 466930696 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GYDBPAWZUUVJPP-CYBMUJFWSA-N 1 1 346.431 2.258 20 5 EEBDMO C[C@@H](c1ccccc1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)C(N)=O ZINC000428854450 467276639 /nfs/dbraw/zinc/27/66/39/467276639.db2.gz ADMZVFWPDLZWCE-MEDUHNTESA-N 1 1 331.347 2.481 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420343728 467370329 /nfs/dbraw/zinc/37/03/29/467370329.db2.gz RCHZBNUWXZKYCX-LSDHHAIUSA-N 1 1 346.431 2.163 20 5 EEBDMO CNc1ccc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000391660568 467421451 /nfs/dbraw/zinc/42/14/51/467421451.db2.gz KCOJJTYYKCQYRT-ZFWWWQNUSA-N 1 1 332.404 2.193 20 5 EEBDMO C[N@@H+](Cc1ccccc1)C1CN(c2c(C(N)=O)cccc2[N+](=O)[O-])C1 ZINC000420627674 467437662 /nfs/dbraw/zinc/43/76/62/467437662.db2.gz OGAKSIMNDGBBRF-UHFFFAOYSA-N 1 1 340.383 2.014 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000457954392 467739118 /nfs/dbraw/zinc/73/91/18/467739118.db2.gz NVGPRWPZWCFRNP-INIZCTEOSA-N 1 1 334.420 2.261 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000450109060 467778573 /nfs/dbraw/zinc/77/85/73/467778573.db2.gz ZUFBIWNBOOVVOO-MLGOLLRUSA-N 1 1 345.399 2.157 20 5 EEBDMO C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000487225031 468029417 /nfs/dbraw/zinc/02/94/17/468029417.db2.gz VXMLCWGKIYGDCE-GWCFXTLKSA-N 1 1 325.796 2.105 20 5 EEBDMO Cc1c(CNC[C@H](O)C[N@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000591763485 468517363 /nfs/dbraw/zinc/51/73/63/468517363.db2.gz LNGBZIRQAMVGOT-SFHVURJKSA-N 1 1 343.427 2.486 20 5 EEBDMO Cc1c(C[NH2+]C[C@H](O)CN(C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000591763485 468517372 /nfs/dbraw/zinc/51/73/72/468517372.db2.gz LNGBZIRQAMVGOT-SFHVURJKSA-N 1 1 343.427 2.486 20 5 EEBDMO CCCN(C(=O)NCCc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000591994197 468593071 /nfs/dbraw/zinc/59/30/71/468593071.db2.gz FATGIRZBYHISNS-INIZCTEOSA-N 1 1 334.420 2.263 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CCC[N@H+]3CCCC[C@H]23)n1 ZINC000594596541 468630762 /nfs/dbraw/zinc/63/07/62/468630762.db2.gz ANQLUUJNPQVLLZ-WCQYABFASA-N 1 1 334.376 2.205 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CC[N@H+](C(C)(C)C)C1 ZINC000594801417 468691807 /nfs/dbraw/zinc/69/18/07/468691807.db2.gz NRUKAKYXXAMVTC-LBPRGKRZSA-N 1 1 341.433 2.054 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000597925007 468712299 /nfs/dbraw/zinc/71/22/99/468712299.db2.gz MDKVGEGPXWPMKB-ZDUSSCGKSA-N 1 1 335.404 2.353 20 5 EEBDMO CCC[N@H+]1CC[C@H](N[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000595097585 468758229 /nfs/dbraw/zinc/75/82/29/468758229.db2.gz YALXYQOTNSFSEV-RDJZCZTQSA-N 1 1 343.431 2.492 20 5 EEBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000598342569 468836611 /nfs/dbraw/zinc/83/66/11/468836611.db2.gz KZQJXNUJEWAFPT-CQSZACIVSA-N 1 1 332.404 2.383 20 5 EEBDMO CC(C)(C)OC(=O)C[C@@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000593093283 468867669 /nfs/dbraw/zinc/86/76/69/468867669.db2.gz SNQTYHPQMMVTQN-ZDUSSCGKSA-N 1 1 338.408 2.378 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](C)[C@@H]1CCO ZINC000595695890 468958852 /nfs/dbraw/zinc/95/88/52/468958852.db2.gz IYIUCQOSSXQCQS-LRDDRELGSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1CCO ZINC000595698624 468959325 /nfs/dbraw/zinc/95/93/25/468959325.db2.gz NGVOXNIUTXOCMR-DZGCQCFKSA-N 1 1 335.404 2.406 20 5 EEBDMO O=[N+]([O-])c1ccc(CN2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c(F)c1 ZINC000610476231 468978902 /nfs/dbraw/zinc/97/89/02/468978902.db2.gz JVQKANCYSYMWQP-INIZCTEOSA-N 1 1 337.395 2.421 20 5 EEBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](CCN2CCOCC2)CC2CC2)cc1 ZINC000595806726 469020198 /nfs/dbraw/zinc/02/01/98/469020198.db2.gz FPBWACHBYKZXHO-UHFFFAOYSA-N 1 1 349.431 2.018 20 5 EEBDMO CC(C)[C@H]1c2ccccc2CC[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000610783298 469070255 /nfs/dbraw/zinc/07/02/55/469070255.db2.gz JCIBHBVCWZURQV-AEFFLSMTSA-N 1 1 344.415 2.408 20 5 EEBDMO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCN(Cc3c(F)cccc3[N+](=O)[O-])C2)C1 ZINC000593736127 469115750 /nfs/dbraw/zinc/11/57/50/469115750.db2.gz GSZUQADLRZZGFG-PBFPGSCMSA-N 1 1 337.395 2.452 20 5 EEBDMO CCCNC(=O)C[NH+]1CCC(Nc2cc(C)sc2[N+](=O)[O-])CC1 ZINC000596072827 469140307 /nfs/dbraw/zinc/14/03/07/469140307.db2.gz AELKSMHFMOCLNT-UHFFFAOYSA-N 1 1 340.449 2.367 20 5 EEBDMO CNC(=O)C[NH+]1CCC(Nc2ccc(C(F)F)cc2[N+](=O)[O-])CC1 ZINC000596073333 469141051 /nfs/dbraw/zinc/14/10/51/469141051.db2.gz KCIJSLNMRVFGTC-UHFFFAOYSA-N 1 1 342.346 2.155 20 5 EEBDMO C[N@@H+](CCNC(=O)c1c(Br)cccc1[N+](=O)[O-])C1CC1 ZINC000599155995 469141378 /nfs/dbraw/zinc/14/13/78/469141378.db2.gz FOBZPWKRNQBHQT-UHFFFAOYSA-N 1 1 342.193 2.181 20 5 EEBDMO CC[N@H+]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1C ZINC000611091811 469160440 /nfs/dbraw/zinc/16/04/40/469160440.db2.gz TVIVJVQHQXKBLA-GFCCVEGCSA-N 1 1 331.376 2.171 20 5 EEBDMO O=[N+]([O-])c1cccc(C[N@H+](CC[C@@H]2CCS(=O)(=O)C2)C2CC2)c1 ZINC000611171667 469180406 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ZINC000445896403 242140517 /nfs/dbraw/zinc/14/05/17/242140517.db2.gz HZUSSOOEKUTQEK-SWLSCSKDSA-N 1 1 332.404 2.145 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCN3CCCOCC3)C2)cc1 ZINC000451552719 243157438 /nfs/dbraw/zinc/15/74/38/243157438.db2.gz XGNPTOHZKQKNEQ-KRWDZBQOSA-N 1 1 333.432 2.497 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H]2CCCN(CC[N@@H+]3CCCOCC3)C2)cc1 ZINC000451552719 243157439 /nfs/dbraw/zinc/15/74/39/243157439.db2.gz XGNPTOHZKQKNEQ-KRWDZBQOSA-N 1 1 333.432 2.497 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H]2CCCN(CC[N@H+]3CCCOCC3)C2)cc1 ZINC000451552719 243157442 /nfs/dbraw/zinc/15/74/42/243157442.db2.gz XGNPTOHZKQKNEQ-KRWDZBQOSA-N 1 1 333.432 2.497 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](OC)C1 ZINC000076348145 203349235 /nfs/dbraw/zinc/34/92/35/203349235.db2.gz HFHMKDPGRQJIJY-ZDUSSCGKSA-N 1 1 337.376 2.043 20 5 EEBDMO Cc1[nH+]ccn1CCCCNC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000129985136 205219001 /nfs/dbraw/zinc/21/90/01/205219001.db2.gz ITIUXVUXTHQLFV-UHFFFAOYSA-N 1 1 332.360 2.075 20 5 EEBDMO Cc1ccc(CN2CCC(C[NH+]3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000134088650 205392071 /nfs/dbraw/zinc/39/20/71/205392071.db2.gz FGTAOOVDBFBTFR-UHFFFAOYSA-N 1 1 333.432 2.447 20 5 EEBDMO Cc1ccc(C[NH+]2CCC(CN3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000134088650 205392073 /nfs/dbraw/zinc/39/20/73/205392073.db2.gz FGTAOOVDBFBTFR-UHFFFAOYSA-N 1 1 333.432 2.447 20 5 EEBDMO COC(=O)[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000264209627 246184967 /nfs/dbraw/zinc/18/49/67/246184967.db2.gz RZKPILHRAGPAOQ-CYBMUJFWSA-N 1 1 345.355 2.287 20 5 EEBDMO O=C1NC2(CO1)CC[NH+](Cc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC000495292004 247113883 /nfs/dbraw/zinc/11/38/83/247113883.db2.gz OPCOOPJFBMAPJA-UHFFFAOYSA-N 1 1 325.752 2.323 20 5 EEBDMO Cc1ccnc(NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000265146304 247246435 /nfs/dbraw/zinc/24/64/35/247246435.db2.gz AGJOZNUMQRJSDI-MRXNPFEDSA-N 1 1 342.399 2.129 20 5 EEBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(F)c([N+](=O)[O-])cc2F)C1 ZINC000161266447 206338140 /nfs/dbraw/zinc/33/81/40/206338140.db2.gz PJKGBVJZPNNHEA-QMTHXVAHSA-N 1 1 339.342 2.429 20 5 EEBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000163603888 206462489 /nfs/dbraw/zinc/46/24/89/206462489.db2.gz BBLFVLWFRWSRPM-OAHLLOKOSA-N 1 1 349.431 2.458 20 5 EEBDMO CC(C)[N@H+](Cc1ccc(F)cc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266552370 248357487 /nfs/dbraw/zinc/35/74/87/248357487.db2.gz UOJIWAZPLJOTJY-INIZCTEOSA-N 1 1 336.367 2.202 20 5 EEBDMO Cc1c(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@H+]3C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000174664994 207044128 /nfs/dbraw/zinc/04/41/28/207044128.db2.gz OEPXCSZIBKTOHI-NWDGAFQWSA-N 1 1 348.359 2.120 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](CNC(C)=O)C1 ZINC000175134502 207097693 /nfs/dbraw/zinc/09/76/93/207097693.db2.gz JHKXXSWZVMNJRU-AWEZNQCLSA-N 1 1 335.404 2.342 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](CNC(C)=O)C1 ZINC000175134502 207097697 /nfs/dbraw/zinc/09/76/97/207097697.db2.gz JHKXXSWZVMNJRU-AWEZNQCLSA-N 1 1 335.404 2.342 20 5 EEBDMO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000175382090 207121590 /nfs/dbraw/zinc/12/15/90/207121590.db2.gz STZUOVCTKOVHLJ-DAOPMYJZSA-N 1 1 336.417 2.222 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000176442200 207228462 /nfs/dbraw/zinc/22/84/62/207228462.db2.gz DOQURPUQJYNDBF-WBVHZDCISA-N 1 1 346.431 2.406 20 5 EEBDMO CCC[C@H](C)[NH+]1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000177228965 207309999 /nfs/dbraw/zinc/30/99/99/207309999.db2.gz MDBNHPHIPOEABS-ZDUSSCGKSA-N 1 1 341.433 2.090 20 5 EEBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](CCO[C@H]2CCCCO2)CC1 ZINC000185175375 285163588 /nfs/dbraw/zinc/16/35/88/285163588.db2.gz OEYIKZUUPLBIGG-KRWDZBQOSA-N 1 1 335.404 2.260 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CN(C)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000175394867 285241295 /nfs/dbraw/zinc/24/12/95/285241295.db2.gz LAGPJGBVVJQEBN-CYBMUJFWSA-N 1 1 341.433 2.008 20 5 EEBDMO COCC[N@H+]1CC[C@@H](NC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC000267968909 256100473 /nfs/dbraw/zinc/10/04/73/256100473.db2.gz MHQNXAKGZPQAST-CYBMUJFWSA-N 1 1 336.392 2.054 20 5 EEBDMO C[C@H](NC(=O)N[C@@H]1C[N@H+](C2CC2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000268094880 256112376 /nfs/dbraw/zinc/11/23/76/256112376.db2.gz CLTPCIAHFCIZID-MQIPJXDCSA-N 1 1 332.404 2.438 20 5 EEBDMO CCC1(CO)CC[NH+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000270927137 256188387 /nfs/dbraw/zinc/18/83/87/256188387.db2.gz SWIHJIRESBSMGM-CYBMUJFWSA-N 1 1 335.404 2.406 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNS(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000120375269 142387000 /nfs/dbraw/zinc/38/70/00/142387000.db2.gz IYWHXBZMGWZNQS-LBPRGKRZSA-N 1 1 343.449 2.220 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342915144 152678087 /nfs/dbraw/zinc/67/80/87/152678087.db2.gz PBIVPCAKDIUYGJ-OCCSQVGLSA-N 1 1 328.372 2.433 20 5 EEBDMO COc1cc(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000106789429 159322259 /nfs/dbraw/zinc/32/22/59/159322259.db2.gz UDWDEWJHADGNFZ-CYBMUJFWSA-N 1 1 333.388 2.350 20 5 EEBDMO CN(C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ncc([N+](=O)[O-])s1 ZINC000192541322 160171459 /nfs/dbraw/zinc/17/14/59/160171459.db2.gz FDDAHVCAPCSRAR-INIZCTEOSA-N 1 1 348.428 2.125 20 5 EEBDMO C[C@@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H]1C ZINC000245931802 160257979 /nfs/dbraw/zinc/25/79/79/160257979.db2.gz PKKPZVUROKIGMO-GHMZBOCLSA-N 1 1 335.360 2.240 20 5 EEBDMO C[C@@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H]1C ZINC000245931802 160257981 /nfs/dbraw/zinc/25/79/81/160257981.db2.gz PKKPZVUROKIGMO-GHMZBOCLSA-N 1 1 335.360 2.240 20 5 EEBDMO CSCC[C@H](C)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248462549 160347868 /nfs/dbraw/zinc/34/78/68/160347868.db2.gz PZCHCIDKDJUVPM-QWHCGFSZSA-N 1 1 328.434 2.408 20 5 EEBDMO COc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccncc2F)c([N+](=O)[O-])c1 ZINC000338360032 160748018 /nfs/dbraw/zinc/74/80/18/160748018.db2.gz VZJZXHMNLRRDBA-JTQLQIEISA-N 1 1 348.334 2.427 20 5 EEBDMO CCOC(=O)C[C@@H](C)[N@@H+](C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000346330389 161363819 /nfs/dbraw/zinc/36/38/19/161363819.db2.gz KIESEGACGUSILR-LLVKDONJSA-N 1 1 340.376 2.386 20 5 EEBDMO CCn1nccc1C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000352348802 162098808 /nfs/dbraw/zinc/09/88/08/162098808.db2.gz FKAZOIUPEOBCPS-UHFFFAOYSA-N 1 1 331.376 2.272 20 5 EEBDMO COc1c(O)cccc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000352608885 162210458 /nfs/dbraw/zinc/21/04/58/162210458.db2.gz PJTGGDLIFLPTNB-CYBMUJFWSA-N 1 1 344.371 2.390 20 5 EEBDMO COc1c(O)cccc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000352608885 162210460 /nfs/dbraw/zinc/21/04/60/162210460.db2.gz PJTGGDLIFLPTNB-CYBMUJFWSA-N 1 1 344.371 2.390 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](CO)c1ccc(F)cc1 ZINC000359625080 164139561 /nfs/dbraw/zinc/13/95/61/164139561.db2.gz LDIKTUXUVHLMTG-MRXNPFEDSA-N 1 1 347.346 2.304 20 5 EEBDMO C[C@@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000359810307 164176294 /nfs/dbraw/zinc/17/62/94/164176294.db2.gz OWZJBJXCKVDIRF-DOMZBBRYSA-N 1 1 328.372 2.316 20 5 EEBDMO C[C@H](CCN1CC[NH+](C)CC1)Nc1ncc([N+](=O)[O-])cc1Cl ZINC000274451775 269034155 /nfs/dbraw/zinc/03/41/55/269034155.db2.gz IXANSEJEOHYNCU-LLVKDONJSA-N 1 1 327.816 2.081 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000275764082 269140202 /nfs/dbraw/zinc/14/02/02/269140202.db2.gz PBSJYHHDZWKMHB-OCCSQVGLSA-N 1 1 334.376 2.352 20 5 EEBDMO CSc1ccccc1C[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000280428482 269361365 /nfs/dbraw/zinc/36/13/65/269361365.db2.gz MHGHGJAKPYGXMJ-CQSZACIVSA-N 1 1 336.417 2.006 20 5 EEBDMO CO[C@@]1(C)CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000280656298 269383059 /nfs/dbraw/zinc/38/30/59/269383059.db2.gz ZOJZZTAVRVCAIR-RDJZCZTQSA-N 1 1 338.404 2.226 20 5 EEBDMO CCC[C@]1(CO)CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000277706220 274321812 /nfs/dbraw/zinc/32/18/12/274321812.db2.gz IBJXVKJTQAJTLO-GOSISDBHSA-N 1 1 347.415 2.111 20 5 EEBDMO C[C@@H](C[NH+]1CCOCC1)N(C)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000278568337 274374694 /nfs/dbraw/zinc/37/46/94/274374694.db2.gz BNSYHXRAZZHWNS-NSHDSACASA-N 1 1 345.346 2.353 20 5 EEBDMO C[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1cccc(N2CCOC2=O)c1 ZINC000494695696 278356771 /nfs/dbraw/zinc/35/67/71/278356771.db2.gz YATRTQCQBWPNDR-LLVKDONJSA-N 1 1 345.359 2.136 20 5 EEBDMO CC[N@@H+](CCNS(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])C(C)C ZINC000444164128 315277866 /nfs/dbraw/zinc/27/78/66/315277866.db2.gz CXSVUVNKJKGUTG-UHFFFAOYSA-N 1 1 343.449 2.220 20 5 EEBDMO CCOc1cc(C[NH+]2CCC(N3CN=NC3=O)CC2)ccc1[N+](=O)[O-] ZINC000565161344 319154562 /nfs/dbraw/zinc/15/45/62/319154562.db2.gz GOSPWUFPCUQNQJ-UHFFFAOYSA-N 1 1 347.375 2.128 20 5 EEBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](Cc2ccc3[nH]cnc3c2)CC1 ZINC000581054216 324175287 /nfs/dbraw/zinc/17/52/87/324175287.db2.gz WHARSQMNSCDUPS-UHFFFAOYSA-N 1 1 338.371 2.188 20 5 EEBDMO CC[C@](C)([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])C(N)=O ZINC000336810714 465047278 /nfs/dbraw/zinc/04/72/78/465047278.db2.gz IZQROHWECROKNU-LBPRGKRZSA-N 1 1 330.182 2.101 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000341960278 465278158 /nfs/dbraw/zinc/27/81/58/465278158.db2.gz GTQYLTISYUFPQN-ZDUSSCGKSA-N 1 1 343.449 2.302 20 5 EEBDMO CCOC(=O)C(C)(C)[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337325710 465306131 /nfs/dbraw/zinc/30/61/31/465306131.db2.gz VKRCXONOPFHJPB-UHFFFAOYSA-N 1 1 337.376 2.197 20 5 EEBDMO CCOC(=O)C(C)(C)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337325710 465306134 /nfs/dbraw/zinc/30/61/34/465306134.db2.gz VKRCXONOPFHJPB-UHFFFAOYSA-N 1 1 337.376 2.197 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CCO[C@@H](C)[C@H]2C)c([N+](=O)[O-])c1 ZINC000298363010 465375037 /nfs/dbraw/zinc/37/50/37/465375037.db2.gz GBNMOHOHJTVAGL-NEPJUHHUSA-N 1 1 337.376 2.041 20 5 EEBDMO COc1cc(C[N@@H+]2C[C@@H](C)[C@@H](O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000351815154 465378669 /nfs/dbraw/zinc/37/86/69/465378669.db2.gz UXAHIDYCIUXVFB-KCJUWKMLSA-N 1 1 332.303 2.017 20 5 EEBDMO COc1cc(C[N@H+]2C[C@@H](C)[C@@H](O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000351815154 465378673 /nfs/dbraw/zinc/37/86/73/465378673.db2.gz UXAHIDYCIUXVFB-KCJUWKMLSA-N 1 1 332.303 2.017 20 5 EEBDMO C[C@@H]1CC[N@@H+](CCN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552048270 468302196 /nfs/dbraw/zinc/30/21/96/468302196.db2.gz MSZQGPGKSODDFY-RHSMWYFYSA-N 1 1 343.431 2.349 20 5 EEBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000113197727 462575899 /nfs/dbraw/zinc/57/58/99/462575899.db2.gz SGUGWTKUVWAKNP-CQSZACIVSA-N 1 1 334.420 2.387 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)n1 ZINC000153290367 462635098 /nfs/dbraw/zinc/63/50/98/462635098.db2.gz BYRBZFJJAXQCCS-UHFFFAOYSA-N 1 1 331.332 2.364 20 5 EEBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccccc1 ZINC000089644493 462702719 /nfs/dbraw/zinc/70/27/19/462702719.db2.gz 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ZINC000346307274 466080758 /nfs/dbraw/zinc/08/07/58/466080758.db2.gz BMBJKIWUUTVWLA-TVYUQYBPSA-N 1 1 328.315 2.399 20 5 EEBDMO Cc1c(CNC(=O)[C@H]2CCC[N@H+]2C2CCOCC2)cccc1[N+](=O)[O-] ZINC000331609344 466161420 /nfs/dbraw/zinc/16/14/20/466161420.db2.gz PCBHNBBYSSWIEU-QGZVFWFLSA-N 1 1 347.415 2.163 20 5 EEBDMO C[C@@H](C[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](C)CO)c1ccccc1 ZINC000347367245 466594223 /nfs/dbraw/zinc/59/42/23/466594223.db2.gz MKDPDPIHUMXIJF-LSDHHAIUSA-N 1 1 332.404 2.278 20 5 EEBDMO Cc1c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000363935980 466660532 /nfs/dbraw/zinc/66/05/32/466660532.db2.gz CXXZXYYDHZILSG-VXGBXAGGSA-N 1 1 348.359 2.168 20 5 EEBDMO C[C@H]1COc2ccccc2C[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000374657730 466706879 /nfs/dbraw/zinc/70/68/79/466706879.db2.gz ABAIPYURNMFFPA-ZDUSSCGKSA-N 1 1 329.356 2.040 20 5 EEBDMO C[C@H]1COc2ccccc2C[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000374657730 466706885 /nfs/dbraw/zinc/70/68/85/466706885.db2.gz ABAIPYURNMFFPA-ZDUSSCGKSA-N 1 1 329.356 2.040 20 5 EEBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411382195 466818196 /nfs/dbraw/zinc/81/81/96/466818196.db2.gz JYYNXQYJKCFTOA-AFAVFJNCSA-N 1 1 329.400 2.299 20 5 EEBDMO Cn1ncc2c1CCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000411857364 466918605 /nfs/dbraw/zinc/91/86/05/466918605.db2.gz SBUAPKSWPJFUEC-UHFFFAOYSA-N 1 1 343.387 2.105 20 5 EEBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000411977059 466954425 /nfs/dbraw/zinc/95/44/25/466954425.db2.gz XRCXSIJFLCPOPU-GOSISDBHSA-N 1 1 325.368 2.224 20 5 EEBDMO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H]1CCc2cn[nH]c2C1 ZINC000374469305 467055011 /nfs/dbraw/zinc/05/50/11/467055011.db2.gz PNMWQGIPHYGOSP-RISCZKNCSA-N 1 1 343.387 2.182 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000412354530 467072857 /nfs/dbraw/zinc/07/28/57/467072857.db2.gz BLILCVDEBONAKL-LZLYRXPVSA-N 1 1 329.400 2.253 20 5 EEBDMO CCOC(=O)c1ccnc(N(C)[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-] ZINC000450949168 467213507 /nfs/dbraw/zinc/21/35/07/467213507.db2.gz AAJPFCONTAJDPZ-LBPRGKRZSA-N 1 1 336.392 2.085 20 5 EEBDMO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1nc2ncccn2n1 ZINC000414262488 467395659 /nfs/dbraw/zinc/39/56/59/467395659.db2.gz IUIBEKXEJZARKA-LBPRGKRZSA-N 1 1 326.360 2.143 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](c2nnc(C)[nH]2)C1 ZINC000430228212 467410061 /nfs/dbraw/zinc/41/00/61/467410061.db2.gz RNARUGXHPANUPG-CYBMUJFWSA-N 1 1 331.376 2.410 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](c2nc(C)n[nH]2)C1 ZINC000430228212 467410064 /nfs/dbraw/zinc/41/00/64/467410064.db2.gz RNARUGXHPANUPG-CYBMUJFWSA-N 1 1 331.376 2.410 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](c2nc(C)n[nH]2)C1 ZINC000430228212 467410067 /nfs/dbraw/zinc/41/00/67/467410067.db2.gz RNARUGXHPANUPG-CYBMUJFWSA-N 1 1 331.376 2.410 20 5 EEBDMO C[C@@H]1CN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[C@@H](C)C[N@@H+]1C ZINC000408074308 467504689 /nfs/dbraw/zinc/50/46/89/467504689.db2.gz VYRMGNOHXUNJJS-KGLIPLIRSA-N 1 1 346.431 2.360 20 5 EEBDMO C[C@@H]1CN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1C ZINC000408074308 467504692 /nfs/dbraw/zinc/50/46/92/467504692.db2.gz VYRMGNOHXUNJJS-KGLIPLIRSA-N 1 1 346.431 2.360 20 5 EEBDMO CCN1CCN(C[C@H](C)C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449130804 467620009 /nfs/dbraw/zinc/62/00/09/467620009.db2.gz HWXNUVGUOSDLDU-IAGOWNOFSA-N 1 1 348.491 2.389 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]C[C@@H](O)C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449738340 467704168 /nfs/dbraw/zinc/70/41/68/467704168.db2.gz BDRTWGIHRBYWTH-HZPDHXFCSA-N 1 1 330.388 2.168 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000457102176 467752842 /nfs/dbraw/zinc/75/28/42/467752842.db2.gz ZOWZVYBKFGQNMJ-INIZCTEOSA-N 1 1 347.415 2.499 20 5 EEBDMO O=C1OC2(CCCC2)CN1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000497101581 467834421 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332.404 2.361 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000597855046 468693948 /nfs/dbraw/zinc/69/39/48/468693948.db2.gz PWCYSOWZHQGWFX-NSHDSACASA-N 1 1 345.403 2.321 20 5 EEBDMO CC(C)(C)[N@@H+]1CC[C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000597855046 468693955 /nfs/dbraw/zinc/69/39/55/468693955.db2.gz PWCYSOWZHQGWFX-NSHDSACASA-N 1 1 345.403 2.321 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000597855046 468693962 /nfs/dbraw/zinc/69/39/62/468693962.db2.gz PWCYSOWZHQGWFX-NSHDSACASA-N 1 1 345.403 2.321 20 5 EEBDMO CN(CCN1CC[NH2+]CC1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000592428402 468696072 /nfs/dbraw/zinc/69/60/72/468696072.db2.gz IEPFSNWCYXSMNJ-UHFFFAOYSA-N 1 1 344.415 2.192 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@H](CO)CC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000595088517 468756564 /nfs/dbraw/zinc/75/65/64/468756564.db2.gz IYRFQSJGCSZMBV-YOEHRIQHSA-N 1 1 344.415 2.416 20 5 EEBDMO O=C1[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C[C@H]2CCCCN12 ZINC000601173053 468769847 /nfs/dbraw/zinc/76/98/47/468769847.db2.gz PVKPSQVRFUCKEP-BDJLRTHQSA-N 1 1 326.356 2.130 20 5 EEBDMO CC(C)(C)N1CC[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1=O ZINC000601182278 468773724 /nfs/dbraw/zinc/77/37/24/468773724.db2.gz SEILMAMAEZFPKG-OAHLLOKOSA-N 1 1 328.372 2.376 20 5 EEBDMO Cc1[nH+]c2c(n1CCO)CC[C@@H](Nc1ccc(C)cc1[N+](=O)[O-])C2 ZINC000601184040 468774152 /nfs/dbraw/zinc/77/41/52/468774152.db2.gz JMXQWFSPICDXME-CYBMUJFWSA-N 1 1 330.388 2.370 20 5 EEBDMO CCCN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CC[N@@H+](C)C1 ZINC000592831699 468799141 /nfs/dbraw/zinc/79/91/41/468799141.db2.gz NTPVWZMCCPUIOV-GFCCVEGCSA-N 1 1 331.376 2.027 20 5 EEBDMO CCCN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@@H]1CC[N@H+](C)C1 ZINC000592831699 468799143 /nfs/dbraw/zinc/79/91/43/468799143.db2.gz NTPVWZMCCPUIOV-GFCCVEGCSA-N 1 1 331.376 2.027 20 5 EEBDMO CCCN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@@H]1CC[N@@H+](C)C1 ZINC000592831699 468799146 /nfs/dbraw/zinc/79/91/46/468799146.db2.gz NTPVWZMCCPUIOV-GFCCVEGCSA-N 1 1 331.376 2.027 20 5 EEBDMO CCCN(C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000592829783 468799190 /nfs/dbraw/zinc/79/91/90/468799190.db2.gz YSMOZJBVXDANOQ-AWEZNQCLSA-N 1 1 335.404 2.468 20 5 EEBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000595294009 468802448 /nfs/dbraw/zinc/80/24/48/468802448.db2.gz HQFMDHBRHGMJPC-DGCLKSJQSA-N 1 1 338.408 2.408 20 5 EEBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000595294009 468802451 /nfs/dbraw/zinc/80/24/51/468802451.db2.gz HQFMDHBRHGMJPC-DGCLKSJQSA-N 1 1 338.408 2.408 20 5 EEBDMO CC(C)O[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000593053756 468853532 /nfs/dbraw/zinc/85/35/32/468853532.db2.gz LPPLDVXIYYJFAS-HUUCEWRRSA-N 1 1 338.404 2.224 20 5 EEBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595474542 468867457 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EEBDMO CC[N@@H+](C)CCC(=O)N1CCC(C)(Nc2ccc([N+](=O)[O-])cn2)CC1 ZINC001112354179 1304483851 /nfs/dbraw/zinc/48/38/51/1304483851.db2.gz XHAJCACUYYBFSP-UHFFFAOYSA-N 1 1 349.435 2.125 20 5 EEBDMO CSCCC(=O)NCCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001233672557 1304553648 /nfs/dbraw/zinc/55/36/48/1304553648.db2.gz YXOSWGNUFLOJEU-UHFFFAOYSA-N 1 1 325.434 2.286 20 5 EEBDMO Cc1ccc(C(=O)NCCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)n1C ZINC001233916026 1304639154 /nfs/dbraw/zinc/63/91/54/1304639154.db2.gz KVSHWLDLORBMDP-UHFFFAOYSA-N 1 1 344.415 2.494 20 5 EEBDMO Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)c1cc(C[NH+](C)C)on1)CC2 ZINC001116531084 1305891663 /nfs/dbraw/zinc/89/16/63/1305891663.db2.gz ZINGIYZYMPQEKR-UHFFFAOYSA-N 1 1 330.344 2.156 20 5 EEBDMO C[C@H](NC(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000836316264 1314987779 /nfs/dbraw/zinc/98/77/79/1314987779.db2.gz OUOSAQRMOXWGCN-SWLSCSKDSA-N 1 1 332.404 2.439 20 5 EEBDMO CC(C)[N@H+]1CCCC[C@@H]1COC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000838284655 1315149031 /nfs/dbraw/zinc/14/90/31/1315149031.db2.gz LLHMKRYWGUSMBK-HZPDHXFCSA-N 1 1 336.388 2.434 20 5 EEBDMO CO[C@@H]1CC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C[C@@H]1C ZINC000840122623 1315302242 /nfs/dbraw/zinc/30/22/42/1315302242.db2.gz ISUMKRZNDHEIOC-SWLSCSKDSA-N 1 1 331.376 2.168 20 5 EEBDMO CO[C@@H]1CC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C[C@@H]1C ZINC000840122623 1315302247 /nfs/dbraw/zinc/30/22/47/1315302247.db2.gz ISUMKRZNDHEIOC-SWLSCSKDSA-N 1 1 331.376 2.168 20 5 EEBDMO Cc1nn(CN(C)[C@H]2CC[N@H+](C(C)C)C2)c2ncc([N+](=O)[O-])cc12 ZINC000840152153 1315311551 /nfs/dbraw/zinc/31/15/51/1315311551.db2.gz CUYBCSORWDFUSF-ZDUSSCGKSA-N 1 1 332.408 2.020 20 5 EEBDMO Cc1cc(Cc2noc(C[NH2+]C[C@@H]3CCCO3)n2)ccc1[N+](=O)[O-] ZINC000843192927 1315863779 /nfs/dbraw/zinc/86/37/79/1315863779.db2.gz ZPXGRKXFPHOABQ-ZDUSSCGKSA-N 1 1 332.360 2.146 20 5 EEBDMO O=C(CCCC[NH+]1CCCC1)NCCNCc1ccccc1[N+](=O)[O-] ZINC001153315055 1316809801 /nfs/dbraw/zinc/80/98/01/1316809801.db2.gz VXSGMFBUJDNKDH-UHFFFAOYSA-N 1 1 348.447 2.067 20 5 EEBDMO Cc1cncnc1O[C@@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254606114 1318142284 /nfs/dbraw/zinc/14/22/84/1318142284.db2.gz DZJCDSOXCZJPFC-DLBZAZTESA-N 1 1 340.383 2.314 20 5 EEBDMO Cc1cnc(O[C@H]2CC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)nc1 ZINC001254611787 1318146264 /nfs/dbraw/zinc/14/62/64/1318146264.db2.gz SYNNBRQPBCROPI-SJORKVTESA-N 1 1 340.383 2.314 20 5 EEBDMO COc1nc(NCCC[N@H+]2CCCC[C@H]2C)nc(OC)c1[N+](=O)[O-] ZINC001156929358 1318295818 /nfs/dbraw/zinc/29/58/18/1318295818.db2.gz UQFAAKGPZYHMAS-LLVKDONJSA-N 1 1 339.396 2.078 20 5 EEBDMO COc1cc(N2CCC([N@@H+]3C[C@H]4C[C@@H](C3)O4)CC2)ccc1[N+](=O)[O-] ZINC001256100260 1318648132 /nfs/dbraw/zinc/64/81/32/1318648132.db2.gz CEXNBAOZQNYKCU-GASCZTMLSA-N 1 1 333.388 2.045 20 5 EEBDMO CN(c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)[C@H]1CCC2(C1)OCCO2 ZINC001157722257 1318819280 /nfs/dbraw/zinc/81/92/80/1318819280.db2.gz IKFXHBUBYXSUME-DYLGSBMWSA-N 1 1 348.403 2.254 20 5 EEBDMO O=C(NCCC[NH2+]Cc1cccc2ccccc21)[C@@H]1CC1[N+](=O)[O-] ZINC001157766926 1318845815 /nfs/dbraw/zinc/84/58/15/1318845815.db2.gz BVBZZUUENWTOHV-IAGOWNOFSA-N 1 1 327.384 2.101 20 5 EEBDMO O=[N+]([O-])c1cc(-c2ccc(N3CC[N@H+]4CC[C@H]4C3)nn2)ccc1F ZINC001158431308 1319235102 /nfs/dbraw/zinc/23/51/02/1319235102.db2.gz OXHDZCXQRANTIP-LBPRGKRZSA-N 1 1 329.335 2.085 20 5 EEBDMO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](Nc1c(Cl)[n+]([O-])ccc1[N+](=O)[O-])C2 ZINC001160472447 1320171399 /nfs/dbraw/zinc/17/13/99/1320171399.db2.gz DQQYTKAMDYYCFM-RTCCRHLQSA-N 1 1 326.784 2.309 20 5 EEBDMO CC[N@H+]1CCC[C@@H](CNc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1 ZINC001327616059 1334322940 /nfs/dbraw/zinc/32/29/40/1334322940.db2.gz HVHLYDLXNQVFKB-NSHDSACASA-N 1 1 331.376 2.387 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@H+]2C2CC2)c(-c2nn[nH]n2)c1 ZINC001609602169 1352031546 /nfs/dbraw/zinc/03/15/46/1352031546.db2.gz PAOBIRJRJQKNHP-CYBMUJFWSA-N 1 1 343.391 2.204 20 5 EEBDMO 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328.372 2.093 20 5 EEBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000128540103 770710760 /nfs/dbraw/zinc/71/07/60/770710760.db2.gz SLTVHRZPORFHKP-GASCZTMLSA-N 1 1 346.431 2.116 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NC[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001091350142 790345266 /nfs/dbraw/zinc/34/52/66/790345266.db2.gz GPOFSTUECQMKAN-OTVXOJSOSA-N 1 1 334.420 2.242 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CC3(Br)CC3)C2)nc1 ZINC000846827408 790607867 /nfs/dbraw/zinc/60/78/67/790607867.db2.gz USXKQUFKWXGORS-JTQLQIEISA-N 1 1 341.209 2.404 20 5 EEBDMO Cn1ncc([N+](=O)[O-])c1N1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000893829631 780207573 /nfs/dbraw/zinc/20/75/73/780207573.db2.gz QWGKKSZDDVKKON-SFHVURJKSA-N 1 1 341.415 2.431 20 5 EEBDMO CCC[N@H+]1CCC[C@H](C(=O)NCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000906636996 784039160 /nfs/dbraw/zinc/03/91/60/784039160.db2.gz RCTWOEWLKOZNLQ-AWEZNQCLSA-N 1 1 335.404 2.212 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC000906790827 784161346 /nfs/dbraw/zinc/16/13/46/784161346.db2.gz JHTKHGIDBHYTMM-JOYOIKCWSA-N 1 1 340.811 2.243 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2nccc(C(F)(F)F)n2)cc1 ZINC000819367962 785535086 /nfs/dbraw/zinc/53/50/86/785535086.db2.gz MEJWBMOLCOPEBZ-NSHDSACASA-N 1 1 342.277 2.227 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]Cc2cccc(Cl)c2)CC1 ZINC000996429246 786395897 /nfs/dbraw/zinc/39/58/97/786395897.db2.gz NOJZUTNWABKWPJ-HUUCEWRRSA-N 1 1 337.807 2.086 20 5 EEBDMO COCCCOC1CC[NH+](Cn2ncc3ccc([N+](=O)[O-])cc32)CC1 ZINC000172913210 791792102 /nfs/dbraw/zinc/79/21/02/791792102.db2.gz LUNGJUDHHOPRLP-UHFFFAOYSA-N 1 1 348.403 2.420 20 5 EEBDMO NC(=O)C[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000690817049 792065047 /nfs/dbraw/zinc/06/50/47/792065047.db2.gz YQQXTPAZNJXHHD-SECBINFHSA-N 1 1 342.193 2.055 20 5 EEBDMO NC(=O)C[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000690817049 792065038 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2.335 20 5 EEBDMO CN(CC[NH+](C)C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014183 797196973 /nfs/dbraw/zinc/19/69/73/797196973.db2.gz MOUKDVYURRNHDS-UHFFFAOYSA-N 1 1 342.390 2.335 20 5 EEBDMO Cc1cc(NC2CCN(C(=O)C[N@H+](C)C(C)C)CC2)ncc1[N+](=O)[O-] ZINC001095228513 797551747 /nfs/dbraw/zinc/55/17/47/797551747.db2.gz KLMDMIBUKPFPGC-UHFFFAOYSA-N 1 1 349.435 2.041 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)C[C@@H]2C1 ZINC000823806237 798768108 /nfs/dbraw/zinc/76/81/08/798768108.db2.gz MOSGZMFTZMKUPV-KOLCDFICSA-N 1 1 341.770 2.411 20 5 EEBDMO [NH3+]CCc1nc(-c2ccccc2)nn1-c1ccc2[nH]cnc2c1[N+](=O)[O-] ZINC001168714054 799929534 /nfs/dbraw/zinc/92/95/34/799929534.db2.gz DVWMTGJYKBXWLY-UHFFFAOYSA-N 1 1 349.354 2.220 20 5 EEBDMO CC(C)c1ccc(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC001086083246 802111688 /nfs/dbraw/zinc/11/16/88/802111688.db2.gz RXGISPABHWLGNZ-BZZMCLGOSA-N 1 1 345.443 2.460 20 5 EEBDMO CCOC[C@@H]1C[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2nn(CC)cc21 ZINC001169025338 803591318 /nfs/dbraw/zinc/59/13/18/803591318.db2.gz YRRCPUVRBUBYDA-SOUVJXGZSA-N 1 1 336.436 2.284 20 5 EEBDMO CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2nn(CC)cc21 ZINC001169025338 803591320 /nfs/dbraw/zinc/59/13/20/803591320.db2.gz YRRCPUVRBUBYDA-SOUVJXGZSA-N 1 1 336.436 2.284 20 5 EEBDMO O=C1C[C@@H]2[C@H](CC[N@@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)N1c1ccsc1 ZINC001169026950 803592472 /nfs/dbraw/zinc/59/24/72/803592472.db2.gz ZJAFVKHNKNKCIC-MYZSUADSSA-N 1 1 335.429 2.373 20 5 EEBDMO CCN(CC)C(=O)[C@H](C)Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001156368242 803988098 /nfs/dbraw/zinc/98/80/98/803988098.db2.gz BCMUFRPIGQWCNH-BCPZQOPPSA-N 1 1 335.408 2.191 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)N(C)CCCNc1ccc([N+](=O)[O-])c(C)c1 ZINC001109455782 805494924 /nfs/dbraw/zinc/49/49/24/805494924.db2.gz PXHPQKSDZOHRRN-UHFFFAOYSA-N 1 1 345.403 2.369 20 5 EEBDMO CC(C)[C@H](C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000787960092 807315217 /nfs/dbraw/zinc/31/52/17/807315217.db2.gz HDSFOPQECGKFRE-BXUZGUMPSA-N 1 1 337.376 2.051 20 5 EEBDMO C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)Cc1ccccc1 ZINC000791335917 809185049 /nfs/dbraw/zinc/18/50/49/809185049.db2.gz JXQQMALKAGEOAO-UHFFFAOYSA-N 1 1 346.362 2.178 20 5 EEBDMO Cc1cc(NC(=O)N2CC[C@H](C[NH+]3CCOCC3)C2)cc([N+](=O)[O-])c1 ZINC001517937737 1119047811 /nfs/dbraw/zinc/04/78/11/1119047811.db2.gz YIHFWXCWJFYPAH-CQSZACIVSA-N 1 1 348.403 2.089 20 5 EEBDMO C[C@@H](c1ccc(S(N)(=O)=O)cc1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000028727284 539331099 /nfs/dbraw/zinc/33/10/99/539331099.db2.gz NTCOHBAVFPPZLS-LBPRGKRZSA-N 1 1 349.412 2.435 20 5 EEBDMO C[C@@H](c1ccc(S(N)(=O)=O)cc1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000028727284 539331102 /nfs/dbraw/zinc/33/11/02/539331102.db2.gz NTCOHBAVFPPZLS-LBPRGKRZSA-N 1 1 349.412 2.435 20 5 EEBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCc2sccc2C1 ZINC000184307868 235363772 /nfs/dbraw/zinc/36/37/72/235363772.db2.gz KOEAGYSORIVQLD-UHFFFAOYSA-N 1 1 346.412 2.027 20 5 EEBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCc2sccc2C1 ZINC000184307868 235363774 /nfs/dbraw/zinc/36/37/74/235363774.db2.gz KOEAGYSORIVQLD-UHFFFAOYSA-N 1 1 346.412 2.027 20 5 EEBDMO NC(=O)c1cccc([N+](=O)[O-])c1N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000420608741 283386864 /nfs/dbraw/zinc/38/68/64/283386864.db2.gz IZPINOGGSHTSQB-WFASDCNBSA-N 1 1 344.415 2.147 20 5 EEBDMO C[C@H](C[C@@H]1COCC[NH2+]1)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000423087510 240358456 /nfs/dbraw/zinc/35/84/56/240358456.db2.gz OIFNCSDQKOEBLW-ZWNOBZJWSA-N 1 1 347.337 2.470 20 5 EEBDMO C[N@@H+]1CC=C(CNc2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000273948145 201263891 /nfs/dbraw/zinc/26/38/91/201263891.db2.gz MLXILGLUSMTOIS-UHFFFAOYSA-N 1 1 327.182 2.426 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000081364339 201356240 /nfs/dbraw/zinc/35/62/40/201356240.db2.gz GKPWYTHUQXOZAA-AWEZNQCLSA-N 1 1 335.404 2.164 20 5 EEBDMO Cc1ccc(NCCCNC(=O)[C@H]2CCC[N@H+]2C2CC2)c([N+](=O)[O-])c1 ZINC000426782304 241338792 /nfs/dbraw/zinc/33/87/92/241338792.db2.gz GDTRKSDPLGBJFW-MRXNPFEDSA-N 1 1 346.431 2.448 20 5 EEBDMO CS(=O)(=O)CCC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451551723 243155451 /nfs/dbraw/zinc/15/54/51/243155451.db2.gz UVDHIAIZKWMJJR-CQSZACIVSA-N 1 1 326.418 2.209 20 5 EEBDMO CS(=O)(=O)CCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451551723 243155456 /nfs/dbraw/zinc/15/54/56/243155456.db2.gz UVDHIAIZKWMJJR-CQSZACIVSA-N 1 1 326.418 2.209 20 5 EEBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1 ZINC000451637247 243185946 /nfs/dbraw/zinc/18/59/46/243185946.db2.gz XIWZQEHMQHKDHU-CORIIIEPSA-N 1 1 343.387 2.342 20 5 EEBDMO C[C@H](C[NH+]1CCN(C)CC1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000070036962 203072124 /nfs/dbraw/zinc/07/21/24/203072124.db2.gz MXACZRUCDRZSSA-CYBMUJFWSA-N 1 1 329.404 2.191 20 5 EEBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@@H+](C)C2)cc1SC ZINC000104184369 204100646 /nfs/dbraw/zinc/10/06/46/204100646.db2.gz GLHAXCWHKRYGSA-SNVBAGLBSA-N 1 1 339.417 2.007 20 5 EEBDMO CC(C)(C)C[N@@H+](CCCO)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000111230172 204343633 /nfs/dbraw/zinc/34/36/33/204343633.db2.gz VCPWGHKZTSRJJE-UHFFFAOYSA-N 1 1 349.431 2.214 20 5 EEBDMO CCC[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)CC[N@@H+]1CCOC ZINC000128199310 205137163 /nfs/dbraw/zinc/13/71/63/205137163.db2.gz GDFZFTLGSHURJJ-MRXNPFEDSA-N 1 1 335.404 2.168 20 5 EEBDMO CCC[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000128199310 205137167 /nfs/dbraw/zinc/13/71/67/205137167.db2.gz GDFZFTLGSHURJJ-MRXNPFEDSA-N 1 1 335.404 2.168 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(CCCC[NH+]3CCOCC3)n2)c1 ZINC000265010970 247133521 /nfs/dbraw/zinc/13/35/21/247133521.db2.gz PUVUQNAJMVSZHT-UHFFFAOYSA-N 1 1 332.360 2.300 20 5 EEBDMO Cc1[nH+]ccn1CCNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000265076950 247183596 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1 1 334.376 2.238 20 5 EEBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000174678969 207045254 /nfs/dbraw/zinc/04/52/54/207045254.db2.gz DEPVXJGKISCDGZ-GXTWGEPZSA-N 1 1 337.807 2.486 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1CCn1cc([N+](=O)[O-])cn1 ZINC000174872785 207067611 /nfs/dbraw/zinc/06/76/11/207067611.db2.gz SIBVBISSRDHSKB-MRXNPFEDSA-N 1 1 343.431 2.388 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)n1 ZINC000267056607 256022645 /nfs/dbraw/zinc/02/26/45/256022645.db2.gz HRDPIXBZGONAEK-UHFFFAOYSA-N 1 1 338.371 2.457 20 5 EEBDMO C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)CC[N@H+]1Cc1ccccc1 ZINC000267512065 256065328 /nfs/dbraw/zinc/06/53/28/256065328.db2.gz MCAIDWBWYKFAGY-OCCSQVGLSA-N 1 1 342.403 2.432 20 5 EEBDMO COc1ccc(NC(=O)CC[N@@H+](C)[C@@H]2CCSC2)c([N+](=O)[O-])c1 ZINC000270457522 256137352 /nfs/dbraw/zinc/13/73/52/256137352.db2.gz LTZVVEAFYAZZBE-LLVKDONJSA-N 1 1 339.417 2.369 20 5 EEBDMO COCCCC[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000274021730 256346798 /nfs/dbraw/zinc/34/67/98/256346798.db2.gz LQHOEZKWUCYFKX-UHFFFAOYSA-N 1 1 347.419 2.410 20 5 EEBDMO O=c1c(Br)cc([N+](=O)[O-])cn1Cc1cn2ccccc2[nH+]1 ZINC000120173214 142381788 /nfs/dbraw/zinc/38/17/88/142381788.db2.gz LQLKKLLMDGDHKE-UHFFFAOYSA-N 1 1 349.144 2.215 20 5 EEBDMO Cc1nn(C)c(C)c1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173465219 152167272 /nfs/dbraw/zinc/16/72/72/152167272.db2.gz JTUPCUZEANPHMM-CYBMUJFWSA-N 1 1 330.392 2.027 20 5 EEBDMO COC(=O)[C@@H](C)C[N@@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000252441530 160391656 /nfs/dbraw/zinc/39/16/56/160391656.db2.gz NHLSEIVVVUQRSE-WDEREUQCSA-N 1 1 348.359 2.447 20 5 EEBDMO O=C(NCC1CC1)[C@H]1CCC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000067387279 159011412 /nfs/dbraw/zinc/01/14/12/159011412.db2.gz XXMKVACTYBPURW-HNNXBMFYSA-N 1 1 347.415 2.212 20 5 EEBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000098099217 159249844 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EEBDMO COc1cc(CN2CCC([N@H+]3CCO[C@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC000351977697 162011386 /nfs/dbraw/zinc/01/13/86/162011386.db2.gz JNCGPBNBOOVFME-CQSZACIVSA-N 1 1 349.431 2.289 20 5 EEBDMO COc1cc(C[NH+]2CCC(N3CCO[C@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC000351977697 162011390 /nfs/dbraw/zinc/01/13/90/162011390.db2.gz JNCGPBNBOOVFME-CQSZACIVSA-N 1 1 349.431 2.289 20 5 EEBDMO CC(C)[C@@H](O)CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353515865 162595851 /nfs/dbraw/zinc/59/58/51/162595851.db2.gz FYIRZMVVVZOKMH-JKSUJKDBSA-N 1 1 332.404 2.414 20 5 EEBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000376575663 167353420 /nfs/dbraw/zinc/35/34/20/167353420.db2.gz WDZDGUIIKRGTCE-HOTGVXAUSA-N 1 1 346.431 2.406 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000270912593 274344159 /nfs/dbraw/zinc/34/41/59/274344159.db2.gz SPZMHFAXCHDMOI-IAQYHMDHSA-N 1 1 340.383 2.356 20 5 EEBDMO CCCNC(=O)C[NH+]1CCC(Nc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000286115280 274838250 /nfs/dbraw/zinc/83/82/50/274838250.db2.gz LZFUUSHWUQUVST-UHFFFAOYSA-N 1 1 338.383 2.136 20 5 EEBDMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000290865322 275247304 /nfs/dbraw/zinc/24/73/04/275247304.db2.gz CBBGIVSQSASWRT-GFCCVEGCSA-N 1 1 332.404 2.464 20 5 EEBDMO Cc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000291668961 275328127 /nfs/dbraw/zinc/32/81/27/275328127.db2.gz BDBVYLBDUGUYER-OCCSQVGLSA-N 1 1 343.387 2.019 20 5 EEBDMO CCc1nocc1C[N@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000293371327 293192302 /nfs/dbraw/zinc/19/23/02/293192302.db2.gz JFGGPZWFBBPJBJ-AWEZNQCLSA-N 1 1 335.360 2.017 20 5 EEBDMO CCc1nocc1C[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000293371327 293192303 /nfs/dbraw/zinc/19/23/03/293192303.db2.gz JFGGPZWFBBPJBJ-AWEZNQCLSA-N 1 1 335.360 2.017 20 5 EEBDMO COC(=O)Cc1ccc(N(C)C[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1 ZINC000297026582 294133071 /nfs/dbraw/zinc/13/30/71/294133071.db2.gz HCIXGVXKFGVCGC-AWEZNQCLSA-N 1 1 335.404 2.088 20 5 EEBDMO Cc1[nH+]ccn1CCCCn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000158825199 311332968 /nfs/dbraw/zinc/33/29/68/311332968.db2.gz AGFUUHZYWUAPTH-UHFFFAOYSA-N 1 1 343.343 2.397 20 5 EEBDMO [NH3+]CC[C@H]1CCCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000443061914 315227311 /nfs/dbraw/zinc/22/73/11/315227311.db2.gz SMRZCURBZSMPSY-GFCCVEGCSA-N 1 1 331.376 2.206 20 5 EEBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)c1cc([N+](=O)[O-])cn1C ZINC000578309270 320306385 /nfs/dbraw/zinc/30/63/85/320306385.db2.gz XWBRVLGYOCIZQU-UHFFFAOYSA-N 1 1 334.376 2.120 20 5 EEBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CC[NH+](Cc2ccccc2)CC1 ZINC000336726465 465045286 /nfs/dbraw/zinc/04/52/86/465045286.db2.gz VPFOWJHVTLVNTC-UHFFFAOYSA-N 1 1 329.404 2.442 20 5 EEBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 ZINC000347603100 465116820 /nfs/dbraw/zinc/11/68/20/465116820.db2.gz UXRKTYBQDDFVTF-UHFFFAOYSA-N 1 1 330.344 2.310 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCO)[C@@H]1CC[C@H](C)C1 ZINC000351618482 465254742 /nfs/dbraw/zinc/25/47/42/465254742.db2.gz HLRVQURBVIEFPD-GXTWGEPZSA-N 1 1 335.404 2.325 20 5 EEBDMO CCCC[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000341951592 465278079 /nfs/dbraw/zinc/27/80/79/465278079.db2.gz VORCAODOJPUNFH-GFCCVEGCSA-N 1 1 343.449 2.302 20 5 EEBDMO C[C@@H](CC[NH+]1CCOCC1)NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000074105690 462556879 /nfs/dbraw/zinc/55/68/79/462556879.db2.gz TZOIUWCONWFHNH-NSHDSACASA-N 1 1 341.795 2.089 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@H](CN2CCOCC2)C1 ZINC000129327530 462700949 /nfs/dbraw/zinc/70/09/49/462700949.db2.gz FDRYLHCDPCOOLE-CYBMUJFWSA-N 1 1 339.823 2.402 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](CN2CCOCC2)C1 ZINC000129327530 462700952 /nfs/dbraw/zinc/70/09/52/462700952.db2.gz FDRYLHCDPCOOLE-CYBMUJFWSA-N 1 1 339.823 2.402 20 5 EEBDMO C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[N@H+](C)CCO1 ZINC000129896979 462730201 /nfs/dbraw/zinc/73/02/01/462730201.db2.gz KBOQXUJGVVEBKF-ZANVPECISA-N 1 1 342.783 2.089 20 5 EEBDMO C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[N@@H+](C)CCO1 ZINC000129896979 462730207 /nfs/dbraw/zinc/73/02/07/462730207.db2.gz KBOQXUJGVVEBKF-ZANVPECISA-N 1 1 342.783 2.089 20 5 EEBDMO CC[C@H]1CN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000117299921 462796437 /nfs/dbraw/zinc/79/64/37/462796437.db2.gz ZHKDYWVISQYTHI-FDMDGMSGSA-N 1 1 347.415 2.177 20 5 EEBDMO C[N@@H+](CCCNC(=O)c1ccc(N)c([N+](=O)[O-])c1)Cc1ccccc1 ZINC000009919866 462809598 /nfs/dbraw/zinc/80/95/98/462809598.db2.gz CBWPLENEYGBEOD-UHFFFAOYSA-N 1 1 342.399 2.429 20 5 EEBDMO C[C@@H](CN1CCN(C)CC1)[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000154907123 462821620 /nfs/dbraw/zinc/82/16/20/462821620.db2.gz OXCHGWZGYXBXBZ-YJBOKZPZSA-N 1 1 346.475 2.141 20 5 EEBDMO COc1ccc(NC(=O)C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000155404992 462887479 /nfs/dbraw/zinc/88/74/79/462887479.db2.gz DOLWYSPOUPBSHC-WBMJQRKESA-N 1 1 349.387 2.043 20 5 EEBDMO COc1ccc(NC(=O)C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000155404992 462887481 /nfs/dbraw/zinc/88/74/81/462887481.db2.gz DOLWYSPOUPBSHC-WBMJQRKESA-N 1 1 349.387 2.043 20 5 EEBDMO Cc1nn(C)c(N2CC[NH+](C/C=C\c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000051149660 463023414 /nfs/dbraw/zinc/02/34/14/463023414.db2.gz LVZWNQRQALSGQJ-TWGQIWQCSA-N 1 1 341.415 2.472 20 5 EEBDMO CNC(=O)[C@@H]1Cc2ccccc2C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000052491807 463081929 /nfs/dbraw/zinc/08/19/29/463081929.db2.gz JOYMHUWXSYCXRG-SFHVURJKSA-N 1 1 339.395 2.310 20 5 EEBDMO CNC(=O)[C@@H]1Cc2ccccc2C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000052491807 463081935 /nfs/dbraw/zinc/08/19/35/463081935.db2.gz JOYMHUWXSYCXRG-SFHVURJKSA-N 1 1 339.395 2.310 20 5 EEBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000025407510 463123805 /nfs/dbraw/zinc/12/38/05/463123805.db2.gz VRQSPMOSOIOQLB-ZIAGYGMSSA-N 1 1 349.431 2.141 20 5 EEBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1c([N+](=O)[O-])ncn1C ZINC000078674729 463139441 /nfs/dbraw/zinc/13/94/41/463139441.db2.gz NRUFUGPPQPPDGK-OAHLLOKOSA-N 1 1 329.404 2.287 20 5 EEBDMO CCOCC[N@H+](CC)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000157584362 463146393 /nfs/dbraw/zinc/14/63/93/463146393.db2.gz KPTLWVATNSJXJN-LBPRGKRZSA-N 1 1 339.392 2.289 20 5 EEBDMO CCOCC[N@@H+](CC)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000157584362 463146397 /nfs/dbraw/zinc/14/63/97/463146397.db2.gz KPTLWVATNSJXJN-LBPRGKRZSA-N 1 1 339.392 2.289 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)nc1 ZINC000078869523 463157052 /nfs/dbraw/zinc/15/70/52/463157052.db2.gz RUVCBHJIHXYGSJ-DOTOQJQBSA-N 1 1 342.399 2.285 20 5 EEBDMO CC[N@@H+](CCNC(=O)NCCOc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000069111023 463208927 /nfs/dbraw/zinc/20/89/27/463208927.db2.gz FSFGYVNISJOPRB-UHFFFAOYSA-N 1 1 338.408 2.003 20 5 EEBDMO CC(=O)c1ccc(NCCCCN2CC[NH+](C)CC2)c([N+](=O)[O-])c1 ZINC000029619316 463265612 /nfs/dbraw/zinc/26/56/12/463265612.db2.gz XOIDXWJHMYJRSX-UHFFFAOYSA-N 1 1 334.420 2.237 20 5 EEBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1 ZINC000141858895 463356420 /nfs/dbraw/zinc/35/64/20/463356420.db2.gz KIEBPOHJMSCFRU-AWEZNQCLSA-N 1 1 332.404 2.094 20 5 EEBDMO CCCc1n[nH]c(C(=O)N2CC[C@H](C[N@H+](C)CCC)C2)c1[N+](=O)[O-] ZINC000081361279 463425801 /nfs/dbraw/zinc/42/58/01/463425801.db2.gz JTMDBJPBDZQOJT-GFCCVEGCSA-N 1 1 337.424 2.074 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[C@H](C[N@@H+](C)CCC)C2)c1[N+](=O)[O-] ZINC000081361279 463425805 /nfs/dbraw/zinc/42/58/05/463425805.db2.gz JTMDBJPBDZQOJT-GFCCVEGCSA-N 1 1 337.424 2.074 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[C@H](C[N@H+](C)CCC)C2)c1[N+](=O)[O-] ZINC000081361279 463425807 /nfs/dbraw/zinc/42/58/07/463425807.db2.gz JTMDBJPBDZQOJT-GFCCVEGCSA-N 1 1 337.424 2.074 20 5 EEBDMO CCOCC[N@@H+]1CCN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000255435108 463725831 /nfs/dbraw/zinc/72/58/31/463725831.db2.gz PPFMACKKDZSCEV-LZNQSLFOSA-N 1 1 347.415 2.177 20 5 EEBDMO CCOCC[N@H+]1CCN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000255435108 463725834 /nfs/dbraw/zinc/72/58/34/463725834.db2.gz PPFMACKKDZSCEV-LZNQSLFOSA-N 1 1 347.415 2.177 20 5 EEBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)[N@H+]1CCC[C@@H](C)C1 ZINC000283432742 463883280 /nfs/dbraw/zinc/88/32/80/463883280.db2.gz JIQXJPGXBOIQMG-GHMZBOCLSA-N 1 1 338.383 2.166 20 5 EEBDMO CN(CC[C@H]1CCCC[N@H+]1C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000185850990 463890842 /nfs/dbraw/zinc/89/08/42/463890842.db2.gz KFKQERVGYBQKNO-CYBMUJFWSA-N 1 1 341.433 2.090 20 5 EEBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000279125858 464040271 /nfs/dbraw/zinc/04/02/71/464040271.db2.gz BBBCTVJHGRPSDV-LLVKDONJSA-N 1 1 338.383 2.166 20 5 EEBDMO CCCc1n[nH]c(C(=O)N2CCC[N@H+](C3CCCC3)CC2)c1[N+](=O)[O-] ZINC000172414137 464075632 /nfs/dbraw/zinc/07/56/32/464075632.db2.gz HTJMHRODTNKVMM-UHFFFAOYSA-N 1 1 349.435 2.361 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CCC[N@@H+](C3CCCC3)CC2)c1[N+](=O)[O-] ZINC000172414137 464075635 /nfs/dbraw/zinc/07/56/35/464075635.db2.gz HTJMHRODTNKVMM-UHFFFAOYSA-N 1 1 349.435 2.361 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CCC[N@H+](C3CCCC3)CC2)c1[N+](=O)[O-] ZINC000172414137 464075641 /nfs/dbraw/zinc/07/56/41/464075641.db2.gz HTJMHRODTNKVMM-UHFFFAOYSA-N 1 1 349.435 2.361 20 5 EEBDMO CN1CC[N@@H+](C)C[C@@H]1CNc1ccc([N+](=O)[O-])cc1Br ZINC000225345346 464156038 /nfs/dbraw/zinc/15/60/38/464156038.db2.gz AQNVBFWOYBSRFU-NSHDSACASA-N 1 1 343.225 2.015 20 5 EEBDMO COc1cc(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)cc([N+](=O)[O-])c1C ZINC000292267550 464179973 /nfs/dbraw/zinc/17/99/73/464179973.db2.gz PXIXUHAWKWLCOB-KRWDZBQOSA-N 1 1 333.388 2.080 20 5 EEBDMO CC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000284406968 464181214 /nfs/dbraw/zinc/18/12/14/464181214.db2.gz RDQJCHPUGHVJON-UHFFFAOYSA-N 1 1 344.209 2.347 20 5 EEBDMO CSC[C@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000292276719 464181668 /nfs/dbraw/zinc/18/16/68/464181668.db2.gz BLODZKXLVMTDFR-ZFWWWQNUSA-N 1 1 340.445 2.410 20 5 EEBDMO C[C@H]1OCC[C@]12C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCO2 ZINC000280615667 464222730 /nfs/dbraw/zinc/22/27/30/464222730.db2.gz XYCDFHJHMMWBLQ-PBHICJAKSA-N 1 1 336.388 2.244 20 5 EEBDMO C[C@@H](O)[C@@H]1CCCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000264391218 464307988 /nfs/dbraw/zinc/30/79/88/464307988.db2.gz FSEIQWXDBDQDAH-RISCZKNCSA-N 1 1 332.360 2.380 20 5 EEBDMO C[C@@H](O)[C@@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000264391218 464307993 /nfs/dbraw/zinc/30/79/93/464307993.db2.gz FSEIQWXDBDQDAH-RISCZKNCSA-N 1 1 332.360 2.380 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000298701978 465476395 /nfs/dbraw/zinc/47/63/95/465476395.db2.gz SHPIFSGMSUSEKC-ZDUSSCGKSA-N 1 1 343.343 2.097 20 5 EEBDMO C[N@H+](CCc1ccncc1)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000181454757 464492854 /nfs/dbraw/zinc/49/28/54/464492854.db2.gz 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342.193 2.055 20 5 EEBDMO Cc1nc(N2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000413530888 467261616 /nfs/dbraw/zinc/26/16/16/467261616.db2.gz KYBIHAKKYMVLAB-CYBMUJFWSA-N 1 1 327.388 2.404 20 5 EEBDMO C[C@H](c1ccccc1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)C(N)=O ZINC000428854448 467276667 /nfs/dbraw/zinc/27/66/67/467276667.db2.gz ADMZVFWPDLZWCE-BDJLRTHQSA-N 1 1 331.347 2.481 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](CCCO)C2)cccc1[N+](=O)[O-] ZINC000452120509 467331194 /nfs/dbraw/zinc/33/11/94/467331194.db2.gz GDHRRQPHYGWMRA-AWEZNQCLSA-N 1 1 335.404 2.326 20 5 EEBDMO O=[N+]([O-])c1cccc2ncnc(NC[C@@H]3CCCC[N@H+]3C3CC3)c21 ZINC000433815217 467356217 /nfs/dbraw/zinc/35/62/17/467356217.db2.gz ZWWDHFGGFPEFJZ-ZDUSSCGKSA-N 1 1 327.388 2.967 20 5 EEBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C(=O)NCCc1ccccc1 ZINC000453610591 467504359 /nfs/dbraw/zinc/50/43/59/467504359.db2.gz JSZMYLIPKDDQJU-GFCCVEGCSA-N 1 1 333.413 2.493 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCNC(=O)Nc2cccc([N+](=O)[O-])c2)CCCO1 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C[C@]([NH3+])(C(=O)N1CCc2cccc(F)c2C1)c1cccc([N+](=O)[O-])c1 ZINC000867979640 1201718749 /nfs/dbraw/zinc/71/87/49/1201718749.db2.gz LJXAGBDLHCJRAB-GOSISDBHSA-N 1 1 343.358 2.493 20 5 EEBDMO CC(C)(C)NC(=O)[C@H]1CCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000932440636 1207606895 /nfs/dbraw/zinc/60/68/95/1207606895.db2.gz NTQDBVLTMHGRGC-HUUCEWRRSA-N 1 1 335.404 2.007 20 5 EEBDMO CC(C)(C)NC(=O)[C@H]1CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000932440636 1207606898 /nfs/dbraw/zinc/60/68/98/1207606898.db2.gz NTQDBVLTMHGRGC-HUUCEWRRSA-N 1 1 335.404 2.007 20 5 EEBDMO CC[N@@H+](CC(=O)N1CCCCCC1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000796602974 1221610907 /nfs/dbraw/zinc/61/09/07/1221610907.db2.gz WZJJAMJKRBZAFA-QGZVFWFLSA-N 1 1 349.431 2.353 20 5 EEBDMO CC[N@H+](CC(=O)N1CCCCCC1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000796602974 1221610908 /nfs/dbraw/zinc/61/09/08/1221610908.db2.gz WZJJAMJKRBZAFA-QGZVFWFLSA-N 1 1 349.431 2.353 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)N1CCC(Nc2ccccc2[N+](=O)[O-])CC1 ZINC001057392496 1243574730 /nfs/dbraw/zinc/57/47/30/1243574730.db2.gz KVFRAIKEUBSPTM-UHFFFAOYSA-N 1 1 343.387 2.203 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(N[C@H]2C[C@H](NC(=O)C[N@H+](C)C(C)C)C2)c1 ZINC001097036721 1243603054 /nfs/dbraw/zinc/60/30/54/1243603054.db2.gz FIEQCMWIBRYIQZ-HDJSIYSDSA-N 1 1 334.420 2.303 20 5 EEBDMO O=[N+]([O-])c1ccc2c(ccnc2NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)c1 ZINC000827495945 1248225184 /nfs/dbraw/zinc/22/51/84/1248225184.db2.gz ATLMGARCBPZIBC-HUUCEWRRSA-N 1 1 328.372 2.418 20 5 EEBDMO Cn1nccc1[C@H](O)C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000856801091 1293638487 /nfs/dbraw/zinc/63/84/87/1293638487.db2.gz JZSWVZLEQAVGRQ-QGZVFWFLSA-N 1 1 348.378 2.413 20 5 EEBDMO CCOc1ccc2c(c1)c(=N)c1ccc(N)cc1n2C(=O)[C@@H](C)C[NH3+] ZINC001219005494 1297903631 /nfs/dbraw/zinc/90/36/31/1297903631.db2.gz PKWMNZZXVMACFS-NSHDSACASA-N 1 1 338.411 2.490 20 5 EEBDMO Cc1cc[nH+]c(N2CCC(Oc3[nH]ccc(=O)c3[N+](=O)[O-])CC2)c1 ZINC001225663879 1301116042 /nfs/dbraw/zinc/11/60/42/1301116042.db2.gz HXFLJJOKJIOVCX-UHFFFAOYSA-N 1 1 330.344 2.447 20 5 EEBDMO O=[N+]([O-])c1cc([N+](=O)[O-])c(O[C@@H]2CCc3[nH+]ccn3C2)c([N+](=O)[O-])c1 ZINC001227501632 1301855277 /nfs/dbraw/zinc/85/52/77/1301855277.db2.gz PSZOQUOYMJGNED-SECBINFHSA-N 1 1 349.259 2.002 20 5 EEBDMO C[C@H](c1ccccn1)[N@H+]1CCC[C@@H](Oc2nc[nH]c(=O)c2[N+](=O)[O-])C1 ZINC001228140007 1302122273 /nfs/dbraw/zinc/12/22/73/1302122273.db2.gz DIAIHHRJOZOCEI-VXGBXAGGSA-N 1 1 345.359 2.090 20 5 EEBDMO CC(C)[N@@H+]1CCC[C@@H](Oc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC001228665203 1302369683 /nfs/dbraw/zinc/36/96/83/1302369683.db2.gz QFCBYDWRVLWEMX-GFCCVEGCSA-N 1 1 342.417 2.250 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H](Oc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC001228665203 1302369701 /nfs/dbraw/zinc/36/97/01/1302369701.db2.gz QFCBYDWRVLWEMX-GFCCVEGCSA-N 1 1 342.417 2.250 20 5 EEBDMO CC(C)[N@H+](C)CC(=O)NC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001230373824 1303181688 /nfs/dbraw/zinc/18/16/88/1303181688.db2.gz BJMZNOQHDGZKEE-UHFFFAOYSA-N 1 1 348.447 2.016 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001230373824 1303181695 /nfs/dbraw/zinc/18/16/95/1303181695.db2.gz BJMZNOQHDGZKEE-UHFFFAOYSA-N 1 1 348.447 2.016 20 5 EEBDMO CO[C@@H]1CC[N@@H+](CCOc2ccc3nc4ccc(=O)cc-4oc3c2)C1 ZINC001231334934 1303738415 /nfs/dbraw/zinc/73/84/15/1303738415.db2.gz LVJCGDQVCUXRIN-OAHLLOKOSA-N 1 1 340.379 2.392 20 5 EEBDMO C[N@@H+](CCCNC(=O)c1ccnc(F)c1)Cc1cccc([N+](=O)[O-])c1 ZINC001235262215 1305170031 /nfs/dbraw/zinc/17/00/31/1305170031.db2.gz ZBITTYNZEWGKQQ-UHFFFAOYSA-N 1 1 346.362 2.381 20 5 EEBDMO CCc1[nH]nc(C(=O)OCC[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000837657834 1315100989 /nfs/dbraw/zinc/10/09/89/1315100989.db2.gz QSCSBWDAAMUSNV-UHFFFAOYSA-N 1 1 332.360 2.169 20 5 EEBDMO CCN1CC[C@]2(CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1=O ZINC001254599019 1318138589 /nfs/dbraw/zinc/13/85/89/1318138589.db2.gz ZMJKVONPZPXELK-MJGOQNOKSA-N 1 1 343.427 2.396 20 5 EEBDMO COCCC[N@H+](CCO)Cc1ccc([N+](=O)[O-])cc1Br ZINC001255434458 1318409003 /nfs/dbraw/zinc/40/90/03/1318409003.db2.gz QUKPUDRUKNCBHE-UHFFFAOYSA-N 1 1 347.209 2.188 20 5 EEBDMO COCCC[N@@H+](CCO)Cc1ccc([N+](=O)[O-])cc1Br ZINC001255434458 1318409008 /nfs/dbraw/zinc/40/90/08/1318409008.db2.gz QUKPUDRUKNCBHE-UHFFFAOYSA-N 1 1 347.209 2.188 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CC[C@@H](C)[C@@H](O)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093078 1318645867 /nfs/dbraw/zinc/64/58/67/1318645867.db2.gz FZCWDYIPOYGRBX-DYVFJYSZSA-N 1 1 349.431 2.275 20 5 EEBDMO O=[N+]([O-])c1cc(Nc2ccccc2CN2CC[NH2+]CC2)ccc1O ZINC001160296752 1320126592 /nfs/dbraw/zinc/12/65/92/1320126592.db2.gz HLJAVPZGQFGGLM-UHFFFAOYSA-N 1 1 328.372 2.449 20 5 EEBDMO CCN(CC)C(=O)[C@H](C)Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2 ZINC001164655136 1321442107 /nfs/dbraw/zinc/44/21/07/1321442107.db2.gz CBJSDTPFHOIHOI-LBPRGKRZSA-N 1 1 334.420 2.252 20 5 EEBDMO CCN(CC)C(=O)[C@H](C)Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2 ZINC001164655136 1321442109 /nfs/dbraw/zinc/44/21/09/1321442109.db2.gz CBJSDTPFHOIHOI-LBPRGKRZSA-N 1 1 334.420 2.252 20 5 EEBDMO CCOC(=O)c1cnc(NCC[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1 ZINC001165260564 1321485164 /nfs/dbraw/zinc/48/51/64/1321485164.db2.gz IIVRQAHFIRNTGS-LBPRGKRZSA-N 1 1 336.392 2.310 20 5 EEBDMO [NH3+][C@@H](Cc1cccc(O)c1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001205004949 1322263390 /nfs/dbraw/zinc/26/33/90/1322263390.db2.gz KXQBDQNDOYLBFI-NSHDSACASA-N 1 1 345.290 2.127 20 5 EEBDMO C[N@H+]1CCC[C@@H](CCNC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001331436576 1335013626 /nfs/dbraw/zinc/01/36/26/1335013626.db2.gz YLIDRWIEKDZKQH-ZDUSSCGKSA-N 1 1 332.404 2.352 20 5 EEBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCOC4CC4)CC3)nc2c1 ZINC001332885712 1335924739 /nfs/dbraw/zinc/92/47/39/1335924739.db2.gz MNMBJIKCPUITDM-UHFFFAOYSA-N 1 1 345.403 2.162 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cccc4c3OCC4)CC2)cn1 ZINC001334887827 1336308454 /nfs/dbraw/zinc/30/84/54/1336308454.db2.gz NNFDQBOSTARMPD-UHFFFAOYSA-N 1 1 340.383 2.247 20 5 EEBDMO COC(=O)/C=C/c1ccc(NCc2cc(N)cc[nH+]2)c([N+](=O)[O-])c1 ZINC001578796510 1344304301 /nfs/dbraw/zinc/30/43/01/1344304301.db2.gz GIAPCCKAJDMFQG-HWKANZROSA-N 1 1 328.328 2.370 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CCS1 ZINC001589518234 1348999184 /nfs/dbraw/zinc/99/91/84/1348999184.db2.gz RCMCGUWCSAFMPA-CQSZACIVSA-N 1 1 348.432 2.348 20 5 EEBDMO C[C@H]([NH2+]Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])c1ccns1 ZINC001589966159 1349083951 /nfs/dbraw/zinc/08/39/51/1349083951.db2.gz ZIIGIJYCNPCDKM-QMMMGPOBSA-N 1 1 331.361 2.082 20 5 EEBDMO Cc1cc(NCC[N@@H+]2CCC[C@@H](C)C2)cc(-c2nn[nH]n2)c1[N+](=O)[O-] ZINC001605734672 1351219758 /nfs/dbraw/zinc/21/97/58/1351219758.db2.gz KJQGSQKSMXCOKP-LLVKDONJSA-N 1 1 345.407 2.227 20 5 EEBDMO Cc1cccc(NCCNc2cc(-c3nn[nH]n3)ccc2[N+](=O)[O-])[nH+]1 ZINC001605919556 1351253684 /nfs/dbraw/zinc/25/36/84/1351253684.db2.gz GHRXKDGDUGMJEF-UHFFFAOYSA-N 1 1 340.347 2.002 20 5 EEBDMO COc1cc(C[N@@H+]2C[C@H]3C[C@@]3(CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000782633347 1371327424 /nfs/dbraw/zinc/32/74/24/1371327424.db2.gz OSZLGMSKRVRDHX-BMIGLBTASA-N 1 1 344.314 2.019 20 5 EEBDMO COc1cc(C[N@H+]2C[C@H]3C[C@@]3(CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000782633347 1371327429 /nfs/dbraw/zinc/32/74/29/1371327429.db2.gz OSZLGMSKRVRDHX-BMIGLBTASA-N 1 1 344.314 2.019 20 5 EEBDMO COc1cc(C(=O)O[C@H](C)Cn2cc[nH+]c2C)c([N+](=O)[O-])cc1F ZINC000835210944 1372602860 /nfs/dbraw/zinc/60/28/60/1372602860.db2.gz BPSDEXPLDARGEI-SECBINFHSA-N 1 1 337.307 2.493 20 5 EEBDMO CCN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C1CC[NH2+]CC1 ZINC001577643483 1403666243 /nfs/dbraw/zinc/66/62/43/1403666243.db2.gz FJSSUKCXPIUEPP-UHFFFAOYSA-N 1 1 343.387 2.199 20 5 EEBDMO CSc1nc(Cl)nc(N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-] ZINC001164637721 719208401 /nfs/dbraw/zinc/20/84/01/719208401.db2.gz MNWRSFPGUJOEDV-SFYZADRCSA-N 1 1 331.829 2.289 20 5 EEBDMO CSc1nc(Cl)nc(N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-] ZINC001164637721 719208404 /nfs/dbraw/zinc/20/84/04/719208404.db2.gz MNWRSFPGUJOEDV-SFYZADRCSA-N 1 1 331.829 2.289 20 5 EEBDMO Cc1nc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)ccc1[N+](=O)[O-] ZINC001164781720 721390751 /nfs/dbraw/zinc/39/07/51/721390751.db2.gz CZOPPWKGZMJFPR-STQMWFEESA-N 1 1 345.428 2.323 20 5 EEBDMO COC[C@@H]1CCC[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000154747758 769176216 /nfs/dbraw/zinc/17/62/16/769176216.db2.gz JGWJGTYAZAWZJK-CQSZACIVSA-N 1 1 348.403 2.153 20 5 EEBDMO COC[C@@H]1CCC[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000154747758 769176219 /nfs/dbraw/zinc/17/62/19/769176219.db2.gz JGWJGTYAZAWZJK-CQSZACIVSA-N 1 1 348.403 2.153 20 5 EEBDMO Cc1cncc(C(=O)NCC2C[NH+](Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001031593980 769951530 /nfs/dbraw/zinc/95/15/30/769951530.db2.gz POIHZEZQHFTINB-UHFFFAOYSA-N 1 1 340.383 2.160 20 5 EEBDMO CC(C)[N@@H+](C)C[C@H](C)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000809861271 783427541 /nfs/dbraw/zinc/42/75/41/783427541.db2.gz XODBPHUFWFYHAW-JTQLQIEISA-N 1 1 349.840 2.255 20 5 EEBDMO O=[N+]([O-])c1c(Br)cccc1NCC[N@H+]1CCCOCC1 ZINC000820685122 786017753 /nfs/dbraw/zinc/01/77/53/786017753.db2.gz BDOVLCQKODJJQK-UHFFFAOYSA-N 1 1 344.209 2.492 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NC/C=C\CNc1ncc([N+](=O)[O-])cc1C ZINC001107275461 786686705 /nfs/dbraw/zinc/68/67/05/786686705.db2.gz VNBOKYHCPBRHIS-WAYWQWQTSA-N 1 1 349.435 2.114 20 5 EEBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825111824 788441877 /nfs/dbraw/zinc/44/18/77/788441877.db2.gz PZRODKXCNHNCEU-PBHICJAKSA-N 1 1 349.431 2.257 20 5 EEBDMO CCCN(C(=O)COc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CC[N@@H+](C)C1 ZINC000843987303 788768406 /nfs/dbraw/zinc/76/84/06/788768406.db2.gz CPUWSGLCMRUORV-LBPRGKRZSA-N 1 1 339.367 2.055 20 5 EEBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C1CCS(=O)(=O)CC1 ZINC001173235831 797313678 /nfs/dbraw/zinc/31/36/78/797313678.db2.gz ZRMKQPFGSGHEQO-GFCCVEGCSA-N 1 1 326.418 2.035 20 5 EEBDMO Cc1c[nH]nc1C(=O)NC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001002769590 798574654 /nfs/dbraw/zinc/57/46/54/798574654.db2.gz GOISOXQRONPRSC-UHFFFAOYSA-N 1 1 343.387 2.021 20 5 EEBDMO O=C(NC1CC[NH+](CC2CCC(F)(F)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001002787145 798609548 /nfs/dbraw/zinc/60/95/48/798609548.db2.gz GKSDULLBJUWEQQ-ZIAGYGMSSA-N 1 1 345.390 2.058 20 5 EEBDMO COc1ccc(C[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001178458368 799484205 /nfs/dbraw/zinc/48/42/05/799484205.db2.gz DDMKNACNZMYTFE-IAGOWNOFSA-N 1 1 349.431 2.127 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NCC1(Nc2ccccc2[N+](=O)[O-])CC1 ZINC001110266550 801086333 /nfs/dbraw/zinc/08/63/33/801086333.db2.gz YMSCXACHXWNIRE-UHFFFAOYSA-N 1 1 334.420 2.386 20 5 EEBDMO COC(=O)[C@@H]([NH3+])Cc1cn([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)c2ccccc12 ZINC001168962711 803551574 /nfs/dbraw/zinc/55/15/74/803551574.db2.gz MTZXUEHXCCCKGD-XPKDYRNWSA-N 1 1 345.399 2.302 20 5 EEBDMO CC(C)(C)OC(=O)N1CC2(CC[N@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169012503 803571568 /nfs/dbraw/zinc/57/15/68/803571568.db2.gz QPKNABSYNRUDJP-STQMWFEESA-N 1 1 325.409 2.127 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCCn3cnc(COCC4CC4)c3C2)C1 ZINC001169024199 803589694 /nfs/dbraw/zinc/58/96/94/803589694.db2.gz QLHHBPKLUALOJL-HZPDHXFCSA-N 1 1 348.447 2.461 20 5 EEBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)O[C@@H]1CC[N@H+](CCF)C1 ZINC000788085116 807370661 /nfs/dbraw/zinc/37/06/61/807370661.db2.gz SYCGYZFBYGGWCH-CYBMUJFWSA-N 1 1 335.335 2.206 20 5 EEBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)O[C@@H]1CC[N@@H+](CCF)C1 ZINC000788085116 807370668 /nfs/dbraw/zinc/37/06/68/807370668.db2.gz SYCGYZFBYGGWCH-CYBMUJFWSA-N 1 1 335.335 2.206 20 5 EEBDMO CC[N@@H+]1C[C@H]2CN([C@@H](C)Cc3ccc(OC)cc3[N+](=O)[O-])C[C@H]2C1 ZINC001170355848 809902971 /nfs/dbraw/zinc/90/29/71/809902971.db2.gz REBFVCGGMJMWRE-CWRNSKLLSA-N 1 1 333.432 2.418 20 5 EEBDMO CC(C)[NH+](CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C(C)C ZINC000032245190 201070001 /nfs/dbraw/zinc/07/00/01/201070001.db2.gz UPMWULLAMNRBKQ-UHFFFAOYSA-N 1 1 333.392 2.320 20 5 EEBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000229726567 242194133 /nfs/dbraw/zinc/19/41/33/242194133.db2.gz MLAUVZFDFBSZRY-ZBFHGGJFSA-N 1 1 332.404 2.017 20 5 EEBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c2c(c1)COCO2 ZINC000449558507 242562352 /nfs/dbraw/zinc/56/23/52/242562352.db2.gz WLLPUTFPXJUNIT-IGCXYCKISA-N 1 1 348.399 2.444 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000456394499 244244053 /nfs/dbraw/zinc/24/40/53/244244053.db2.gz YRPVXLSXBFJAFW-AWEZNQCLSA-N 1 1 335.404 2.468 20 5 EEBDMO CCC[C@H]1CN(C(=O)c2cccc(C)c2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000130986861 205270023 /nfs/dbraw/zinc/27/00/23/205270023.db2.gz VHRZHIVHJQIQOB-HNNXBMFYSA-N 1 1 349.431 2.476 20 5 EEBDMO CCC[C@H]1CN(C(=O)c2cccc(C)c2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000130986861 205270028 /nfs/dbraw/zinc/27/00/28/205270028.db2.gz 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COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H]2CC[C@H](C1)[N@H+]2C ZINC000156107534 206057075 /nfs/dbraw/zinc/05/70/75/206057075.db2.gz AHKJYAYGJQVXCC-WCQYABFASA-N 1 1 334.376 2.304 20 5 EEBDMO O=C(/C=C/c1ccc(F)cc1[N+](=O)[O-])NC[C@@H]1CCc2[nH+]ccn2C1 ZINC000491960441 246231997 /nfs/dbraw/zinc/23/19/97/246231997.db2.gz HKYDSCKSDROZCJ-UXONFWTHSA-N 1 1 344.346 2.322 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCC[C@H]3CCO)n2)c1 ZINC000264295991 246309068 /nfs/dbraw/zinc/30/90/68/246309068.db2.gz QRDCRICHZAGXFI-ZDUSSCGKSA-N 1 1 332.360 2.382 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCC[C@H]3CCO)n2)c1 ZINC000264295991 246309074 /nfs/dbraw/zinc/30/90/74/246309074.db2.gz QRDCRICHZAGXFI-ZDUSSCGKSA-N 1 1 332.360 2.382 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC2(COC(=O)N2)CC1 ZINC000495140888 247072226 /nfs/dbraw/zinc/07/22/26/247072226.db2.gz QVLRPDSPMUVZHX-UHFFFAOYSA-N 1 1 349.387 2.456 20 5 EEBDMO CC(C)c1ccc(C(=O)N2CC[N@@H+](C[C@H](C)O)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000249105439 206348463 /nfs/dbraw/zinc/34/84/63/206348463.db2.gz PFFMTUGFXZNVEE-KBPBESRZSA-N 1 1 349.431 2.245 20 5 EEBDMO CC(C)c1ccc(C(=O)N2CC[N@H+](C[C@H](C)O)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000249105439 206348469 /nfs/dbraw/zinc/34/84/69/206348469.db2.gz PFFMTUGFXZNVEE-KBPBESRZSA-N 1 1 349.431 2.245 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000266103243 248098154 /nfs/dbraw/zinc/09/81/54/248098154.db2.gz SGYATZCGUONJGY-BZNIZROVSA-N 1 1 330.388 2.488 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1 ZINC000173801379 206959834 /nfs/dbraw/zinc/95/98/34/206959834.db2.gz ZLBOWYNMYYSCTH-CQSZACIVSA-N 1 1 348.447 2.465 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1CCn1cc([N+](=O)[O-])cn1 ZINC000174872796 207067051 /nfs/dbraw/zinc/06/70/51/207067051.db2.gz SIBVBISSRDHSKB-INIZCTEOSA-N 1 1 343.431 2.388 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CN(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000175390306 207121944 /nfs/dbraw/zinc/12/19/44/207121944.db2.gz ZOWFGZAKHKJMTD-AWEZNQCLSA-N 1 1 341.433 2.008 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H]2c2cccc3c2OCCO3)n1 ZINC000176227858 207204017 /nfs/dbraw/zinc/20/40/17/207204017.db2.gz SHDMRPYPLOYSGW-CQSZACIVSA-N 1 1 344.371 2.400 20 5 EEBDMO COCCN(C)CCC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000268798814 252252359 /nfs/dbraw/zinc/25/23/59/252252359.db2.gz GYSNLQMPGGALJX-KRWDZBQOSA-N 1 1 335.448 2.474 20 5 EEBDMO Cc1cccc(N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)[nH+]1 ZINC000268869021 252317327 /nfs/dbraw/zinc/31/73/27/252317327.db2.gz TZPOVSSACPTDOH-UHFFFAOYSA-N 1 1 326.356 2.261 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000270598096 256152276 /nfs/dbraw/zinc/15/22/76/256152276.db2.gz VRQOFUJARPIJLL-CYBMUJFWSA-N 1 1 331.347 2.385 20 5 EEBDMO COCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000271146814 256212742 /nfs/dbraw/zinc/21/27/42/256212742.db2.gz RTWWLQAKDSMVHR-GDBMZVCRSA-N 1 1 349.431 2.266 20 5 EEBDMO CC[C@@H]1C[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O ZINC000270857324 256179974 /nfs/dbraw/zinc/17/99/74/256179974.db2.gz HSPVKFURXAHWBS-WDMOLILDSA-N 1 1 332.360 2.409 20 5 EEBDMO COC1CCC([N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000273400757 256293542 /nfs/dbraw/zinc/29/35/42/256293542.db2.gz WIJUOEGEANJKJC-SHARSMKWSA-N 1 1 338.404 2.224 20 5 EEBDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000352203279 153002832 /nfs/dbraw/zinc/00/28/32/153002832.db2.gz QKNCOELAYJMZML-NSHDSACASA-N 1 1 327.768 2.298 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000352203279 153002836 /nfs/dbraw/zinc/00/28/36/153002836.db2.gz QKNCOELAYJMZML-NSHDSACASA-N 1 1 327.768 2.298 20 5 EEBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+]1Cc1ccccc1 ZINC000357697060 153294306 /nfs/dbraw/zinc/29/43/06/153294306.db2.gz HWCXERIKDKXIPN-KRWDZBQOSA-N 1 1 325.368 2.486 20 5 EEBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000357697060 153294310 /nfs/dbraw/zinc/29/43/10/153294310.db2.gz HWCXERIKDKXIPN-KRWDZBQOSA-N 1 1 325.368 2.486 20 5 EEBDMO C[C@]1(Cc2ccccc2)CCC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000248628900 160352876 /nfs/dbraw/zinc/35/28/76/160352876.db2.gz QUUUDERFMGAIMU-QZTJIDSGSA-N 1 1 344.415 2.249 20 5 EEBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000186782551 160083634 /nfs/dbraw/zinc/08/36/34/160083634.db2.gz HNLCGFONBUSCSK-UHFFFAOYSA-N 1 1 332.404 2.335 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000245443768 160235358 /nfs/dbraw/zinc/23/53/58/160235358.db2.gz JCPAYZHHAICDFF-KGLIPLIRSA-N 1 1 334.420 2.195 20 5 EEBDMO COc1ccc(OCC[N@@H+](C)C[C@H]2CCCC[C@H]2O)c([N+](=O)[O-])c1 ZINC000245556133 160242129 /nfs/dbraw/zinc/24/21/29/160242129.db2.gz UFKCVBIMXPIRJB-CZUORRHYSA-N 1 1 338.404 2.465 20 5 EEBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 ZINC000245836556 160253729 /nfs/dbraw/zinc/25/37/29/160253729.db2.gz AQWZKHSBTDQAEA-UONOGXRCSA-N 1 1 349.435 2.055 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC000247013500 160305792 /nfs/dbraw/zinc/30/57/92/160305792.db2.gz ZESMKQNUHJSWJH-DVOMOZLQSA-N 1 1 333.388 2.423 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000342073888 161037358 /nfs/dbraw/zinc/03/73/58/161037358.db2.gz ZBNOLUKBSSYNDI-HIFRSBDPSA-N 1 1 333.388 2.485 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000342073888 161037359 /nfs/dbraw/zinc/03/73/59/161037359.db2.gz ZBNOLUKBSSYNDI-HIFRSBDPSA-N 1 1 333.388 2.485 20 5 EEBDMO Cn1cc([N+](=O)[O-])c(C(=O)Nc2cccc(CC[N@@H+](C)C3CC3)c2)n1 ZINC000342214854 161047987 /nfs/dbraw/zinc/04/79/87/161047987.db2.gz JDVSIJUDMXJXSH-UHFFFAOYSA-N 1 1 343.387 2.217 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000343266941 161118716 /nfs/dbraw/zinc/11/87/16/161118716.db2.gz MTXWYKCETKMDMG-QWHCGFSZSA-N 1 1 328.372 2.433 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCSC[C@H]3CO)o2)c1 ZINC000343772847 161167123 /nfs/dbraw/zinc/16/71/23/161167123.db2.gz SMDXZMOTSDPXMY-CQSZACIVSA-N 1 1 349.412 2.202 20 5 EEBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)CC1 ZINC000347554124 161462680 /nfs/dbraw/zinc/46/26/80/161462680.db2.gz AWCQPPRXHVEKEU-UHFFFAOYSA-N 1 1 344.371 2.320 20 5 EEBDMO O=C([C@H]1CCCc2[nH+]ccn21)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000355053724 163064741 /nfs/dbraw/zinc/06/47/41/163064741.db2.gz GHGCUHCOQNTTNO-OAHLLOKOSA-N 1 1 326.356 2.254 20 5 EEBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1)c1csc([N+](=O)[O-])c1 ZINC000355305365 163138694 /nfs/dbraw/zinc/13/86/94/163138694.db2.gz IGEBUKNWZBIZJE-AWEZNQCLSA-N 1 1 347.396 2.475 20 5 EEBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1)c1csc([N+](=O)[O-])c1 ZINC000355305369 163138926 /nfs/dbraw/zinc/13/89/26/163138926.db2.gz IGEBUKNWZBIZJE-CQSZACIVSA-N 1 1 347.396 2.475 20 5 EEBDMO CCCC[N@@H+](C)CCNS(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C ZINC000360451857 164314335 /nfs/dbraw/zinc/31/43/35/164314335.db2.gz LKOSEJSGRDLSHK-UHFFFAOYSA-N 1 1 343.449 2.222 20 5 EEBDMO C[C@H]1C[C@H](NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000360667401 164360599 /nfs/dbraw/zinc/36/05/99/164360599.db2.gz XCMPHAIJDZSNMN-VHSXEESVSA-N 1 1 347.824 2.009 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C)cc1OC[C@H](O)C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000153763192 292511040 /nfs/dbraw/zinc/51/10/40/292511040.db2.gz QHLVLTGIECUPJF-RBSFLKMASA-N 1 1 338.404 2.061 20 5 EEBDMO C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000362888968 164826270 /nfs/dbraw/zinc/82/62/70/164826270.db2.gz CJAXYNILLCOINP-CXAGYDPISA-N 1 1 347.415 2.162 20 5 EEBDMO CCc1[nH]nc(C(=O)N(CC)CCC[NH+](CC)CC)c1[N+](=O)[O-] ZINC000277895357 269195636 /nfs/dbraw/zinc/19/56/36/269195636.db2.gz GCURCZIGZRECNL-UHFFFAOYSA-N 1 1 325.413 2.074 20 5 EEBDMO Cc1c(C(=O)NCC[N@H+]2CC=CCC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000280352739 269354569 /nfs/dbraw/zinc/35/45/69/269354569.db2.gz 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NVYDOESDEYWEKM-KRWDZBQOSA-N 1 1 343.431 2.306 20 5 EEBDMO Cc1nc2sccn2c1C[N@H+](C)CCn1c(C)ncc1[N+](=O)[O-] ZINC000602796493 469083091 /nfs/dbraw/zinc/08/30/91/469083091.db2.gz PKTMCWLWFPWILV-UHFFFAOYSA-N 1 1 334.405 2.249 20 5 EEBDMO Cc1nc2sccn2c1C[N@@H+](C)CCn1c(C)ncc1[N+](=O)[O-] ZINC000602796493 469083100 /nfs/dbraw/zinc/08/31/00/469083100.db2.gz PKTMCWLWFPWILV-UHFFFAOYSA-N 1 1 334.405 2.249 20 5 EEBDMO CCO[C@H]1C[C@@](CO)([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C1(C)C ZINC000614926375 469096420 /nfs/dbraw/zinc/09/64/20/469096420.db2.gz UEUSFGOKKZGUSE-YOEHRIQHSA-N 1 1 349.387 2.392 20 5 EEBDMO CC[N@H+]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1C ZINC000611091750 469158169 /nfs/dbraw/zinc/15/81/69/469158169.db2.gz INXNWYVZSWHFMU-GFCCVEGCSA-N 1 1 331.376 2.171 20 5 EEBDMO COC(=O)c1cnc(NC[C@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000596309306 469239509 /nfs/dbraw/zinc/23/95/09/469239509.db2.gz YEUSDSYHVFVTQN-LLVKDONJSA-N 1 1 336.392 2.309 20 5 EEBDMO CN(C(=O)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])nc1 ZINC000602320161 469281673 /nfs/dbraw/zinc/28/16/73/469281673.db2.gz GTNGADYVVVKECW-OAHLLOKOSA-N 1 1 340.383 2.475 20 5 EEBDMO CC1(C)C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]1c1cccnc1 ZINC000596591831 469308406 /nfs/dbraw/zinc/30/84/06/469308406.db2.gz LPPQCQGGDVPUCQ-MRXNPFEDSA-N 1 1 328.372 2.235 20 5 EEBDMO CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]1c1cccnc1 ZINC000596591831 469308408 /nfs/dbraw/zinc/30/84/08/469308408.db2.gz LPPQCQGGDVPUCQ-MRXNPFEDSA-N 1 1 328.372 2.235 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCc3c(O)cccc3C2)c1 ZINC000599647511 469322728 /nfs/dbraw/zinc/32/27/28/469322728.db2.gz PSMSRWUCYCGKFT-OAHLLOKOSA-N 1 1 344.367 2.098 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCc3c(O)cccc3C2)c1 ZINC000599647511 469322731 /nfs/dbraw/zinc/32/27/31/469322731.db2.gz PSMSRWUCYCGKFT-OAHLLOKOSA-N 1 1 344.367 2.098 20 5 EEBDMO C[C@@H](C(=O)N1CCC([N@@H+](C)CCCO)CC1)c1cccc([N+](=O)[O-])c1 ZINC000617754740 469792975 /nfs/dbraw/zinc/79/29/75/469792975.db2.gz VLSOBCAAQYXYFC-CQSZACIVSA-N 1 1 349.431 2.004 20 5 EEBDMO CCO[C@@H]1CCC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000609450716 469928528 /nfs/dbraw/zinc/92/85/28/469928528.db2.gz VSRIXJIIBAZBLQ-CVEARBPZSA-N 1 1 333.388 2.201 20 5 EEBDMO CCO[C@@H]1CCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000609450716 469928531 /nfs/dbraw/zinc/92/85/31/469928531.db2.gz VSRIXJIIBAZBLQ-CVEARBPZSA-N 1 1 333.388 2.201 20 5 EEBDMO CC(C)[N@H+](Cc1cccc(F)c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266648254 535097566 /nfs/dbraw/zinc/09/75/66/535097566.db2.gz XYGUCOYVJVQJPK-MRXNPFEDSA-N 1 1 336.367 2.202 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000771401190 577210981 /nfs/dbraw/zinc/21/09/81/577210981.db2.gz AYTMTELOKKGYPE-ZIAGYGMSSA-N 1 1 346.431 2.360 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000771401190 577210983 /nfs/dbraw/zinc/21/09/83/577210983.db2.gz AYTMTELOKKGYPE-ZIAGYGMSSA-N 1 1 346.431 2.360 20 5 EEBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000771460560 577213685 /nfs/dbraw/zinc/21/36/85/577213685.db2.gz QEMXHCCJPCSLDR-QWRGUYRKSA-N 1 1 340.811 2.211 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCN(c3nccs3)CC2)cc1 ZINC000776579943 577463051 /nfs/dbraw/zinc/46/30/51/577463051.db2.gz PVAKICYVZGIZIO-HNNXBMFYSA-N 1 1 348.428 2.297 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2[C@@H](O)C(F)(F)F)cc1 ZINC000776582532 577463236 /nfs/dbraw/zinc/46/32/36/577463236.db2.gz RPVGHJDJWZEKHZ-YNEHKIRRSA-N 1 1 334.294 2.016 20 5 EEBDMO C[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1n1ccnc1 ZINC000776590532 577463571 /nfs/dbraw/zinc/46/35/71/577463571.db2.gz HEFKPHSKALLHOK-XOKHGSTOSA-N 1 1 330.388 2.408 20 5 EEBDMO C[N@@H+](CC(=O)OCc1ccc([N+](=O)[O-])cc1F)[C@H]1CCSC1 ZINC000767111943 577530891 /nfs/dbraw/zinc/53/08/91/577530891.db2.gz NWQLAZMAGNZPGA-LBPRGKRZSA-N 1 1 328.365 2.214 20 5 EEBDMO C[N@H+](CC(=O)OCc1ccc([N+](=O)[O-])cc1F)[C@H]1CCSC1 ZINC000767111943 577530890 /nfs/dbraw/zinc/53/08/90/577530890.db2.gz NWQLAZMAGNZPGA-LBPRGKRZSA-N 1 1 328.365 2.214 20 5 EEBDMO Cc1[nH+]ccn1CCCOC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000767625151 577541549 /nfs/dbraw/zinc/54/15/49/577541549.db2.gz XJNIBXZSDRHDHS-UHFFFAOYSA-N 1 1 347.327 2.118 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000804776860 675629568 /nfs/dbraw/zinc/62/95/68/675629568.db2.gz IODDROCIYVFKQB-AWEZNQCLSA-N 1 1 334.420 2.265 20 5 EEBDMO C[C@@H]1C[C@H](Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000892875648 683159200 /nfs/dbraw/zinc/15/92/00/683159200.db2.gz HPPZRFNXINAJIO-NEPJUHHUSA-N 1 1 342.399 2.484 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000892899032 683177080 /nfs/dbraw/zinc/17/70/80/683177080.db2.gz IJVCLTFXNJTLBW-FZMZJTMJSA-N 1 1 342.399 2.341 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21)C1(C2CC2)CC1 ZINC001025815855 683304284 /nfs/dbraw/zinc/30/42/84/683304284.db2.gz OMOLDNQENIDAPS-FVQHAEBGSA-N 1 1 341.411 2.331 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H]1C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000895472221 684617131 /nfs/dbraw/zinc/61/71/31/684617131.db2.gz BODMIPFVKPKJDG-MRXNPFEDSA-N 1 1 346.431 2.116 20 5 EEBDMO Cc1c[nH]cc1C(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001032183803 1192880476 /nfs/dbraw/zinc/88/04/76/1192880476.db2.gz ARXQJXASTGWDTP-UHFFFAOYSA-N 1 1 328.372 2.093 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)N(C)CCN(C)c1ccc([N+](=O)[O-])cc1 ZINC001105441775 1187158428 /nfs/dbraw/zinc/15/84/28/1187158428.db2.gz JVSYMCNVXATAGS-UHFFFAOYSA-N 1 1 336.436 2.221 20 5 EEBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC000842348863 1188647987 /nfs/dbraw/zinc/64/79/87/1188647987.db2.gz MMIAXCPAWWGMMQ-BZUAXINKSA-N 1 1 332.400 2.496 20 5 EEBDMO CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1OC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC000842348863 1188647988 /nfs/dbraw/zinc/64/79/88/1188647988.db2.gz MMIAXCPAWWGMMQ-BZUAXINKSA-N 1 1 332.400 2.496 20 5 EEBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1OC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC000842348863 1188647991 /nfs/dbraw/zinc/64/79/91/1188647991.db2.gz MMIAXCPAWWGMMQ-BZUAXINKSA-N 1 1 332.400 2.496 20 5 EEBDMO CCc1ccccc1C[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001034643672 1196464831 /nfs/dbraw/zinc/46/48/31/1196464831.db2.gz QUSPGQITMXOXOR-BRSBDYLESA-N 1 1 345.443 2.431 20 5 EEBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC(=O)NCC(F)F ZINC000872068904 1198039228 /nfs/dbraw/zinc/03/92/28/1198039228.db2.gz KOUDKGYBRPGTST-MRVPVSSYSA-N 1 1 333.360 2.349 20 5 EEBDMO CN(CC(C)(C)S(C)(=O)=O)c1cc[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000865648920 1198314965 /nfs/dbraw/zinc/31/49/65/1198314965.db2.gz KFINCBUOULZHPK-UHFFFAOYSA-N 1 1 337.401 2.402 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@H](n3cc(Cl)cn3)C2)cc1 ZINC000810131600 1199286652 /nfs/dbraw/zinc/28/66/52/1199286652.db2.gz MESNSHYDMSVZOQ-HUUCEWRRSA-N 1 1 336.779 2.425 20 5 EEBDMO Cc1[nH+]ccn1C[C@H](C)OC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000810619429 1199616649 /nfs/dbraw/zinc/61/66/49/1199616649.db2.gz QEBXSJCAZGDDSP-VIFPVBQESA-N 1 1 333.300 2.074 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)CC[N@H+]1C ZINC000826077310 1200714623 /nfs/dbraw/zinc/71/46/23/1200714623.db2.gz ZAYUUTVGZQQSTR-WDEREUQCSA-N 1 1 338.383 2.012 20 5 EEBDMO C[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1O ZINC000879142430 1200885794 /nfs/dbraw/zinc/88/57/94/1200885794.db2.gz QSMBUESRWTVWNZ-ZIAGYGMSSA-N 1 1 341.795 2.422 20 5 EEBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000195625030 1211444854 /nfs/dbraw/zinc/44/48/54/1211444854.db2.gz GIWMTPZLUSLSOC-XQQFMLRXSA-N 1 1 334.420 2.273 20 5 EEBDMO NC(C[NH+]1CCCCC1)=NOCc1c(F)cc([N+](=O)[O-])cc1F ZINC000902655380 1238141288 /nfs/dbraw/zinc/14/12/88/1238141288.db2.gz FJGGOAVPQYZIJP-UHFFFAOYSA-N 1 1 328.319 2.357 20 5 EEBDMO C[N@@H+](CC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2)C1)C1CCC1 ZINC001097260670 1243886677 /nfs/dbraw/zinc/88/66/77/1243886677.db2.gz JARPHIKRJFGLFK-OKILXGFUSA-N 1 1 332.404 2.138 20 5 EEBDMO O=[N+]([O-])c1ccc(CN2CC[NH+]([C@H]3CCOC3)CC2)cc1Cl ZINC000827120159 1250158691 /nfs/dbraw/zinc/15/86/91/1250158691.db2.gz QDLZPACJSOTXIZ-ZDUSSCGKSA-N 1 1 325.796 2.155 20 5 EEBDMO C[N@@H+](CC(=O)NCCN(c1ccccc1[N+](=O)[O-])C1CC1)C1CCC1 ZINC001101462377 1245862360 /nfs/dbraw/zinc/86/23/60/1245862360.db2.gz UFYZGFZCCVOPSH-UHFFFAOYSA-N 1 1 346.431 2.164 20 5 EEBDMO CC(C)CC[N@H+]1Cc2ccc(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2C1 ZINC001054265741 1247936675 /nfs/dbraw/zinc/93/66/75/1247936675.db2.gz WCCNVFACSCPVFU-IAGOWNOFSA-N 1 1 331.416 2.330 20 5 EEBDMO CC(C)CC[N@@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1 ZINC001054265741 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329.360 2.080 20 5 EEBDMO [NH3+]CC[C@H]1CCCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000443057305 315226701 /nfs/dbraw/zinc/22/67/01/315226701.db2.gz GFBURKVLCHLIKZ-GFCCVEGCSA-N 1 1 331.376 2.206 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCC(C)(C)C2)c1 ZINC000444628102 315312703 /nfs/dbraw/zinc/31/27/03/315312703.db2.gz GSNHKZOJTQYQIT-UHFFFAOYSA-N 1 1 335.404 2.455 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000565995329 319233382 /nfs/dbraw/zinc/23/33/82/319233382.db2.gz QWIDDNCSOIIKLQ-KRWDZBQOSA-N 1 1 332.404 2.222 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 ZINC000576570904 320184043 /nfs/dbraw/zinc/18/40/43/320184043.db2.gz LQDUSEGTHMQZDK-CYBMUJFWSA-N 1 1 349.435 2.435 20 5 EEBDMO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000354826603 465175021 /nfs/dbraw/zinc/17/50/21/465175021.db2.gz IOPDSGHWZFIXOQ-WQGACYEGSA-N 1 1 348.378 2.299 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H](C)C(C)(C)O ZINC000298028260 465277981 /nfs/dbraw/zinc/27/79/81/465277981.db2.gz BVTAPJGBXQSZCZ-LLVKDONJSA-N 1 1 339.392 2.023 20 5 EEBDMO Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000356429791 465375344 /nfs/dbraw/zinc/37/53/44/465375344.db2.gz QSDWOMRUUWQWRA-UHFFFAOYSA-N 1 1 349.435 2.057 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CCCC23CC[NH+](C)CC3)c1[N+](=O)[O-] ZINC000351870394 465408525 /nfs/dbraw/zinc/40/85/25/465408525.db2.gz MFENGCFSAHZANG-UHFFFAOYSA-N 1 1 335.408 2.142 20 5 EEBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1C[C@H](O)C[N@H+]1Cc1ccccc1 ZINC000089644489 462703281 /nfs/dbraw/zinc/70/32/81/462703281.db2.gz YVOJXAMJBZKJQQ-RDJZCZTQSA-N 1 1 342.399 2.346 20 5 EEBDMO CC[N@H+](CCC(=O)OC)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000064570043 462710721 /nfs/dbraw/zinc/71/07/21/462710721.db2.gz DMSKSHUGJLTFQK-UHFFFAOYSA-N 1 1 334.332 2.030 20 5 EEBDMO CC[N@@H+](CCC(=O)OC)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000064570043 462710725 /nfs/dbraw/zinc/71/07/25/462710725.db2.gz DMSKSHUGJLTFQK-UHFFFAOYSA-N 1 1 334.332 2.030 20 5 EEBDMO C[C@H]1CCC[N@@H+](CCNC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000047146125 462747810 /nfs/dbraw/zinc/74/78/10/462747810.db2.gz XLLDNNRYUYSTRJ-AWEZNQCLSA-N 1 1 334.420 2.245 20 5 EEBDMO COc1ccc(NC(=O)C[N@@H+](C[C@@H]2CCOC2)C2CC2)c([N+](=O)[O-])c1 ZINC000047405772 462778761 /nfs/dbraw/zinc/77/87/61/462778761.db2.gz AZKDOMSCGSIHHF-LBPRGKRZSA-N 1 1 349.387 2.043 20 5 EEBDMO CCC(CC)[C@H](CNC(=O)c1ccc([N+](=O)[O-])o1)[NH+]1CCOCC1 ZINC000047459627 462787219 /nfs/dbraw/zinc/78/72/19/462787219.db2.gz NRVGOFYVMYFAJW-ZDUSSCGKSA-N 1 1 339.392 2.055 20 5 EEBDMO CO[C@H]1CCC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000117338825 462800799 /nfs/dbraw/zinc/80/07/99/462800799.db2.gz YMDZFYHWISDYOO-ZDUSSCGKSA-N 1 1 335.360 2.004 20 5 EEBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](CO)c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000090884767 462815332 /nfs/dbraw/zinc/81/53/32/462815332.db2.gz TULQEUACUKKLAT-RISCZKNCSA-N 1 1 334.376 2.111 20 5 EEBDMO CC[N@H+]1CCCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000118826245 462855365 /nfs/dbraw/zinc/85/53/65/462855365.db2.gz QBAQXUBIOIDVJR-UHFFFAOYSA-N 1 1 334.420 2.259 20 5 EEBDMO CCN1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000118826245 462855370 /nfs/dbraw/zinc/85/53/70/462855370.db2.gz QBAQXUBIOIDVJR-UHFFFAOYSA-N 1 1 334.420 2.259 20 5 EEBDMO CCN1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000118826245 462855375 /nfs/dbraw/zinc/85/53/75/462855375.db2.gz QBAQXUBIOIDVJR-UHFFFAOYSA-N 1 1 334.420 2.259 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CCO[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC000091453706 462880136 /nfs/dbraw/zinc/88/01/36/462880136.db2.gz XDYMJACBQBIJCW-ZDUSSCGKSA-N 1 1 335.404 2.293 20 5 EEBDMO CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1c1ccccc1 ZINC000134278165 463022181 /nfs/dbraw/zinc/02/21/81/463022181.db2.gz AXWWSZYHTGKVPT-DLBZAZTESA-N 1 1 344.415 2.278 20 5 EEBDMO Cc1c([C@H](C)[NH2+]C[C@@H](C)CN2CCN(C)CC2)cccc1[N+](=O)[O-] ZINC000120925145 463054197 /nfs/dbraw/zinc/05/41/97/463054197.db2.gz IISRQRZFRZYURS-ZBFHGGJFSA-N 1 1 334.464 2.437 20 5 EEBDMO CCC[N@H+]1CC[C@@H](CNc2nccc(C(=O)OCC)c2[N+](=O)[O-])C1 ZINC000077932856 463073498 /nfs/dbraw/zinc/07/34/98/463073498.db2.gz HVEKSUVUDFEAJA-LBPRGKRZSA-N 1 1 336.392 2.310 20 5 EEBDMO Cc1nn(C)c(NCc2ccc(-n3cc[nH+]c3C)nc2)c1[N+](=O)[O-] ZINC000052510506 463084595 /nfs/dbraw/zinc/08/45/95/463084595.db2.gz UDAJJPIUDBBTSC-UHFFFAOYSA-N 1 1 327.348 2.138 20 5 EEBDMO CN(C)c1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cn1 ZINC000121357629 463122190 /nfs/dbraw/zinc/12/21/90/463122190.db2.gz UOWHSRWSFJKYDP-UHFFFAOYSA-N 1 1 341.415 2.378 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCOc3ccccc3F)CC2)cn1 ZINC000026483284 463165162 /nfs/dbraw/zinc/16/51/62/463165162.db2.gz QSBWZGMEZCRRPB-UHFFFAOYSA-N 1 1 346.362 2.330 20 5 EEBDMO COc1ccc(CC(=O)NC[C@H](c2ccco2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000069365941 463235854 /nfs/dbraw/zinc/23/58/54/463235854.db2.gz KAUCMSWFZBHCOL-CQSZACIVSA-N 1 1 347.371 2.158 20 5 EEBDMO C[C@H](O)CC[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000072714483 463537805 /nfs/dbraw/zinc/53/78/05/463537805.db2.gz JSUWWRUVXAFPSO-UWVGGRQHSA-N 1 1 329.784 2.278 20 5 EEBDMO C[C@H](O)CC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000072714483 463537809 /nfs/dbraw/zinc/53/78/09/463537809.db2.gz JSUWWRUVXAFPSO-UWVGGRQHSA-N 1 1 329.784 2.278 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000110992655 463668432 /nfs/dbraw/zinc/66/84/32/463668432.db2.gz WATJJTQLXGYPOD-CQSZACIVSA-N 1 1 335.404 2.354 20 5 EEBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000073949683 463673458 /nfs/dbraw/zinc/67/34/58/463673458.db2.gz ZMFLLAMAOCIWDU-CYBMUJFWSA-N 1 1 345.403 2.278 20 5 EEBDMO COc1cccc(N(C)CC(C)(C)C[NH+]2CCOCC2)c1[N+](=O)[O-] ZINC000185622196 463851467 /nfs/dbraw/zinc/85/14/67/463851467.db2.gz COXUIHDMPYLIQD-UHFFFAOYSA-N 1 1 337.420 2.398 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000261910295 463896366 /nfs/dbraw/zinc/89/63/66/463896366.db2.gz HMRSQPDKAVUJDJ-HNNXBMFYSA-N 1 1 346.774 2.430 20 5 EEBDMO COc1cccc(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c1[N+](=O)[O-] ZINC000194729888 463916933 /nfs/dbraw/zinc/91/69/33/463916933.db2.gz UEVVBNDIAKBMBD-TZMCWYRMSA-N 1 1 333.388 2.160 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000283581554 463931947 /nfs/dbraw/zinc/93/19/47/463931947.db2.gz KVPHMRGHJPWSDU-NSHDSACASA-N 1 1 338.383 2.310 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000194946703 463964427 /nfs/dbraw/zinc/96/44/27/463964427.db2.gz BFKSUXOJTHICMK-UHFFFAOYSA-N 1 1 349.431 2.334 20 5 EEBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000283668278 463966524 /nfs/dbraw/zinc/96/65/24/463966524.db2.gz FFVCZFYUAFFQOG-NSHDSACASA-N 1 1 338.383 2.263 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](OCCO)C1 ZINC000172291931 464039784 /nfs/dbraw/zinc/03/97/84/464039784.db2.gz ZYAYHAZHZIDNHD-MRXNPFEDSA-N 1 1 338.404 2.355 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](OCCO)C1 ZINC000172291931 464039792 /nfs/dbraw/zinc/03/97/92/464039792.db2.gz ZYAYHAZHZIDNHD-MRXNPFEDSA-N 1 1 338.404 2.355 20 5 EEBDMO COc1cc(C(=O)NC[C@H](C)Cn2cc[nH+]c2C)ccc1[N+](=O)[O-] ZINC000195490461 464059910 /nfs/dbraw/zinc/05/99/10/464059910.db2.gz HXFJFKWULSCWEX-NSHDSACASA-N 1 1 332.360 2.174 20 5 EEBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](C2CC2)O1 ZINC000279410783 464100683 /nfs/dbraw/zinc/10/06/83/464100683.db2.gz VVPKWGFEFKVODX-MLGOLLRUSA-N 1 1 333.388 2.423 20 5 EEBDMO CCOc1cc(N2CC[NH+](CCC(=O)CC)CC2)ccc1[N+](=O)[O-] ZINC000280248239 464195343 /nfs/dbraw/zinc/19/53/43/464195343.db2.gz OFXCHSPWRQFGTR-UHFFFAOYSA-N 1 1 335.404 2.485 20 5 EEBDMO C[C@@H]1CN(C(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000292333070 464198863 /nfs/dbraw/zinc/19/88/63/464198863.db2.gz JYKPWNWYXUYEHJ-AWEZNQCLSA-N 1 1 347.415 2.306 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C(N)=O)[C@@H](C)c1ccccc1 ZINC000292394722 464218249 /nfs/dbraw/zinc/21/82/49/464218249.db2.gz ZYBVPQZGURDQRA-SJCJKPOMSA-N 1 1 343.383 2.351 20 5 EEBDMO CC(C)[N@H+]1CCCN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000292426199 464229351 /nfs/dbraw/zinc/22/93/51/464229351.db2.gz LQHIAZCKALSJOB-AWEZNQCLSA-N 1 1 334.420 2.338 20 5 EEBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000270275932 464242674 /nfs/dbraw/zinc/24/26/74/464242674.db2.gz SMKPQBKQVXNLMR-IRXDYDNUSA-N 1 1 342.399 2.362 20 5 EEBDMO C[C@H]1CN(c2cccc(F)c2)CC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000292472569 464244993 /nfs/dbraw/zinc/24/49/93/464244993.db2.gz ZVIMCGDSRVTQPX-ZDUSSCGKSA-N 1 1 333.367 2.141 20 5 EEBDMO CC[C@H]1CN(c2cc(OC)c([N+](=O)[O-])cc2F)CC[N@H+]1C[C@H](C)O ZINC000270567061 464260075 /nfs/dbraw/zinc/26/00/75/464260075.db2.gz NHXGGYUQZFVGFS-RYUDHWBXSA-N 1 1 341.383 2.024 20 5 EEBDMO C[C@@H](CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[N@H+]1CCC[C@@H](C)C1 ZINC000180454365 464314804 /nfs/dbraw/zinc/31/48/04/464314804.db2.gz XYJMZSRAZYRUGV-NEPJUHHUSA-N 1 1 349.387 2.174 20 5 EEBDMO COc1ccc(C[N@@H+]2CCC[C@H]2[C@@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000264583225 464382975 /nfs/dbraw/zinc/38/29/75/464382975.db2.gz DEXIEAZYSSQFGA-GXFFZTMASA-N 1 1 334.294 2.491 20 5 EEBDMO COc1ccc(C[N@H+]2CCC[C@H]2[C@@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000264583225 464382979 /nfs/dbraw/zinc/38/29/79/464382979.db2.gz DEXIEAZYSSQFGA-GXFFZTMASA-N 1 1 334.294 2.491 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](CO)CC2)cccc1[N+](=O)[O-] ZINC000293317202 464400735 /nfs/dbraw/zinc/40/07/35/464400735.db2.gz XKRXZUXWPMVWBZ-KGLIPLIRSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@]1(CCCO)CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000272022077 464449493 /nfs/dbraw/zinc/44/94/93/464449493.db2.gz NATPLVBPPHOYOP-GOSISDBHSA-N 1 1 347.415 2.111 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N(C)[C@H](C)C2CC[NH+](C)CC2)c1[N+](=O)[O-] ZINC000272174612 464506124 /nfs/dbraw/zinc/50/61/24/464506124.db2.gz KFYYMTDVNMOAOK-LLVKDONJSA-N 1 1 337.424 2.244 20 5 EEBDMO C[C@H]([NH2+][C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1ccccn1 ZINC000181804070 464529947 /nfs/dbraw/zinc/52/99/47/464529947.db2.gz ZCZICVUVIDORNF-BLLLJJGKSA-N 1 1 326.356 2.446 20 5 EEBDMO O=C(NCC[NH+]1CCC2(CCCCC2)CC1)c1n[nH]cc1[N+](=O)[O-] ZINC000281795936 464588763 /nfs/dbraw/zinc/58/87/63/464588763.db2.gz OMPUAVMOXNWYBL-UHFFFAOYSA-N 1 1 335.408 2.094 20 5 EEBDMO CCC[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)CC1CC1 ZINC000182171498 464590268 /nfs/dbraw/zinc/59/02/68/464590268.db2.gz WRFFXJZWBHTVHD-UHFFFAOYSA-N 1 1 326.418 2.491 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 ZINC000285615374 464629668 /nfs/dbraw/zinc/62/96/68/464629668.db2.gz WBTZCIWQXJZJMJ-OLZOCXBDSA-N 1 1 335.408 2.045 20 5 EEBDMO CC[C@@H](Cc1ccccc1)[N@@H+](CC)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000247655741 464699975 /nfs/dbraw/zinc/69/99/75/464699975.db2.gz 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/nfs/dbraw/zinc/47/47/46/464474746.db2.gz TYVZQQJGUVILIH-UHFFFAOYSA-N 1 1 335.404 2.273 20 5 EEBDMO O=C(NCC[NH+]1CCSCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000264848150 464488862 /nfs/dbraw/zinc/48/88/62/464488862.db2.gz ZGAGSEOFZLUALK-UHFFFAOYSA-N 1 1 329.809 2.027 20 5 EEBDMO CC[N@@H+](CCNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-])C1CC1 ZINC000281646104 464533297 /nfs/dbraw/zinc/53/32/97/464533297.db2.gz RJZUHRFOHJJXAY-UHFFFAOYSA-N 1 1 335.404 2.273 20 5 EEBDMO COc1cc(C(=O)NCC[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000294669559 464569109 /nfs/dbraw/zinc/56/91/09/464569109.db2.gz ZUJJGGGSADLQFF-LLVKDONJSA-N 1 1 339.367 2.204 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000294701599 464579928 /nfs/dbraw/zinc/57/99/28/464579928.db2.gz VHMAACDQSVFPTI-JTQLQIEISA-N 1 1 327.356 2.203 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](CN3CCOCC3)C2)c(Cl)c1 ZINC000182190920 464594866 /nfs/dbraw/zinc/59/48/66/464594866.db2.gz SGXMHNNHUDYDPI-CYBMUJFWSA-N 1 1 339.823 2.402 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](CN3CCOCC3)C2)c(Cl)c1 ZINC000182190920 464594870 /nfs/dbraw/zinc/59/48/70/464594870.db2.gz SGXMHNNHUDYDPI-CYBMUJFWSA-N 1 1 339.823 2.402 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)[C@@H]2C1 ZINC000272487231 464628496 /nfs/dbraw/zinc/62/84/96/464628496.db2.gz MRRDJBIJEWPWTB-IAQYHMDHSA-N 1 1 328.372 2.242 20 5 EEBDMO O=c1cccc2n1C[C@H]1C[C@@H]2C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000295087177 464700684 /nfs/dbraw/zinc/70/06/84/464700684.db2.gz BOQXTRFFYXCZMT-JKSUJKDBSA-N 1 1 339.395 2.418 20 5 EEBDMO Cc1[nH+]ccn1CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000273935343 464728201 /nfs/dbraw/zinc/72/82/01/464728201.db2.gz JDBIRKHLJAJAJF-UHFFFAOYSA-N 1 1 334.351 2.333 20 5 EEBDMO Cn1cc([C@@H]2CSCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)cn1 ZINC000191211426 464799892 /nfs/dbraw/zinc/79/98/92/464799892.db2.gz OAXGTBBMFBGBAI-INIZCTEOSA-N 1 1 348.428 2.497 20 5 EEBDMO Cn1cc([C@@H]2CSCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)cn1 ZINC000191211426 464799897 /nfs/dbraw/zinc/79/98/97/464799897.db2.gz OAXGTBBMFBGBAI-INIZCTEOSA-N 1 1 348.428 2.497 20 5 EEBDMO COC(=O)[C@]1(C)C[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000282410758 464808792 /nfs/dbraw/zinc/80/87/92/464808792.db2.gz CGIWNROGMOIPDR-PSTGCABASA-N 1 1 349.387 2.053 20 5 EEBDMO COC(=O)[C@]1(C)C[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000282410758 464808794 /nfs/dbraw/zinc/80/87/94/464808794.db2.gz CGIWNROGMOIPDR-PSTGCABASA-N 1 1 349.387 2.053 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(c3nc4ccc([N+](=O)[O-])cc4c(=O)[nH]3)CC[C@@H]21 ZINC000286137014 464816628 /nfs/dbraw/zinc/81/66/28/464816628.db2.gz HRHIHNUZVPCZRG-NHYWBVRUSA-N 1 1 343.387 2.164 20 5 EEBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCC[NH+]1CCCCCC1 ZINC000276125610 464817570 /nfs/dbraw/zinc/81/75/70/464817570.db2.gz ZMZOJBOCDNVHFT-UHFFFAOYSA-N 1 1 341.433 2.286 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c1 ZINC000286205612 464839106 /nfs/dbraw/zinc/83/91/06/464839106.db2.gz YDQQCDQFBZFBLM-KURKYZTESA-N 1 1 342.399 2.296 20 5 EEBDMO CCO[C@@H]1C[C@H](O)C12CC[NH+](Cc1ccc([N+](=O)[O-])c(F)c1)CC2 ZINC000276330270 464891336 /nfs/dbraw/zinc/89/13/36/464891336.db2.gz QXXCUCDQRIQTGU-JKSUJKDBSA-N 1 1 338.379 2.486 20 5 EEBDMO CC(=O)c1cc([N+](=O)[O-])ccc1NCCN1CC[N@H+](C)C(C)(C)C1 ZINC000286371952 464895489 /nfs/dbraw/zinc/89/54/89/464895489.db2.gz IJOPMPDIDPKBSO-UHFFFAOYSA-N 1 1 334.420 2.235 20 5 EEBDMO CC[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)Cc1ccsc1 ZINC000249594317 464897615 /nfs/dbraw/zinc/89/76/15/464897615.db2.gz WJFSGXOLFRKNCD-DOMZBBRYSA-N 1 1 338.433 2.167 20 5 EEBDMO C[C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@@H]1CC[NH3+] ZINC000593917653 468432966 /nfs/dbraw/zinc/43/29/66/468432966.db2.gz XGZFPOZPJSBNQA-QMTHXVAHSA-N 1 1 331.376 2.061 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1ccnn1C ZINC000348376449 465572569 /nfs/dbraw/zinc/57/25/69/465572569.db2.gz RBUBYYGZZHFKRT-UHFFFAOYSA-N 1 1 331.376 2.097 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000299057353 465580835 /nfs/dbraw/zinc/58/08/35/465580835.db2.gz PVDZGCPQDPCUQD-HOCLYGCPSA-N 1 1 328.372 2.433 20 5 EEBDMO O=[N+]([O-])c1cccc(CNC[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000344547051 465661998 /nfs/dbraw/zinc/66/19/98/465661998.db2.gz ZOCRUNNHYCSMQB-LJQANCHMSA-N 1 1 341.411 2.321 20 5 EEBDMO O=[N+]([O-])c1cccc(C[NH2+]C[C@]2(O)CCN(Cc3ccccc3)C2)c1 ZINC000344547051 465662002 /nfs/dbraw/zinc/66/20/02/465662002.db2.gz ZOCRUNNHYCSMQB-LJQANCHMSA-N 1 1 341.411 2.321 20 5 EEBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000357012416 465700004 /nfs/dbraw/zinc/70/00/04/465700004.db2.gz YUNZGKSWWKSXEP-QWRGUYRKSA-N 1 1 340.811 2.211 20 5 EEBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000330615630 465732943 /nfs/dbraw/zinc/73/29/43/465732943.db2.gz UUBMJSKVTYDZCC-QWRGUYRKSA-N 1 1 325.796 2.342 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)C2)C1 ZINC000366536518 465789854 /nfs/dbraw/zinc/78/98/54/465789854.db2.gz RYQMZQXEXFXMQV-GOSISDBHSA-N 1 1 342.399 2.173 20 5 EEBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2[nH]nc(C)c2[N+](=O)[O-])c1 ZINC000299557754 465800877 /nfs/dbraw/zinc/80/08/77/465800877.db2.gz SJXBWCZRPFKXQJ-UHFFFAOYSA-N 1 1 331.376 2.008 20 5 EEBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CC[N@@H+](CCOC)C1 ZINC000361210837 465838159 /nfs/dbraw/zinc/83/81/59/465838159.db2.gz DETAIUZNKVEXCE-CVEARBPZSA-N 1 1 349.431 2.000 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)C(C)C ZINC000357188139 465841516 /nfs/dbraw/zinc/84/15/16/465841516.db2.gz RUEWUYOQASNVKL-UHFFFAOYSA-N 1 1 339.392 2.072 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOC[C@H]1C1CC1 ZINC000299728041 465872969 /nfs/dbraw/zinc/87/29/69/465872969.db2.gz VPWVCXBDIPXATA-HNNXBMFYSA-N 1 1 349.387 2.043 20 5 EEBDMO Nc1nc(NC[C@H]2CCC[N@H+]2CC2CCCCC2)ncc1[N+](=O)[O-] ZINC000301161327 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PAOJHHKRGBWYIF-OAHLLOKOSA-N 1 1 333.388 2.227 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](C)c1ccncc1F ZINC000338351841 466052786 /nfs/dbraw/zinc/05/27/86/466052786.db2.gz VDGLALNMRGZTIP-JTQLQIEISA-N 1 1 348.334 2.427 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@@H](CCO)C3)o2)c1 ZINC000357813960 466232776 /nfs/dbraw/zinc/23/27/76/466232776.db2.gz JBWKZWBHMQPPHW-ZDUSSCGKSA-N 1 1 331.372 2.497 20 5 EEBDMO CC(=O)NCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CCSCC1 ZINC000338584903 466236968 /nfs/dbraw/zinc/23/69/68/466236968.db2.gz HZSSUMQRRSPFID-UHFFFAOYSA-N 1 1 337.445 2.429 20 5 EEBDMO CC(C)(CNC(=O)c1ccc([N+](=O)[O-])[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000340675400 466255787 /nfs/dbraw/zinc/25/57/87/466255787.db2.gz BXBYVDKHCOPMRD-UHFFFAOYSA-N 1 1 342.399 2.490 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCC[C@H](CO)C3)o2)c1 ZINC000304662684 466309619 /nfs/dbraw/zinc/30/96/19/466309619.db2.gz ANUVLZPHSXCCRL-ZDUSSCGKSA-N 1 1 331.372 2.497 20 5 EEBDMO CCNC(=O)[C@H](C)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000338714965 466331253 /nfs/dbraw/zinc/33/12/53/466331253.db2.gz VKPLKLOPKZITFY-NSHDSACASA-N 1 1 347.371 2.478 20 5 EEBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@]1(CO)CCOC1 ZINC000600179062 468487159 /nfs/dbraw/zinc/48/71/59/468487159.db2.gz SKXCKUPTLBAJOQ-KRWDZBQOSA-N 1 1 332.356 2.438 20 5 EEBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@]1(CO)CCOC1 ZINC000600179065 468487249 /nfs/dbraw/zinc/48/72/49/468487249.db2.gz SKXCKUPTLBAJOQ-QGZVFWFLSA-N 1 1 332.356 2.438 20 5 EEBDMO CC(C)[N@@H+](C)C[C@H](O)Cn1cnc2cc3ccccc3cc2c1=O ZINC000581082757 468487663 /nfs/dbraw/zinc/48/76/63/468487663.db2.gz NJWPUBRZLQHOJM-INIZCTEOSA-N 1 1 325.412 2.251 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CNc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000354425839 466557991 /nfs/dbraw/zinc/55/79/91/466557991.db2.gz IOCWUXOTXVCACP-UONOGXRCSA-N 1 1 334.420 2.338 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@](C)(F)C2)c([N+](=O)[O-])c1 ZINC000347348831 466583433 /nfs/dbraw/zinc/58/34/33/466583433.db2.gz KMDMGWCFMOSLGO-OAHLLOKOSA-N 1 1 325.340 2.366 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@](C)(F)C1 ZINC000347350147 466584879 /nfs/dbraw/zinc/58/48/79/466584879.db2.gz MBBUOLAIOHSMTH-HNNXBMFYSA-N 1 1 325.340 2.366 20 5 EEBDMO CCOc1ccc(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)cc1[N+](=O)[O-] ZINC000368352751 466605011 /nfs/dbraw/zinc/60/50/11/466605011.db2.gz WVRPYVWZRRRPLA-KRWDZBQOSA-N 1 1 333.388 2.161 20 5 EEBDMO COc1cc(C(=O)N2CC[N@H+](C)C[C@@H]2C(C)C)c([N+](=O)[O-])cc1F ZINC000410500855 466699225 /nfs/dbraw/zinc/69/92/25/466699225.db2.gz BZOAVIUNHQMCHS-CQSZACIVSA-N 1 1 339.367 2.155 20 5 EEBDMO COc1cc(C(=O)N2CC[N@@H+](C)C[C@@H]2C(C)C)c([N+](=O)[O-])cc1F ZINC000410500855 466699230 /nfs/dbraw/zinc/69/92/30/466699230.db2.gz BZOAVIUNHQMCHS-CQSZACIVSA-N 1 1 339.367 2.155 20 5 EEBDMO CCN1C[C@@H](C)[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000411722986 466886874 /nfs/dbraw/zinc/88/68/74/466886874.db2.gz RPCVKBTUYOUJQQ-ZIAGYGMSSA-N 1 1 334.420 2.338 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@]23CCOC3)c([N+](=O)[O-])c1 ZINC000411765269 466896119 /nfs/dbraw/zinc/89/61/19/466896119.db2.gz JJGVHIJYWUYQJR-KRWDZBQOSA-N 1 1 349.387 2.187 20 5 EEBDMO C[N@H+]1CCCC12CCN(CC(=O)Nc1ccccc1[N+](=O)[O-])CC2 ZINC000370649807 466953611 /nfs/dbraw/zinc/95/36/11/466953611.db2.gz HGUQWGSBPWSWHY-UHFFFAOYSA-N 1 1 332.404 2.094 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000412061966 466990136 /nfs/dbraw/zinc/99/01/36/466990136.db2.gz HXUHKKJVPOBHLN-QGZVFWFLSA-N 1 1 349.387 2.199 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](CO)[C@@H]1C ZINC000412087103 467003001 /nfs/dbraw/zinc/00/30/01/467003001.db2.gz OXFNCHLELNBLLI-KBPBESRZSA-N 1 1 335.404 2.325 20 5 EEBDMO CC[C@@H]1CN(c2ccc([N+](=O)[O-])c3ncccc32)CC[N@H+]1C[C@H](C)O ZINC000413129286 467175556 /nfs/dbraw/zinc/17/55/56/467175556.db2.gz LHLQBWRPTDAFPA-UONOGXRCSA-N 1 1 344.415 2.424 20 5 EEBDMO 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ZINC000595747477 468984753 /nfs/dbraw/zinc/98/47/53/468984753.db2.gz DXNZQUDVSJPYIT-KRWDZBQOSA-N 1 1 343.431 2.040 20 5 EEBDMO CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1ccccc1 ZINC000610505867 468989264 /nfs/dbraw/zinc/98/92/64/468989264.db2.gz ZNXMJTLKOYXONA-HOTGVXAUSA-N 1 1 330.388 2.235 20 5 EEBDMO CC[N@H+]1CCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@H]1C ZINC000611092474 469159684 /nfs/dbraw/zinc/15/96/84/469159684.db2.gz VDSCBXMEXKUEHL-TZMCWYRMSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1cc(NCC[N@@H+]2CC[C@H](O)C2)c(Br)cc1[N+](=O)[O-] ZINC000599199217 469160933 /nfs/dbraw/zinc/16/09/33/469160933.db2.gz HDAVYYRKTDCFQX-JTQLQIEISA-N 1 1 344.209 2.144 20 5 EEBDMO Cc1cc(NCC[N@H+]2CC[C@H](O)C2)c(Br)cc1[N+](=O)[O-] ZINC000599199217 469160938 /nfs/dbraw/zinc/16/09/38/469160938.db2.gz HDAVYYRKTDCFQX-JTQLQIEISA-N 1 1 344.209 2.144 20 5 EEBDMO CNC(=O)c1ccc(NC[C@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000596308489 469239160 /nfs/dbraw/zinc/23/91/60/469239160.db2.gz SVWARWRXSCSCSB-GFCCVEGCSA-N 1 1 334.420 2.487 20 5 EEBDMO Cc1noc(C)c1[C@H](C)[NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000612461530 469473675 /nfs/dbraw/zinc/47/36/75/469473675.db2.gz INKQGINQCYUXOR-JTQLQIEISA-N 1 1 344.371 2.440 20 5 EEBDMO C[N@H+](CCc1ccccn1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000612584161 469501886 /nfs/dbraw/zinc/50/18/86/469501886.db2.gz WWGANVXHKQFBCW-UHFFFAOYSA-N 1 1 329.356 2.436 20 5 EEBDMO C[N@@H+](CCc1ccccn1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000612584161 469501889 /nfs/dbraw/zinc/50/18/89/469501889.db2.gz WWGANVXHKQFBCW-UHFFFAOYSA-N 1 1 329.356 2.436 20 5 EEBDMO CCOc1cccc(N2CC[NH+](C[C@H]3CCCO3)CC2)c1[N+](=O)[O-] ZINC000613041541 469613340 /nfs/dbraw/zinc/61/33/40/469613340.db2.gz NCHOUUPAPMLDRF-CQSZACIVSA-N 1 1 335.404 2.295 20 5 EEBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000619758798 469677492 /nfs/dbraw/zinc/67/74/92/469677492.db2.gz KRLLCRAFKUYKMH-MRXNPFEDSA-N 1 1 346.431 2.263 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000451728615 536140161 /nfs/dbraw/zinc/14/01/61/536140161.db2.gz HAAMFFWCUNFBGO-AWEZNQCLSA-N 1 1 334.420 2.258 20 5 EEBDMO CC[C@H]1CCC[N@H+]1CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000727823774 576451563 /nfs/dbraw/zinc/45/15/63/576451563.db2.gz KIYFERMXSKFWCU-SUMWQHHRSA-N 1 1 346.387 2.194 20 5 EEBDMO C[NH+]1CCN(C(=O)CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000772039703 577246904 /nfs/dbraw/zinc/24/69/04/577246904.db2.gz QOVALRBAJQKHRG-UHFFFAOYSA-N 1 1 347.202 2.088 20 5 EEBDMO COCC[NH+](CCOC)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774636638 577407925 /nfs/dbraw/zinc/40/79/25/577407925.db2.gz VSUNXEQWPQXXHK-UHFFFAOYSA-N 1 1 342.783 2.150 20 5 EEBDMO COc1ccc([C@H](CO)[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776581698 577463094 /nfs/dbraw/zinc/46/30/94/577463094.db2.gz HRICODFSXJRFKT-ZWKOTPCHSA-N 1 1 346.383 2.302 20 5 EEBDMO COC(=O)C[C@@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000754524446 577807880 /nfs/dbraw/zinc/80/78/80/577807880.db2.gz XVBBRAAGLBSGQU-CYBMUJFWSA-N 1 1 346.343 2.076 20 5 EEBDMO Cc1ccc(C2=CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)CC2)cc1 ZINC000743256968 577882302 /nfs/dbraw/zinc/88/23/02/577882302.db2.gz ZJIPNBASCMRAJR-GOSISDBHSA-N 1 1 342.399 2.250 20 5 EEBDMO COCC[N@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CCCC1 ZINC000747792126 577950159 /nfs/dbraw/zinc/95/01/59/577950159.db2.gz YPFNHJJMUURKJV-UHFFFAOYSA-N 1 1 335.360 2.351 20 5 EEBDMO COCC[N@@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CCCC1 ZINC000747792126 577950160 /nfs/dbraw/zinc/95/01/60/577950160.db2.gz YPFNHJJMUURKJV-UHFFFAOYSA-N 1 1 335.360 2.351 20 5 EEBDMO CCOC[C@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000748095165 577955029 /nfs/dbraw/zinc/95/50/29/577955029.db2.gz QTCJIBBPLRKZCZ-ZDUSSCGKSA-N 1 1 331.376 2.169 20 5 EEBDMO C[C@H](C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1[C@H](C)CC[C@H]1C ZINC000741021369 578111457 /nfs/dbraw/zinc/11/14/57/578111457.db2.gz DJKBPENXHVLGLJ-JHJVBQTASA-N 1 1 349.387 2.338 20 5 EEBDMO COc1c(O)ccc(C[N@@H+](CCO)CCc2ccccc2)c1[N+](=O)[O-] ZINC000892042317 677939879 /nfs/dbraw/zinc/93/98/79/677939879.db2.gz NYWCMMGNMVVAKF-UHFFFAOYSA-N 1 1 346.383 2.346 20 5 EEBDMO C[C@H](CNC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000891980373 677838763 /nfs/dbraw/zinc/83/87/63/677838763.db2.gz FJVBPTQZTPNEEJ-KGLIPLIRSA-N 1 1 346.431 2.482 20 5 EEBDMO C[C@@H]1CCN(c2c([N+](=O)[O-])cnn2C)CC[N@H+]1Cc1ccccc1 ZINC000892742900 682979330 /nfs/dbraw/zinc/97/93/30/682979330.db2.gz ZBLZVWFQAOOKCS-CQSZACIVSA-N 1 1 329.404 2.429 20 5 EEBDMO CC(C)[C@@](C)([NH2+]Cc1cccc([N+](=O)[O-])c1Br)C(N)=O ZINC000312402284 684555691 /nfs/dbraw/zinc/55/56/91/684555691.db2.gz PHVJRRAOYFPJEY-CYBMUJFWSA-N 1 1 344.209 2.347 20 5 EEBDMO Cc1cc(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1 ZINC001034643921 1196464941 /nfs/dbraw/zinc/46/49/41/1196464941.db2.gz ADDVXCFGBMVXIV-KBUPBQIOSA-N 1 1 337.445 2.239 20 5 EEBDMO 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349.387 2.117 20 5 EEBDMO CNC(=O)OC[C@@H]1CCCC[N@@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000286732145 465016664 /nfs/dbraw/zinc/01/66/64/465016664.db2.gz HHJQGKVGYGVNLX-ZDUSSCGKSA-N 1 1 337.376 2.314 20 5 EEBDMO CNC(=O)OC[C@@H]1CCCC[N@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000286732145 465016670 /nfs/dbraw/zinc/01/66/70/465016670.db2.gz HHJQGKVGYGVNLX-ZDUSSCGKSA-N 1 1 337.376 2.314 20 5 EEBDMO Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+]1CC1CCCCC1 ZINC000356453365 465391353 /nfs/dbraw/zinc/39/13/53/465391353.db2.gz CTJMDFLGPVRPNK-AWEZNQCLSA-N 1 1 349.435 2.103 20 5 EEBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CC[C@H](CC3CC3)C2)cc1 ZINC000339675081 465435360 /nfs/dbraw/zinc/43/53/60/465435360.db2.gz BYRNXPDXVDQGNG-CQSZACIVSA-N 1 1 338.429 2.491 20 5 EEBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CC[C@H](CC3CC3)C2)cc1 ZINC000339675081 465435364 /nfs/dbraw/zinc/43/53/64/465435364.db2.gz BYRNXPDXVDQGNG-CQSZACIVSA-N 1 1 338.429 2.491 20 5 EEBDMO C[C@H]1[C@@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CCC[N@H+]1C ZINC000343477502 465519755 /nfs/dbraw/zinc/51/97/55/465519755.db2.gz CRHLFZIMMVWNQW-ZFWWWQNUSA-N 1 1 346.431 2.408 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000356970571 465668398 /nfs/dbraw/zinc/66/83/98/465668398.db2.gz FRLYRBFDIGKXDC-VXGBXAGGSA-N 1 1 331.376 2.169 20 5 EEBDMO CC[N@H+]1CC[C@@H](CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000299361458 465716506 /nfs/dbraw/zinc/71/65/06/465716506.db2.gz YWNAANIXTGHIJV-ZDUSSCGKSA-N 1 1 330.388 2.008 20 5 EEBDMO COc1cc(CN2CC[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000330607078 465728948 /nfs/dbraw/zinc/72/89/48/465728948.db2.gz JGUHIZHVUGIARY-JTQLQIEISA-N 1 1 345.346 2.341 20 5 EEBDMO C[C@H]1COCC[N@H+]1C1CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000593990684 468453368 /nfs/dbraw/zinc/45/33/68/468453368.db2.gz IEGUIBGBFNBUIL-ZDUSSCGKSA-N 1 1 337.395 2.419 20 5 EEBDMO CNc1c(C(=O)NC[C@H](C)Cn2cc[nH+]c2C)cccc1[N+](=O)[O-] ZINC000361162541 465809005 /nfs/dbraw/zinc/80/90/05/465809005.db2.gz UBYUVKHWHQMTFF-NSHDSACASA-N 1 1 331.376 2.208 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353447457 465890110 /nfs/dbraw/zinc/89/01/10/465890110.db2.gz MAMRQADXVNFXTP-IAGOWNOFSA-N 1 1 343.431 2.492 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@]1(C)CCCO ZINC000345959772 465918320 /nfs/dbraw/zinc/91/83/20/465918320.db2.gz ZCYCBWBSKHBTMZ-QGZVFWFLSA-N 1 1 335.404 2.469 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@]1(C)CCCO ZINC000345959772 465918326 /nfs/dbraw/zinc/91/83/26/465918326.db2.gz ZCYCBWBSKHBTMZ-QGZVFWFLSA-N 1 1 335.404 2.469 20 5 EEBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000346166683 465953257 /nfs/dbraw/zinc/95/32/57/465953257.db2.gz SAOANSKCSPKOHI-ZQIUZPCESA-N 1 1 331.416 2.326 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C)[C@@H](C(C)C)C1 ZINC000362717827 465969712 /nfs/dbraw/zinc/96/97/12/465969712.db2.gz 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C[C@@H](O)[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000305183986 466372008 /nfs/dbraw/zinc/37/20/08/466372008.db2.gz OSRZVICJYDFNJX-DGCLKSJQSA-N 1 1 332.360 2.238 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000363407578 466383181 /nfs/dbraw/zinc/38/31/81/466383181.db2.gz ACIGFQYBDCGSDZ-MRXNPFEDSA-N 1 1 341.367 2.347 20 5 EEBDMO COc1cc(CN2CCC(C[NH+](C)C)CC2)c([N+](=O)[O-])cc1OC ZINC000350185473 466420062 /nfs/dbraw/zinc/42/00/62/466420062.db2.gz VEDSKMYWYGRTMD-UHFFFAOYSA-N 1 1 337.420 2.386 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@H]1CCCC[C@H]1O ZINC000305794094 466465912 /nfs/dbraw/zinc/46/59/12/466465912.db2.gz DZAFSCDWNRLRPG-CZUORRHYSA-N 1 1 335.404 2.325 20 5 EEBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@](O)(C(F)(F)F)C2)c1 ZINC000354380757 466521418 /nfs/dbraw/zinc/52/14/18/466521418.db2.gz CWMSBTUPXRMMOC-CYBMUJFWSA-N 1 1 334.294 2.363 20 5 EEBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@](O)(C(F)(F)F)C2)c1 ZINC000354380757 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1 1 345.403 2.418 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](CO)[C@@H]1C ZINC000412063472 466989957 /nfs/dbraw/zinc/98/99/57/466989957.db2.gz BCLCUMJFZJZLDK-UONOGXRCSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@H]1[C@@H](CO)CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000412088446 467002902 /nfs/dbraw/zinc/00/29/02/467002902.db2.gz PLEMMTLTMHCIFJ-WCQYABFASA-N 1 1 332.360 2.238 20 5 EEBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C(C)(C)CN1CCOCC1 ZINC000412093814 467005318 /nfs/dbraw/zinc/00/53/18/467005318.db2.gz OQMIOPLMJNVUTL-UHFFFAOYSA-N 1 1 337.420 2.016 20 5 EEBDMO COC(=O)[C@]1(C)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000377115674 467032487 /nfs/dbraw/zinc/03/24/87/467032487.db2.gz PVSFZWHEBOWVPH-SJKOYZFVSA-N 1 1 349.387 2.054 20 5 EEBDMO O=C(CC[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000370990037 467065703 /nfs/dbraw/zinc/06/57/03/467065703.db2.gz BIOSROJRLFSFII-ZIAGYGMSSA-N 1 1 333.388 2.282 20 5 EEBDMO 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ZINC000451548025 467259741 /nfs/dbraw/zinc/25/97/41/467259741.db2.gz LZTKYEONPSBXAL-WBVHZDCISA-N 1 1 333.432 2.495 20 5 EEBDMO COC[C@@]1(CO)CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000451926812 467285458 /nfs/dbraw/zinc/28/54/58/467285458.db2.gz IHZILJLMWAZZKC-KRWDZBQOSA-N 1 1 347.371 2.081 20 5 EEBDMO COC[C@@]1(CO)CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000451926812 467285461 /nfs/dbraw/zinc/28/54/61/467285461.db2.gz IHZILJLMWAZZKC-KRWDZBQOSA-N 1 1 347.371 2.081 20 5 EEBDMO CCn1cccc(C[NH2+]Cc2cc(OC)c(OC)cc2[N+](=O)[O-])c1=O ZINC000433195023 467305580 /nfs/dbraw/zinc/30/55/80/467305580.db2.gz QCKCGVAJFOTUHZ-UHFFFAOYSA-N 1 1 347.371 2.083 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](CCCO)C2)cccc1[N+](=O)[O-] ZINC000452120522 467331024 /nfs/dbraw/zinc/33/10/24/467331024.db2.gz GDHRRQPHYGWMRA-CQSZACIVSA-N 1 1 335.404 2.326 20 5 EEBDMO C[N@@H+](Cc1ccccc1)C1(CNC(=O)c2[nH]ncc2[N+](=O)[O-])CCC1 ZINC000452725910 467414765 /nfs/dbraw/zinc/41/47/65/467414765.db2.gz FILRTSNKZMEBGN-UHFFFAOYSA-N 1 1 343.387 2.102 20 5 EEBDMO C[N@H+](Cc1ccccc1)C1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CCC1 ZINC000452725910 467414769 /nfs/dbraw/zinc/41/47/69/467414769.db2.gz FILRTSNKZMEBGN-UHFFFAOYSA-N 1 1 343.387 2.102 20 5 EEBDMO C[N@@H+](Cc1ccccc1)C1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CCC1 ZINC000452725910 467414774 /nfs/dbraw/zinc/41/47/74/467414774.db2.gz FILRTSNKZMEBGN-UHFFFAOYSA-N 1 1 343.387 2.102 20 5 EEBDMO CNC(=O)[C@]1(C)CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000430277855 467416710 /nfs/dbraw/zinc/41/67/10/467416710.db2.gz NZZYNUMSNWCAPR-QGZVFWFLSA-N 1 1 344.371 2.208 20 5 EEBDMO CNc1nc(C(=O)NCCC[N@@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000454512261 467597708 /nfs/dbraw/zinc/59/77/08/467597708.db2.gz BSQCNMDEGMLNMY-UHFFFAOYSA-N 1 1 349.435 2.416 20 5 EEBDMO C[C@H]1C[N@H+](C)CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000448945007 467607087 /nfs/dbraw/zinc/60/70/87/467607087.db2.gz GDPGXOXTCPJQDY-VIFPVBQESA-N 1 1 331.294 2.390 20 5 EEBDMO C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000448945007 467607089 /nfs/dbraw/zinc/60/70/89/467607089.db2.gz GDPGXOXTCPJQDY-VIFPVBQESA-N 1 1 331.294 2.390 20 5 EEBDMO CCN1CCN([C@H](C)C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449080239 467617095 /nfs/dbraw/zinc/61/70/95/467617095.db2.gz UNEFGRRWUMAOOM-HZPDHXFCSA-N 1 1 334.464 2.141 20 5 EEBDMO CCC(CC)[C@H](CNc1ncc([N+](=O)[O-])c(C)n1)[NH+]1CCOCC1 ZINC000450244232 467807290 /nfs/dbraw/zinc/80/72/90/467807290.db2.gz OSUUUTNJGBZUSN-HNNXBMFYSA-N 1 1 337.424 2.242 20 5 EEBDMO CCN1CC[NH+]([C@@H](C)CNc2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000450259418 467810759 /nfs/dbraw/zinc/81/07/59/467810759.db2.gz WMNPLEBERBSPOH-AWEZNQCLSA-N 1 1 343.431 2.581 20 5 EEBDMO CC[N@H+]1CCC[C@H](CNc2ccc(CC(=O)OC)cc2[N+](=O)[O-])C1 ZINC000450284166 467817722 /nfs/dbraw/zinc/81/77/22/467817722.db2.gz BPAXMZJDARUPCY-CQSZACIVSA-N 1 1 335.404 2.454 20 5 EEBDMO CC(C)[C@@H]1CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000487080519 468021430 /nfs/dbraw/zinc/02/14/30/468021430.db2.gz SSWAIOSVUMZGQG-KRWDZBQOSA-N 1 1 346.431 2.263 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@@H+](C)[C@H](C(C)C)C1 ZINC000487199514 468028166 /nfs/dbraw/zinc/02/81/66/468028166.db2.gz HLFGVGJUKZIKKE-AWEZNQCLSA-N 1 1 336.392 2.407 20 5 EEBDMO CC(C)[C@@H]1CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[N@H+]1C ZINC000487947021 468062226 /nfs/dbraw/zinc/06/22/26/468062226.db2.gz KUPPGKQCIIEVFP-INIZCTEOSA-N 1 1 335.404 2.233 20 5 EEBDMO COc1ccc(NC(=O)CC[N@@H+](C)CC(C)(C)OC)c([N+](=O)[O-])c1 ZINC000532647527 468128629 /nfs/dbraw/zinc/12/86/29/468128629.db2.gz CRDPAWYRGGODNC-UHFFFAOYSA-N 1 1 339.392 2.289 20 5 EEBDMO COCC[N@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@@H]1CCO[C@@H]1C ZINC000489503930 468146262 /nfs/dbraw/zinc/14/62/62/468146262.db2.gz ZQDPAJISSVLEAB-BXUZGUMPSA-N 1 1 342.367 2.368 20 5 EEBDMO COCC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@@H]1CCO[C@@H]1C ZINC000489503930 468146264 /nfs/dbraw/zinc/14/62/64/468146264.db2.gz ZQDPAJISSVLEAB-BXUZGUMPSA-N 1 1 342.367 2.368 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C1CCOCC1 ZINC000533308360 468187241 /nfs/dbraw/zinc/18/72/41/468187241.db2.gz CSZDUHCUCFZBFK-UHFFFAOYSA-N 1 1 337.376 2.043 20 5 EEBDMO Cc1ccc(C(=O)N2CCC([N@@H+]3CCOC[C@@H]3C)CC2)cc1[N+](=O)[O-] ZINC000590390260 468244296 /nfs/dbraw/zinc/24/42/96/468244296.db2.gz WOKSADNHXHEPSV-AWEZNQCLSA-N 1 1 347.415 2.229 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594235245 468523686 /nfs/dbraw/zinc/52/36/86/468523686.db2.gz UNTPPHXROYKWIV-IAGOWNOFSA-N 1 1 346.431 2.453 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594235247 468523779 /nfs/dbraw/zinc/52/37/79/468523779.db2.gz UNTPPHXROYKWIV-SJORKVTESA-N 1 1 346.431 2.453 20 5 EEBDMO C[C@H](O)C[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000594615059 468636789 /nfs/dbraw/zinc/63/67/89/468636789.db2.gz LLXMIRBOBRFSBV-LBPRGKRZSA-N 1 1 330.388 2.341 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1CN1CCC([C@H]3CC[NH2+]C3)CC1)OCCO2 ZINC000592433566 468696397 /nfs/dbraw/zinc/69/63/97/468696397.db2.gz CGKOPCAKGZXMBQ-AWEZNQCLSA-N 1 1 347.415 2.188 20 5 EEBDMO C[C@H](CN1CCCCC1)[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000594914211 468722015 /nfs/dbraw/zinc/72/20/15/468722015.db2.gz FSRGPFVGEXLNOJ-CYBMUJFWSA-N 1 1 335.404 2.330 20 5 EEBDMO O=C1CCCCN1CCCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000601112801 468745757 /nfs/dbraw/zinc/74/57/57/468745757.db2.gz FRNXPLHZHRXKEC-UHFFFAOYSA-N 1 1 328.372 2.379 20 5 EEBDMO CCC[N@H+]1CC[C@@H](N[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000595097586 468758056 /nfs/dbraw/zinc/75/80/56/468758056.db2.gz YALXYQOTNSFSEV-WBVHZDCISA-N 1 1 343.431 2.492 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000583992239 468782917 /nfs/dbraw/zinc/78/29/17/468782917.db2.gz ZLOZOLWKTFYPRB-CVEARBPZSA-N 1 1 343.383 2.219 20 5 EEBDMO C[C@H]1CC[N@@H+](CCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000560363496 468790954 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2.412 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2NC(=O)CC[C@H]2C1 ZINC000595741255 468982929 /nfs/dbraw/zinc/98/29/29/468982929.db2.gz MCSPVORSAMQJPP-SWLSCSKDSA-N 1 1 333.388 2.094 20 5 EEBDMO COC[C@H]1C[C@@H](O)C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000593674539 469089886 /nfs/dbraw/zinc/08/98/86/469089886.db2.gz XENZSHZHNHHQOD-HUUCEWRRSA-N 1 1 332.356 2.436 20 5 EEBDMO O=[N+]([O-])c1cn(C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)nc1C1CC1 ZINC000601958895 469113110 /nfs/dbraw/zinc/11/31/10/469113110.db2.gz OWMMIUALLUKYAN-SFHVURJKSA-N 1 1 342.399 2.306 20 5 EEBDMO Cn1cc(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000601978108 469124354 /nfs/dbraw/zinc/12/43/54/469124354.db2.gz XLGXXSXDEZSYPB-GASCZTMLSA-N 1 1 328.372 2.074 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2c[nH]nc2C1 ZINC000611008763 469138541 /nfs/dbraw/zinc/13/85/41/469138541.db2.gz JXMRPIDCYANYMV-UHFFFAOYSA-N 1 1 329.360 2.013 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCc2cn[nH]c2C1 ZINC000611008763 469138546 /nfs/dbraw/zinc/13/85/46/469138546.db2.gz JXMRPIDCYANYMV-UHFFFAOYSA-N 1 1 329.360 2.013 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2cn[nH]c2C1 ZINC000611008763 469138548 /nfs/dbraw/zinc/13/85/48/469138548.db2.gz JXMRPIDCYANYMV-UHFFFAOYSA-N 1 1 329.360 2.013 20 5 EEBDMO Cc1cc(CO)cc(N2CCN(c3cccc([N+](=O)[O-])c3)CC2)[nH+]1 ZINC000596076053 469143720 /nfs/dbraw/zinc/14/37/20/469143720.db2.gz BYECZTZGSPPUGD-UHFFFAOYSA-N 1 1 328.372 2.117 20 5 EEBDMO CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C[C@@H]1C ZINC000611223992 469199031 /nfs/dbraw/zinc/19/90/31/469199031.db2.gz SXNYOYCWAJRDHL-LBPRGKRZSA-N 1 1 328.372 2.309 20 5 EEBDMO O=[N+]([O-])c1ccccc1C[N@H+](CC1CCS(=O)(=O)CC1)C1CC1 ZINC000611244046 469206749 /nfs/dbraw/zinc/20/67/49/469206749.db2.gz CAOGVNCMBIZZON-UHFFFAOYSA-N 1 1 338.429 2.384 20 5 EEBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CC1CCS(=O)(=O)CC1)C1CC1 ZINC000611244046 469206755 /nfs/dbraw/zinc/20/67/55/469206755.db2.gz CAOGVNCMBIZZON-UHFFFAOYSA-N 1 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O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c(F)c1 ZINC001164731325 720367042 /nfs/dbraw/zinc/36/70/42/720367042.db2.gz ZDLVBRHWYRHONT-CVEARBPZSA-N 1 1 343.362 2.377 20 5 EEBDMO O=[N+]([O-])c1cc2c(Cl)ncnc2c(N2CCc3[nH+]ccn3CC2)c1 ZINC001167182019 757464493 /nfs/dbraw/zinc/46/44/93/757464493.db2.gz KLYCAEHRINCNCR-UHFFFAOYSA-N 1 1 344.762 2.451 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])cc(NCCC[N@H+]2CCCC[C@H]2C)n1 ZINC001167752675 769542261 /nfs/dbraw/zinc/54/22/61/769542261.db2.gz WTBAUTLPPCCTEM-GFCCVEGCSA-N 1 1 336.392 2.453 20 5 EEBDMO Cc1ncsc1C(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001031560281 769658140 /nfs/dbraw/zinc/65/81/40/769658140.db2.gz LYSHHIVOFZSYHN-UHFFFAOYSA-N 1 1 346.412 2.222 20 5 EEBDMO Cc1ccccc1C[N@H+]1CCCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1 ZINC000981763926 778159449 /nfs/dbraw/zinc/15/94/49/778159449.db2.gz MTVYDYMKPOKJKH-IAGOWNOFSA-N 1 1 343.427 2.085 20 5 EEBDMO Cc1ccccc1C[N@@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC000981763926 778159453 /nfs/dbraw/zinc/15/94/53/778159453.db2.gz MTVYDYMKPOKJKH-IAGOWNOFSA-N 1 1 343.427 2.085 20 5 EEBDMO Cc1ccccc1C[N@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC000981763926 778159456 /nfs/dbraw/zinc/15/94/56/778159456.db2.gz MTVYDYMKPOKJKH-IAGOWNOFSA-N 1 1 343.427 2.085 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)C[C@H]2C1 ZINC000907805108 784858234 /nfs/dbraw/zinc/85/82/34/784858234.db2.gz NWLNTHLWVCRJSV-AOOOYVTPSA-N 1 1 327.743 2.021 20 5 EEBDMO Cc1nn(C[N@@H+]2CCC[C@@H](n3ccnn3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000819897603 785706196 /nfs/dbraw/zinc/70/61/96/785706196.db2.gz RIZFKWRZENERTG-CQSZACIVSA-N 1 1 341.375 2.139 20 5 EEBDMO Cc1nn(C[N@H+]2CCC[C@@H](n3ccnn3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000819897603 785706203 /nfs/dbraw/zinc/70/62/03/785706203.db2.gz RIZFKWRZENERTG-CQSZACIVSA-N 1 1 341.375 2.139 20 5 EEBDMO COCC(C)(C)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000819944224 785734664 /nfs/dbraw/zinc/73/46/64/785734664.db2.gz XKQAOYVIBKCMFD-UHFFFAOYSA-N 1 1 338.364 2.050 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H]2CCC[N@@H+]2CCCO)c1 ZINC000824559042 788215028 /nfs/dbraw/zinc/21/50/28/788215028.db2.gz CZGOBQQMVYTLEA-AWEZNQCLSA-N 1 1 327.812 2.185 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@@H]2CCCN2CCCO)c1 ZINC000824559042 788215038 /nfs/dbraw/zinc/21/50/38/788215038.db2.gz CZGOBQQMVYTLEA-AWEZNQCLSA-N 1 1 327.812 2.185 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(Cc3ccc(Br)c([N+](=O)[O-])c3)C[C@@H]21 ZINC000824893005 788336657 /nfs/dbraw/zinc/33/66/57/788336657.db2.gz IHWOKDXDDGROKR-RISCZKNCSA-N 1 1 340.221 2.493 20 5 EEBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000923299274 789321400 /nfs/dbraw/zinc/32/14/00/789321400.db2.gz RNFFNQCYAJAHLN-QWHCGFSZSA-N 1 1 328.372 2.385 20 5 EEBDMO COc1cccc([C@H](C)[NH+]2CCN(Cn3cc([N+](=O)[O-])cn3)CC2)c1 ZINC000171607435 791414230 /nfs/dbraw/zinc/41/42/30/791414230.db2.gz FFZWKEPKLFYTCV-AWEZNQCLSA-N 1 1 345.403 2.136 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000173497482 791862044 /nfs/dbraw/zinc/86/20/44/791862044.db2.gz YXFMGZGGXIDEFF-CQSZACIVSA-N 1 1 344.419 2.084 20 5 EEBDMO Cc1cc(NCCNC(=O)C[N@H+](C)CC(C)(C)C)ccc1[N+](=O)[O-] ZINC001094141366 795992491 /nfs/dbraw/zinc/99/24/91/795992491.db2.gz RPBBRHIBLVIWGW-UHFFFAOYSA-N 1 1 336.436 2.409 20 5 EEBDMO CC[N@@H+]([C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])C1CN(C)C1 ZINC001173192293 797282197 /nfs/dbraw/zinc/28/21/97/797282197.db2.gz KYXOZJQYRSTVKS-LLVKDONJSA-N 1 1 325.384 2.309 20 5 EEBDMO CCO[C@@H]1C[C@H]2CN([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC[N@H+]2C1 ZINC001173224459 797307445 /nfs/dbraw/zinc/30/74/45/797307445.db2.gz HAHIRPNMLSGUGY-JCGIZDLHSA-N 1 1 333.432 2.321 20 5 EEBDMO O=C(NC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1)c1cncs1 ZINC001002409310 798042515 /nfs/dbraw/zinc/04/25/15/798042515.db2.gz AREVVNQNYOBAMR-UHFFFAOYSA-N 1 1 346.412 2.446 20 5 EEBDMO CC(C)(C)OC(=O)N[C@H]1C[C@@H]2C[C@H]1C[N@H+]2[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169011290 803570823 /nfs/dbraw/zinc/57/08/23/803570823.db2.gz JIITYRFTMFSJRL-YTFOTSKYSA-N 1 1 339.436 2.419 20 5 EEBDMO O=C(N[C@@H]1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1)c1ccccc1F ZINC001169056357 803597650 /nfs/dbraw/zinc/59/76/50/803597650.db2.gz SJNBQJVXRSBKFD-KFWWJZLASA-N 1 1 349.406 2.465 20 5 EEBDMO CSc1nc(Cl)c([N+](=O)[O-])c(N2C[C@@H]3CCC[N@@H+](C)[C@@H]3C2)n1 ZINC001157262740 807176976 /nfs/dbraw/zinc/17/69/76/807176976.db2.gz YCCGSDUVJNYWFP-DTWKUNHWSA-N 1 1 343.840 2.291 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790910441 808992672 /nfs/dbraw/zinc/99/26/72/808992672.db2.gz APFSAULBJRWXKH-NXEZZACHSA-N 1 1 343.786 2.481 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)OCCC[NH+]1CCN(C(C)C)CC1 ZINC000791797613 809422360 /nfs/dbraw/zinc/42/23/60/809422360.db2.gz VBFVPUJYRKVEDO-UHFFFAOYSA-N 1 1 349.431 2.476 20 5 EEBDMO CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)c2nn(CC)cc2[N+](=O)[O-])C1 ZINC000191804914 529760485 /nfs/dbraw/zinc/76/04/85/529760485.db2.gz PRUCGPAETYOONS-GFCCVEGCSA-N 1 1 346.391 2.047 20 5 EEBDMO CC(C)C(=O)NC[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000101908779 219171674 /nfs/dbraw/zinc/17/16/74/219171674.db2.gz JHTXRMRCZIPIJP-OAHLLOKOSA-N 1 1 349.431 2.458 20 5 EEBDMO CN(C(=O)C[N@H+](CCO)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000103140559 219260279 /nfs/dbraw/zinc/26/02/79/219260279.db2.gz OPVXVSNICVPFAR-UHFFFAOYSA-N 1 1 343.383 2.052 20 5 EEBDMO CN(C(=O)C[N@@H+](CCO)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000103140559 219260282 /nfs/dbraw/zinc/26/02/82/219260282.db2.gz OPVXVSNICVPFAR-UHFFFAOYSA-N 1 1 343.383 2.052 20 5 EEBDMO C[C@H]1SCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1C ZINC000181895194 234370643 /nfs/dbraw/zinc/37/06/43/234370643.db2.gz RPPGQIFDFAEPST-UPJWGTAASA-N 1 1 326.418 2.160 20 5 EEBDMO C[C@H]([NH3+])[C@@H]1COCC[C@H]1NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000423091601 240362123 /nfs/dbraw/zinc/36/21/23/240362123.db2.gz XUGSRYDIZYEVCX-QCZZGDTMSA-N 1 1 347.337 2.456 20 5 EEBDMO CSc1cccc(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-] ZINC000425065547 241118423 /nfs/dbraw/zinc/11/84/23/241118423.db2.gz LRHDQXHMAOPYDX-WCQYABFASA-N 1 1 335.429 2.483 20 5 EEBDMO C[C@@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO ZINC000451655606 243195215 /nfs/dbraw/zinc/19/52/15/243195215.db2.gz SRDJUDRESCJATC-TXEJJXNPSA-N 1 1 327.812 2.135 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@H+](CCCO)[C@@H]2CCc3ccccc32)c1 ZINC000266029561 248044874 /nfs/dbraw/zinc/04/48/74/248044874.db2.gz RMQMIOUKWPXTPY-QGZVFWFLSA-N 1 1 330.388 2.163 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(NC[C@@H](C(C)C)N2CC[NH+](C)CC2)c1 ZINC000266134950 248120827 /nfs/dbraw/zinc/12/08/27/248120827.db2.gz FKBZXKOSPGCMTB-KRWDZBQOSA-N 1 1 336.436 2.287 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cccnc32)C[C@H]1C ZINC000266398727 248281564 /nfs/dbraw/zinc/28/15/64/248281564.db2.gz PACNFFWVGKSSFK-OLZOCXBDSA-N 1 1 330.388 2.034 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000266499857 248333043 /nfs/dbraw/zinc/33/30/43/248333043.db2.gz WVFKMTBGTGHKPC-JKSUJKDBSA-N 1 1 334.351 2.128 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(N3CC[N@H+]4CCCC[C@H]4C3)n2)cc1 ZINC000359456333 285106888 /nfs/dbraw/zinc/10/68/88/285106888.db2.gz SXANEKJQOCFGFR-AWEZNQCLSA-N 1 1 329.360 2.319 20 5 EEBDMO CCOc1ccc(NC(=O)C[NH2+][C@H](C)c2cnn(C)c2)c([N+](=O)[O-])c1 ZINC000273278859 256283533 /nfs/dbraw/zinc/28/35/33/256283533.db2.gz IGKRZSLUSFVDCV-LLVKDONJSA-N 1 1 347.375 2.016 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000273422948 256295016 /nfs/dbraw/zinc/29/50/16/256295016.db2.gz ZCHXXHBKHAHYRZ-HIFRSBDPSA-N 1 1 331.372 2.500 20 5 EEBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000119694762 221379378 /nfs/dbraw/zinc/37/93/78/221379378.db2.gz FQFFWBVYZDAJLF-HNNXBMFYSA-N 1 1 348.447 2.491 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCc2nn(C)c(=O)cc2C1 ZINC000182817262 292296528 /nfs/dbraw/zinc/29/65/28/292296528.db2.gz KREKCVJTQAEYFT-LBPRGKRZSA-N 1 1 328.372 2.116 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCc2nn(C)c(=O)cc2C1 ZINC000182817262 292296531 /nfs/dbraw/zinc/29/65/31/292296531.db2.gz KREKCVJTQAEYFT-LBPRGKRZSA-N 1 1 328.372 2.116 20 5 EEBDMO COC(=O)CC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)C ZINC000074321071 159063408 /nfs/dbraw/zinc/06/34/08/159063408.db2.gz MZHMSDNAXNQIHE-UHFFFAOYSA-N 1 1 348.359 2.418 20 5 EEBDMO COC(=O)CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)C ZINC000074321071 159063413 /nfs/dbraw/zinc/06/34/13/159063413.db2.gz MZHMSDNAXNQIHE-UHFFFAOYSA-N 1 1 348.359 2.418 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000247328146 160320312 /nfs/dbraw/zinc/32/03/12/160320312.db2.gz WSHKYJMGWAPUTH-IJEWVQPXSA-N 1 1 346.431 2.338 20 5 EEBDMO Cc1cc([C@H]2CCC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])on1 ZINC000342695757 161083881 /nfs/dbraw/zinc/08/38/81/161083881.db2.gz 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CC[N@H+]1C[C@H](C)N(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000345941774 161344248 /nfs/dbraw/zinc/34/42/48/161344248.db2.gz DNDINWQMYWMQLR-KBPBESRZSA-N 1 1 334.420 2.338 20 5 EEBDMO C[C@H](C[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H](C)CO)c1ccccc1 ZINC000347443633 161452848 /nfs/dbraw/zinc/45/28/48/161452848.db2.gz FYKMDZBANQNEOU-KGLIPLIRSA-N 1 1 332.404 2.315 20 5 EEBDMO O=C(NCC1CC1)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000352694627 162248917 /nfs/dbraw/zinc/24/89/17/162248917.db2.gz WCLDDVKTXHWPEY-CQSZACIVSA-N 1 1 335.379 2.472 20 5 EEBDMO O=C(NCC1CC1)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000352694627 162248919 /nfs/dbraw/zinc/24/89/19/162248919.db2.gz WCLDDVKTXHWPEY-CQSZACIVSA-N 1 1 335.379 2.472 20 5 EEBDMO CN(C(=O)C[N@@H+]1CC[C@@H](COC(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000353010043 162390646 /nfs/dbraw/zinc/39/06/46/162390646.db2.gz SSAYQHNPTJZKPK-LLVKDONJSA-N 1 1 343.330 2.119 20 5 EEBDMO CN(C(=O)C[N@H+]1CC[C@@H](COC(F)F)C1)c1ccc([N+](=O)[O-])cc1 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ZINC000427989054 467191325 /nfs/dbraw/zinc/19/13/25/467191325.db2.gz FLVQEEQUVNSRSH-AWEZNQCLSA-N 1 1 347.419 2.052 20 5 EEBDMO COCCCC[N@@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000419377891 467194723 /nfs/dbraw/zinc/19/47/23/467194723.db2.gz BVUSHEZJLDYWLE-LBPRGKRZSA-N 1 1 339.392 2.289 20 5 EEBDMO C[C@H](CN1CCOCC1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548023 467259704 /nfs/dbraw/zinc/25/97/04/467259704.db2.gz LZTKYEONPSBXAL-NVXWUHKLSA-N 1 1 333.432 2.495 20 5 EEBDMO Cc1ccc(CN2CCN([C@@H]3CCC[N@H+](C)C3)CC2)cc1[N+](=O)[O-] ZINC000378354982 467276683 /nfs/dbraw/zinc/27/66/83/467276683.db2.gz MGDAFDJCFAVDEP-QGZVFWFLSA-N 1 1 332.448 2.115 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](O)C12CCCC2 ZINC000433034778 467285556 /nfs/dbraw/zinc/28/55/56/467285556.db2.gz ULHNDTWSBUTDHG-OAHLLOKOSA-N 1 1 333.388 2.221 20 5 EEBDMO NC(=O)c1cccc([N+](=O)[O-])c1N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000420594119 467431115 /nfs/dbraw/zinc/43/11/15/467431115.db2.gz YZAITXYDKMPKRT-CQSZACIVSA-N 1 1 340.383 2.380 20 5 EEBDMO COc1cc(CN2CCC3(CC[NH2+]C3)CC2)c([N+](=O)[O-])cc1OC ZINC000430929017 467476777 /nfs/dbraw/zinc/47/67/77/467476777.db2.gz MTKGTBZKEJFHTJ-UHFFFAOYSA-N 1 1 335.404 2.188 20 5 EEBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)CN1CCC(C)CC1 ZINC000449122424 467619528 /nfs/dbraw/zinc/61/95/28/467619528.db2.gz LIJNJNHYPMYUQJ-RDJZCZTQSA-N 1 1 335.448 2.208 20 5 EEBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])NC[C@H](O)C[NH+]1CCC(C)CC1 ZINC000449122424 467619530 /nfs/dbraw/zinc/61/95/30/467619530.db2.gz LIJNJNHYPMYUQJ-RDJZCZTQSA-N 1 1 335.448 2.208 20 5 EEBDMO C[C@@H]1[C@@H](NC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)CCC[N@H+]1C ZINC000450789395 467908279 /nfs/dbraw/zinc/90/82/79/467908279.db2.gz GJXWYVOOLJNDDC-RISCZKNCSA-N 1 1 343.387 2.197 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cn2C)C[N@H+]1Cc1ccccc1 ZINC000531569453 468061541 /nfs/dbraw/zinc/06/15/41/468061541.db2.gz UFSPMVKZNJBHFI-HIFRSBDPSA-N 1 1 342.399 2.326 20 5 EEBDMO COc1ccc(CC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000531726244 468071822 /nfs/dbraw/zinc/07/18/22/468071822.db2.gz SKBNJXMZGGFXQP-HUUCEWRRSA-N 1 1 347.415 2.089 20 5 EEBDMO CC(C)CN1C[C@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)CCN2C1=O ZINC000488725696 468099543 /nfs/dbraw/zinc/09/95/43/468099543.db2.gz CDMFCKMAFMJKHQ-QGZVFWFLSA-N 1 1 346.431 2.215 20 5 EEBDMO CC(C)CN1C[C@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CCN2C1=O ZINC000488725696 468099544 /nfs/dbraw/zinc/09/95/44/468099544.db2.gz CDMFCKMAFMJKHQ-QGZVFWFLSA-N 1 1 346.431 2.215 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000590344985 468237552 /nfs/dbraw/zinc/23/75/52/468237552.db2.gz CDTYTGKFFWSHKO-CQSZACIVSA-N 1 1 335.404 2.468 20 5 EEBDMO CCNc1ccc(C(=O)NCc2c[nH+]c3n2CCCC3)cc1[N+](=O)[O-] ZINC000556492765 468529421 /nfs/dbraw/zinc/52/94/21/468529421.db2.gz VUNMZWUOMBYRMG-UHFFFAOYSA-N 1 1 343.387 2.489 20 5 EEBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1ccc(F)cc1[N+](=O)[O-])C2 ZINC000597710126 468647313 /nfs/dbraw/zinc/64/73/13/468647313.db2.gz HIYSEPOYVVQDIL-KRWDZBQOSA-N 1 1 335.379 2.221 20 5 EEBDMO COc1ccc(C(=O)N2CCC[C@@]3(CC[N@@H+](C)C3)C2)cc1[N+](=O)[O-] ZINC000597715576 468648715 /nfs/dbraw/zinc/64/87/15/468648715.db2.gz MVHZIKRNGWBBKL-KRWDZBQOSA-N 1 1 333.388 2.161 20 5 EEBDMO CC(C)CNC(=O)CCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000595370484 468828343 /nfs/dbraw/zinc/82/83/43/468828343.db2.gz GRXYIZFYYBXNGC-CQSZACIVSA-N 1 1 349.435 2.028 20 5 EEBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000598341837 468836812 /nfs/dbraw/zinc/83/68/12/468836812.db2.gz GXIYYKPCVQFHCB-CYBMUJFWSA-N 1 1 343.387 2.199 20 5 EEBDMO CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)CC1([NH+](C)C)CC1 ZINC000601409393 468861878 /nfs/dbraw/zinc/86/18/78/468861878.db2.gz POTUWGSZHFDTDM-UHFFFAOYSA-N 1 1 341.433 2.235 20 5 EEBDMO CC[N@H+]1CCCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H](C)C1 ZINC000595535050 468891202 /nfs/dbraw/zinc/89/12/02/468891202.db2.gz LPDADQHUUTZKFE-CYBMUJFWSA-N 1 1 335.404 2.377 20 5 EEBDMO C[C@@H](O)[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595764520 468996141 /nfs/dbraw/zinc/99/61/41/468996141.db2.gz AMFLOULXFCCIFG-BXKDBHETSA-N 1 1 327.768 2.032 20 5 EEBDMO C[C@@H](O)[C@H]1CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595764520 468996143 /nfs/dbraw/zinc/99/61/43/468996143.db2.gz AMFLOULXFCCIFG-BXKDBHETSA-N 1 1 327.768 2.032 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCN(c2ccccc2)CC1 ZINC000602769743 469062196 /nfs/dbraw/zinc/06/21/96/469062196.db2.gz WGAGYATWGIEOHW-UHFFFAOYSA-N 1 1 329.404 2.312 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000602777781 469067058 /nfs/dbraw/zinc/06/70/58/469067058.db2.gz LKXMDXQHGABSQD-MRXNPFEDSA-N 1 1 330.388 2.082 20 5 EEBDMO C[N@H+]1CCCC[C@H](CNC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000598994550 469079877 /nfs/dbraw/zinc/07/98/77/469079877.db2.gz AMBFJMXODLPBPG-CQSZACIVSA-N 1 1 334.420 2.168 20 5 EEBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(c2ccc(N)c([N+](=O)[O-])n2)C1 ZINC000596140223 469172789 /nfs/dbraw/zinc/17/27/89/469172789.db2.gz PJNPOTZJYBGMII-AWEZNQCLSA-N 1 1 327.388 2.283 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21 ZINC000602997174 469213061 /nfs/dbraw/zinc/21/30/61/469213061.db2.gz FEDBDUCPCSNMOZ-UAGQMJEPSA-N 1 1 347.415 2.467 20 5 EEBDMO C[N@@H+]1CCO[C@@H](CN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)C1 ZINC000563263322 469215393 /nfs/dbraw/zinc/21/53/93/469215393.db2.gz CXGOAOOJIRRBII-QWHCGFSZSA-N 1 1 333.310 2.118 20 5 EEBDMO C[N@H+]1CCO[C@@H](CN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)C1 ZINC000563263322 469215397 /nfs/dbraw/zinc/21/53/97/469215397.db2.gz CXGOAOOJIRRBII-QWHCGFSZSA-N 1 1 333.310 2.118 20 5 EEBDMO C[N@@H+]1CCO[C@H](CN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)C1 ZINC000563263321 469215646 /nfs/dbraw/zinc/21/56/46/469215646.db2.gz CXGOAOOJIRRBII-OLZOCXBDSA-N 1 1 333.310 2.118 20 5 EEBDMO C[N@H+]1CCO[C@H](CN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)C1 ZINC000563263321 469215651 /nfs/dbraw/zinc/21/56/51/469215651.db2.gz CXGOAOOJIRRBII-OLZOCXBDSA-N 1 1 333.310 2.118 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(Cc3cc4c(cc3[N+](=O)[O-])OCCO4)CC[C@H]21 ZINC000611286353 469220003 /nfs/dbraw/zinc/22/00/03/469220003.db2.gz QTKHDGSPAZUAGM-UKRRQHHQSA-N 1 1 347.415 2.282 20 5 EEBDMO O=C1NCCCC[C@@H]1[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602510502 469344397 /nfs/dbraw/zinc/34/43/97/469344397.db2.gz XJYDNHJDLDNMAO-VIFPVBQESA-N 1 1 348.222 2.177 20 5 EEBDMO O=C(CC[N@H+]1CCC[C@@H](n2ccnc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000609258024 469907211 /nfs/dbraw/zinc/90/72/11/469907211.db2.gz IQOAZDSIUCTBOD-MRXNPFEDSA-N 1 1 343.387 2.457 20 5 EEBDMO COc1cc(C[N@@H+]2CCC[C@H](Cn3ccnn3)C2)c([N+](=O)[O-])cc1F ZINC000184268935 533806268 /nfs/dbraw/zinc/80/62/68/533806268.db2.gz JKOWTIHJVWHVDA-LBPRGKRZSA-N 1 1 349.366 2.246 20 5 EEBDMO COc1cc(C[N@H+]2CCC[C@H](Cn3ccnn3)C2)c([N+](=O)[O-])cc1F ZINC000184268935 533806276 /nfs/dbraw/zinc/80/62/76/533806276.db2.gz JKOWTIHJVWHVDA-LBPRGKRZSA-N 1 1 349.366 2.246 20 5 EEBDMO Cc1c(NC(=O)CCN(C)CC[N@@H+](C)C2CC2)cccc1[N+](=O)[O-] ZINC000186752144 533899650 /nfs/dbraw/zinc/89/96/50/533899650.db2.gz DYBKULUGZRCLAU-UHFFFAOYSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+](C)CCN(C)C2CC2)cccc1[N+](=O)[O-] ZINC000186752144 533899654 /nfs/dbraw/zinc/89/96/54/533899654.db2.gz DYBKULUGZRCLAU-UHFFFAOYSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+](C)CCN(C)C2CC2)cccc1[N+](=O)[O-] ZINC000186752144 533899681 /nfs/dbraw/zinc/89/96/81/533899681.db2.gz DYBKULUGZRCLAU-UHFFFAOYSA-N 1 1 334.420 2.258 20 5 EEBDMO CC(C)C(=O)NC[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000153907943 527512887 /nfs/dbraw/zinc/51/28/87/527512887.db2.gz IITYAHFETIHHPF-YOEHRIQHSA-N 1 1 349.431 2.112 20 5 EEBDMO CCOCC[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000153685144 528742238 /nfs/dbraw/zinc/74/22/38/528742238.db2.gz LNJUAULVVQBOKU-UHFFFAOYSA-N 1 1 336.392 2.089 20 5 EEBDMO C[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000264923997 536375119 /nfs/dbraw/zinc/37/51/19/536375119.db2.gz QLEJECLNTJMWEN-CQSZACIVSA-N 1 1 332.404 2.019 20 5 EEBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC[C@H](n3ccnc3)C2)c1 ZINC000738160556 578001920 /nfs/dbraw/zinc/00/19/20/578001920.db2.gz XPDDXMLHZHHELF-HNNXBMFYSA-N 1 1 326.360 2.436 20 5 EEBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@H](n3ccnc3)C2)c1 ZINC000738160556 578001921 /nfs/dbraw/zinc/00/19/21/578001921.db2.gz XPDDXMLHZHHELF-HNNXBMFYSA-N 1 1 326.360 2.436 20 5 EEBDMO COC[C@H]1CC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000739918256 576311544 /nfs/dbraw/zinc/31/15/44/576311544.db2.gz DDKOZXDDEXEFGS-JTQLQIEISA-N 1 1 327.768 2.155 20 5 EEBDMO COC[C@H]1CC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000739918256 576311546 /nfs/dbraw/zinc/31/15/46/576311546.db2.gz DDKOZXDDEXEFGS-JTQLQIEISA-N 1 1 327.768 2.155 20 5 EEBDMO Cn1ccnc1[C@@H](O)[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000769939862 577587443 /nfs/dbraw/zinc/58/74/43/577587443.db2.gz AYWUSOIEBINAAH-WBVHZDCISA-N 1 1 344.415 2.316 20 5 EEBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CC[N@@H+](C)[C@@H](C)C1 ZINC000761067582 577675449 /nfs/dbraw/zinc/67/54/49/577675449.db2.gz FXQKTHMNQXKHNC-QWRGUYRKSA-N 1 1 340.811 2.211 20 5 EEBDMO CC[N@H+](C[C@H]1CCCO1)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000752789759 577776145 /nfs/dbraw/zinc/77/61/45/577776145.db2.gz OZPMCSVIUJTLLU-CQSZACIVSA-N 1 1 348.403 2.295 20 5 EEBDMO CC[N@@H+](C[C@H]1CCCO1)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000752789759 577776146 /nfs/dbraw/zinc/77/61/46/577776146.db2.gz OZPMCSVIUJTLLU-CQSZACIVSA-N 1 1 348.403 2.295 20 5 EEBDMO COC(=O)C[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000754526938 577807979 /nfs/dbraw/zinc/80/79/79/577807979.db2.gz SHFCNCRWJDTENP-CYBMUJFWSA-N 1 1 346.343 2.076 20 5 EEBDMO CC1(C)CC[N@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000743391796 577884512 /nfs/dbraw/zinc/88/45/12/577884512.db2.gz YANJKDWFHVHSLL-KRWDZBQOSA-N 1 1 346.387 2.051 20 5 EEBDMO CC1(C)CC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000743391796 577884513 /nfs/dbraw/zinc/88/45/13/577884513.db2.gz YANJKDWFHVHSLL-KRWDZBQOSA-N 1 1 346.387 2.051 20 5 EEBDMO Cc1c(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000748837018 577967950 /nfs/dbraw/zinc/96/79/50/577967950.db2.gz DVJYVFLBUWIADZ-NSHDSACASA-N 1 1 348.359 2.086 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000804778226 675630009 /nfs/dbraw/zinc/63/00/09/675630009.db2.gz SHVMJYVYWLKZLR-NSHDSACASA-N 1 1 349.416 2.204 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@@H+](CCC3CCCCCC3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001025777823 683268798 /nfs/dbraw/zinc/26/87/98/683268798.db2.gz OYKZCFZCBBPZSC-UUAJXVIYSA-N 1 1 335.448 2.059 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](CCC3CCCCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-] ZINC001025777823 683268799 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345.443 2.345 20 5 EEBDMO COC(=O)[C@@]1(C)CCCN1c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001165249252 1321483349 /nfs/dbraw/zinc/48/33/49/1321483349.db2.gz YSWPTNMZYGOYQE-YXMGTMDOSA-N 1 1 334.376 2.054 20 5 EEBDMO CCC[N@H+]1CC[C@H](Nc2c3cc(OC)ccc3ncc2[N+](=O)[O-])C1 ZINC001307175588 1331515392 /nfs/dbraw/zinc/51/53/92/1331515392.db2.gz NDBACPDIRPXZJY-LBPRGKRZSA-N 1 1 330.388 2.470 20 5 EEBDMO C[C@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[N@@H+]1C ZINC001326481702 1334102163 /nfs/dbraw/zinc/10/21/63/1334102163.db2.gz JHLMQQJWMZXAHM-VIFPVBQESA-N 1 1 331.294 2.390 20 5 EEBDMO C[C@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC001326481702 1334102164 /nfs/dbraw/zinc/10/21/64/1334102164.db2.gz JHLMQQJWMZXAHM-VIFPVBQESA-N 1 1 331.294 2.390 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C2CC2)C[C@H](C)C1 ZINC001330613423 1334877732 /nfs/dbraw/zinc/87/77/32/1334877732.db2.gz KUTWSRKCLXXWEP-LBPRGKRZSA-N 1 1 332.404 2.193 20 5 EEBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(c2cc(N)c([N+](=O)[O-])cn2)C1 ZINC001339774902 1337071290 /nfs/dbraw/zinc/07/12/90/1337071290.db2.gz WLIYYZQCBNFWTA-HNNXBMFYSA-N 1 1 341.415 2.325 20 5 EEBDMO CCOc1ccc2c(c1)C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)CC2 ZINC000090522199 1357088271 /nfs/dbraw/zinc/08/82/71/1357088271.db2.gz LYBUCBXEILRTCS-UHFFFAOYSA-N 1 1 343.383 2.214 20 5 EEBDMO CCOc1ccc2c(c1)C[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)CC2 ZINC000090522199 1357088278 /nfs/dbraw/zinc/08/82/78/1357088278.db2.gz LYBUCBXEILRTCS-UHFFFAOYSA-N 1 1 343.383 2.214 20 5 EEBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccc(-c3nn[nH]n3)c([N+](=O)[O-])c2)C1 ZINC001589630104 1349013108 /nfs/dbraw/zinc/01/31/08/1349013108.db2.gz RAKFVNIHYCHKBN-LBPRGKRZSA-N 1 1 345.407 2.165 20 5 EEBDMO O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC001593466710 1349803218 /nfs/dbraw/zinc/80/32/18/1349803218.db2.gz FGDISJAQWYQZFX-CYBMUJFWSA-N 1 1 340.343 2.357 20 5 EEBDMO CCn1c(-c2c[nH]c([N+](=O)[O-])c2)nnc1N1C[C@@H](C)[N@@H+](CC)C[C@@H]1C ZINC001121720004 1371918597 /nfs/dbraw/zinc/91/85/97/1371918597.db2.gz LECVGLQLQHLCLC-NEPJUHHUSA-N 1 1 347.423 2.120 20 5 EEBDMO C[C@@]([NH3+])(C(=O)Nc1ccc2c(c1)C(=O)OC2)c1cccc([N+](=O)[O-])c1 ZINC001576086750 1403560170 /nfs/dbraw/zinc/56/01/70/1403560170.db2.gz ZZLCUTPCEUHBJP-KRWDZBQOSA-N 1 1 341.323 2.078 20 5 EEBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)c1cc2n(n1)C[C@@H](C)[NH2+]C2 ZINC001578263659 1403729110 /nfs/dbraw/zinc/72/91/10/1403729110.db2.gz RNDKCSJITFEBHG-SNVBAGLBSA-N 1 1 329.360 2.098 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2ccc(N3CCc4[nH+]ccn4CC3)nn2)cc1 ZINC001167179979 757461825 /nfs/dbraw/zinc/46/18/25/757461825.db2.gz BMVTVBXVGIQSHA-UHFFFAOYSA-N 1 1 336.355 2.311 20 5 EEBDMO Cn1ncc([N+](=O)[O-])c1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000893569016 773330685 /nfs/dbraw/zinc/33/06/85/773330685.db2.gz XWDNFIWWTALHMH-UHFFFAOYSA-N 1 1 330.392 2.245 20 5 EEBDMO C[C@H](NC(=O)N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1)c1ccccc1[N+](=O)[O-] ZINC000894017170 780405066 /nfs/dbraw/zinc/40/50/66/780405066.db2.gz YPTRPSTZDMBODI-GDZNZVCISA-N 1 1 332.404 2.249 20 5 EEBDMO C[N@H+]1CCCC[C@@H]1CCn1cc([N+](=O)[O-])cc(Br)c1=O ZINC000906503241 783969505 /nfs/dbraw/zinc/96/95/05/783969505.db2.gz VHNMVUPJRBTRFJ-SNVBAGLBSA-N 1 1 344.209 2.393 20 5 EEBDMO C[N@H+]1CCCC[C@H]1CCn1cc([N+](=O)[O-])cc(Br)c1=O ZINC000906503239 783969876 /nfs/dbraw/zinc/96/98/76/783969876.db2.gz VHNMVUPJRBTRFJ-JTQLQIEISA-N 1 1 344.209 2.393 20 5 EEBDMO Cc1ccc(C[NH2+]CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1F ZINC000997770916 791040868 /nfs/dbraw/zinc/04/08/68/791040868.db2.gz BJQFJHYHWPUKBG-NVXWUHKLSA-N 1 1 349.406 2.128 20 5 EEBDMO CN1CC[NH+](Cc2ccc(NC(=O)CCC(C)(C)[N+](=O)[O-])cc2)CC1 ZINC000822500297 787244338 /nfs/dbraw/zinc/24/43/38/787244338.db2.gz NNDJGIOKUFHQOQ-UHFFFAOYSA-N 1 1 348.447 2.208 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H]2[C@@H](C1)C2(F)F ZINC000844455748 789113326 /nfs/dbraw/zinc/11/33/26/789113326.db2.gz OQVSGNJNIWKBMF-PHIMTYICSA-N 1 1 341.314 2.129 20 5 EEBDMO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCN(Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 ZINC000846225936 790093861 /nfs/dbraw/zinc/09/38/61/790093861.db2.gz ROKHKFKVZWXJQC-SRCQZFHVSA-N 1 1 337.395 2.452 20 5 EEBDMO Nc1ccc(C(=O)NC[C@H]2CC[N@@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000715695062 795482275 /nfs/dbraw/zinc/48/22/75/795482275.db2.gz IILWIGXVMFIXQO-OAHLLOKOSA-N 1 1 340.383 2.181 20 5 EEBDMO Nc1ccc(C(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000715695062 795482278 /nfs/dbraw/zinc/48/22/78/795482278.db2.gz IILWIGXVMFIXQO-OAHLLOKOSA-N 1 1 340.383 2.181 20 5 EEBDMO CCN(CCNc1ccc([N+](=O)[O-])c(C)c1)C(=O)Cn1cc[nH+]c1C ZINC001106768324 796492220 /nfs/dbraw/zinc/49/22/20/796492220.db2.gz VAPFOKKNZIALLD-UHFFFAOYSA-N 1 1 345.403 2.369 20 5 EEBDMO C[N@@H+](CC1COC1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173018686 797198941 /nfs/dbraw/zinc/19/89/41/797198941.db2.gz ZAOJEAJZLREXRX-UHFFFAOYSA-N 1 1 341.358 2.420 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C[C@@H]2CCN(C)C2)c1F ZINC001173178086 797277924 /nfs/dbraw/zinc/27/79/24/797277924.db2.gz ZUVMTHQBUONKSE-RYUDHWBXSA-N 1 1 325.384 2.215 20 5 EEBDMO COC(=O)[C@H]1CC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173182400 797280502 /nfs/dbraw/zinc/28/05/02/797280502.db2.gz ROTPVNMUMVSQJD-MNOVXSKESA-N 1 1 340.351 2.168 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N1CCC(Nc2ccccc2[N+](=O)[O-])CC1 ZINC001095233572 797565099 /nfs/dbraw/zinc/56/50/99/797565099.db2.gz DJQKCCMBYJFAJJ-UHFFFAOYSA-N 1 1 334.420 2.340 20 5 EEBDMO C[N@@H+]1CCc2c(sc(Nc3ccc([N+](=O)[O-])cc3)c2C(N)=O)C1 ZINC001174475306 797778825 /nfs/dbraw/zinc/77/88/25/797778825.db2.gz GLSFNOKGDKHBTD-UHFFFAOYSA-N 1 1 332.385 2.487 20 5 EEBDMO C[N@H+]1CCc2c(sc(Nc3ccc([N+](=O)[O-])cc3)c2C(N)=O)C1 ZINC001174475306 797778827 /nfs/dbraw/zinc/77/88/27/797778827.db2.gz GLSFNOKGDKHBTD-UHFFFAOYSA-N 1 1 332.385 2.487 20 5 EEBDMO CC1(C)CCC(C[NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC001002786440 798607720 /nfs/dbraw/zinc/60/77/20/798607720.db2.gz AUGLBWNOOTXZCS-HZPDHXFCSA-N 1 1 337.464 2.449 20 5 EEBDMO C[N@@H+]1CCC[C@@H]1c1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)n[nH]1 ZINC000823773226 798764982 /nfs/dbraw/zinc/76/49/82/798764982.db2.gz MBPDPNYGPOZWCL-OAHLLOKOSA-N 1 1 341.371 2.288 20 5 EEBDMO C[N@H+]1CCC[C@@H]1c1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)n[nH]1 ZINC000823773226 798764984 /nfs/dbraw/zinc/76/49/84/798764984.db2.gz MBPDPNYGPOZWCL-OAHLLOKOSA-N 1 1 341.371 2.288 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2CC1 ZINC000946589418 801543411 /nfs/dbraw/zinc/54/34/11/801543411.db2.gz YAXXLXFIOFIGAE-XMTFNYHQSA-N 1 1 343.427 2.022 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2CC1 ZINC000946589418 801543421 /nfs/dbraw/zinc/54/34/21/801543421.db2.gz YAXXLXFIOFIGAE-XMTFNYHQSA-N 1 1 343.427 2.022 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2CC1 ZINC000946589418 801543430 /nfs/dbraw/zinc/54/34/30/801543430.db2.gz YAXXLXFIOFIGAE-XMTFNYHQSA-N 1 1 343.427 2.022 20 5 EEBDMO O=C(NC[C@H]1C[C@@H]([NH2+]CC2CCC3(CC3)CC2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086084627 802116699 /nfs/dbraw/zinc/11/66/99/802116699.db2.gz YXCOFJZEJBZXHO-QKPAOTATSA-N 1 1 335.448 2.106 20 5 EEBDMO CC(C)(C)OC(=O)N1C[C@@H]2CC[N@@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)[C@@H]2C1 ZINC001169011074 803570791 /nfs/dbraw/zinc/57/07/91/803570791.db2.gz IBSACRGAGJDCHJ-ZQDZILKHSA-N 1 1 339.436 2.373 20 5 EEBDMO CC(C)(C)OC(=O)N1C[C@@H]2CC[N@@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)[C@@H]2C1 ZINC001169011071 803570877 /nfs/dbraw/zinc/57/08/77/803570877.db2.gz IBSACRGAGJDCHJ-BYNSBNAKSA-N 1 1 339.436 2.373 20 5 EEBDMO CC(C)N1CCOC[C@]2(CCC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)C1 ZINC001169019450 803587455 /nfs/dbraw/zinc/58/74/55/803587455.db2.gz IDLGQOWVFBBRSB-OKZBNKHCSA-N 1 1 339.480 2.255 20 5 EEBDMO O=C(N[C@@H]1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1)c1ccc(F)cc1 ZINC001169055864 803597043 /nfs/dbraw/zinc/59/70/43/803597043.db2.gz QVUXRPKLJVKOJG-XYPHTWIQSA-N 1 1 349.406 2.465 20 5 EEBDMO O=C(N[C@@H]1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1)c1cccc(F)c1 ZINC001169054894 803597144 /nfs/dbraw/zinc/59/71/44/803597144.db2.gz OBTJKOWJCUKXEF-XKQJLSEDSA-N 1 1 349.406 2.465 20 5 EEBDMO CC(C)[C@H](C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])[NH+](C)C ZINC000787960954 807316833 /nfs/dbraw/zinc/31/68/33/807316833.db2.gz JIPFQXMEKGUHHA-BXUZGUMPSA-N 1 1 337.376 2.051 20 5 EEBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790912082 808994966 /nfs/dbraw/zinc/99/49/66/808994966.db2.gz NGWUSXFBIPPGSW-VHSXEESVSA-N 1 1 343.786 2.481 20 5 EEBDMO CCNC(=O)[C@@H]1CCC[N@H+]1[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170355348 809902728 /nfs/dbraw/zinc/90/27/28/809902728.db2.gz AMRKUDPWPZPXDC-DOMZBBRYSA-N 1 1 335.404 2.135 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(c2nnc([C@@H](C)[N+](=O)[O-])n2CC(C)C)C[C@@H]1C ZINC001517388991 1119032952 /nfs/dbraw/zinc/03/29/52/1119032952.db2.gz CFENIANFRDCTPB-MELADBBJSA-N 1 1 338.456 2.191 20 5 EEBDMO CC[N@@H+](C)CCNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000051469727 214094931 /nfs/dbraw/zinc/09/49/31/214094931.db2.gz SLJBDKPANQUWJT-UHFFFAOYSA-N 1 1 334.401 2.400 20 5 EEBDMO CC[C@H](O)C[NH+]1CCN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC1 ZINC000179552631 529699624 /nfs/dbraw/zinc/69/96/24/529699624.db2.gz QUBONPUWVSMUDW-HNNXBMFYSA-N 1 1 349.431 2.049 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)CC[C@@H]21 ZINC000153960153 530064628 /nfs/dbraw/zinc/06/46/28/530064628.db2.gz ZWKOCDLNHNZTEG-NHYWBVRUSA-N 1 1 343.387 2.027 20 5 EEBDMO C[N@@H+]1CCC[C@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)CC[C@@H]21 ZINC000153960153 530064629 /nfs/dbraw/zinc/06/46/29/530064629.db2.gz ZWKOCDLNHNZTEG-NHYWBVRUSA-N 1 1 343.387 2.027 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)CC[C@@H]21 ZINC000153960153 530064630 /nfs/dbraw/zinc/06/46/30/530064630.db2.gz ZWKOCDLNHNZTEG-NHYWBVRUSA-N 1 1 343.387 2.027 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)[C@@H]2C1 ZINC000352805654 283073729 /nfs/dbraw/zinc/07/37/29/283073729.db2.gz PVXSFIKBNCZBFW-IAQYHMDHSA-N 1 1 328.372 2.242 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CC(C)(C)O)C1CC1 ZINC000189895107 237365698 /nfs/dbraw/zinc/36/56/98/237365698.db2.gz ZRSBIXVNNHOIMP-UHFFFAOYSA-N 1 1 335.404 2.467 20 5 EEBDMO Cn1ccnc1[C@H](N[C@@H]1CC[C@@H](C[NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423508097 240509589 /nfs/dbraw/zinc/50/95/89/240509589.db2.gz NMMBXWZVWYOBSY-XNRPHZJLSA-N 1 1 329.404 2.135 20 5 EEBDMO O=C(NCC[NH+]1CCSCC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000226226016 242091139 /nfs/dbraw/zinc/09/11/39/242091139.db2.gz UOPOIHZAVOLUEC-UHFFFAOYSA-N 1 1 329.809 2.027 20 5 EEBDMO CN(C(=O)C[N@H+]1CC[C@@H]2C[C@H](O)CC[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000451693932 243207723 /nfs/dbraw/zinc/20/77/23/243207723.db2.gz KANLDRANMDOYCC-JKIFEVAISA-N 1 1 347.415 2.041 20 5 EEBDMO O=C(/C=C\c1ccccc1[N+](=O)[O-])NC[C@H]1CCc2[nH+]ccn2C1 ZINC000492007694 246254479 /nfs/dbraw/zinc/25/44/79/246254479.db2.gz XWBBFWOWWUNQSU-FWPCIQOSSA-N 1 1 326.356 2.183 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000266103242 248098465 /nfs/dbraw/zinc/09/84/65/248098465.db2.gz SGYATZCGUONJGY-BDJLRTHQSA-N 1 1 330.388 2.488 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@H]1C ZINC000266316880 248244097 /nfs/dbraw/zinc/24/40/97/248244097.db2.gz FBKXPIVTCCPCEP-OLZOCXBDSA-N 1 1 330.388 2.034 20 5 EEBDMO CNC(=O)[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000093361357 218218764 /nfs/dbraw/zinc/21/87/64/218218764.db2.gz ULBNIQHKOAVBAM-SNVBAGLBSA-N 1 1 343.330 2.154 20 5 EEBDMO CNC(=O)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000093361357 218218767 /nfs/dbraw/zinc/21/87/67/218218767.db2.gz ULBNIQHKOAVBAM-SNVBAGLBSA-N 1 1 343.330 2.154 20 5 EEBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000153682717 296389099 /nfs/dbraw/zinc/38/90/99/296389099.db2.gz YOIKGTFSVSJRMP-CYBMUJFWSA-N 1 1 344.415 2.467 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000117333206 221053302 /nfs/dbraw/zinc/05/33/02/221053302.db2.gz BFLBPHJOYBKJQS-TXEJJXNPSA-N 1 1 335.360 2.002 20 5 EEBDMO C[C@@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000117333206 221053304 /nfs/dbraw/zinc/05/33/04/221053304.db2.gz BFLBPHJOYBKJQS-TXEJJXNPSA-N 1 1 335.360 2.002 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000246154798 256014745 /nfs/dbraw/zinc/01/47/45/256014745.db2.gz DHBOUYMBRPSQQU-XJKSGUPXSA-N 1 1 334.420 2.119 20 5 EEBDMO CN(C)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cc[nH+]1 ZINC000267298173 256046750 /nfs/dbraw/zinc/04/67/50/256046750.db2.gz KSCMIAISVVPTAR-UHFFFAOYSA-N 1 1 329.360 2.374 20 5 EEBDMO Cc1cc(N2CCC(Nc3ncccc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000267390361 256054684 /nfs/dbraw/zinc/05/46/84/256054684.db2.gz NIOHDFZUUIVMMZ-UHFFFAOYSA-N 1 1 328.376 2.478 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H]2C[C@H](O)c2cccs2)c1 ZINC000267448506 256059997 /nfs/dbraw/zinc/05/99/97/256059997.db2.gz LMTBGRKWCJMDAB-JSGCOSHPSA-N 1 1 336.417 2.441 20 5 EEBDMO CCOC(=O)[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000120512082 142391859 /nfs/dbraw/zinc/39/18/59/142391859.db2.gz JCODWMLNCXUIPU-HNNXBMFYSA-N 1 1 349.387 2.259 20 5 EEBDMO CCOC(=O)[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000120512082 142391861 /nfs/dbraw/zinc/39/18/61/142391861.db2.gz JCODWMLNCXUIPU-HNNXBMFYSA-N 1 1 349.387 2.259 20 5 EEBDMO C[N@H+]1CCC[C@H](CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC000087136927 292206106 /nfs/dbraw/zinc/20/61/06/292206106.db2.gz AMBHQOHVZYPBAB-CYBMUJFWSA-N 1 1 332.404 2.004 20 5 EEBDMO COC(=O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000249149498 160375852 /nfs/dbraw/zinc/37/58/52/160375852.db2.gz XKPKQKNQYDGRSU-CHWSQXEVSA-N 1 1 349.387 2.054 20 5 EEBDMO CC[C@]1(C)CC[N@@H+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000343667425 161156751 /nfs/dbraw/zinc/15/67/51/161156751.db2.gz HNBXIWYEWSCCNE-RHSMWYFYSA-N 1 1 331.372 2.349 20 5 EEBDMO CC[C@]1(C)CC[N@H+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000343667425 161156752 /nfs/dbraw/zinc/15/67/52/161156752.db2.gz HNBXIWYEWSCCNE-RHSMWYFYSA-N 1 1 331.372 2.349 20 5 EEBDMO C[C@@H]1C[C@@H](CO)CC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000344147748 161202507 /nfs/dbraw/zinc/20/25/07/161202507.db2.gz QNPUWUKTTQHXHC-NEPJUHHUSA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@@H]1C[C@@H](CO)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000344147748 161202508 /nfs/dbraw/zinc/20/25/08/161202508.db2.gz QNPUWUKTTQHXHC-NEPJUHHUSA-N 1 1 332.360 2.238 20 5 EEBDMO C[N@@H+](CC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])[C@H]1CCSC1 ZINC000345815273 161334534 /nfs/dbraw/zinc/33/45/34/161334534.db2.gz XCRPHDIPGNCYCP-LBPRGKRZSA-N 1 1 337.445 2.383 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1CNS(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000352502157 162161297 /nfs/dbraw/zinc/16/12/97/162161297.db2.gz ZNMMHEDQKJTKRT-AWEZNQCLSA-N 1 1 341.433 2.056 20 5 EEBDMO CCn1cc(C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CCO)cn1 ZINC000355494518 163209955 /nfs/dbraw/zinc/20/99/55/163209955.db2.gz KRLATPNVTIOHDN-ALCCZGGFSA-N 1 1 330.388 2.319 20 5 EEBDMO CCn1cc(C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CCO)cn1 ZINC000355494518 163209957 /nfs/dbraw/zinc/20/99/57/163209957.db2.gz KRLATPNVTIOHDN-ALCCZGGFSA-N 1 1 330.388 2.319 20 5 EEBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@H]2CCSC2)cc1[N+](=O)[O-] ZINC000355607238 163247978 /nfs/dbraw/zinc/24/79/78/163247978.db2.gz NIBCLWPCENZENL-LBPRGKRZSA-N 1 1 340.401 2.084 20 5 EEBDMO C[C@H]1C[C@@H](C(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)CC[N@H+]1C ZINC000359608185 164135877 /nfs/dbraw/zinc/13/58/77/164135877.db2.gz DOOVVNRSVFKPFO-STQMWFEESA-N 1 1 333.388 2.046 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](Cc2cnn(C)c2)C1 ZINC000370004589 166374751 /nfs/dbraw/zinc/37/47/51/166374751.db2.gz CMVPFFYMYVAZIR-CYBMUJFWSA-N 1 1 330.388 2.402 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000374408876 167036760 /nfs/dbraw/zinc/03/67/60/167036760.db2.gz AOKUKNPSVSFHHU-ZIAGYGMSSA-N 1 1 333.388 2.200 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC[S@@](=O)C1 ZINC000375934378 167229434 /nfs/dbraw/zinc/22/94/34/167229434.db2.gz VOHFBQYNHHKNII-MCMMXHMISA-N 1 1 326.418 2.064 20 5 EEBDMO C[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC[S@@](=O)C1 ZINC000375934378 167229431 /nfs/dbraw/zinc/22/94/31/167229431.db2.gz VOHFBQYNHHKNII-MCMMXHMISA-N 1 1 326.418 2.064 20 5 EEBDMO O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC[NH+](C2CCCCC2)CC1 ZINC000272699053 269010542 /nfs/dbraw/zinc/01/05/42/269010542.db2.gz STXLNAHWNYRQPY-UHFFFAOYSA-N 1 1 333.388 2.391 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-] ZINC000277438792 269156325 /nfs/dbraw/zinc/15/63/25/269156325.db2.gz FDTQNTNDPVRTPH-GFCCVEGCSA-N 1 1 335.408 2.188 20 5 EEBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000278251900 269219207 /nfs/dbraw/zinc/21/92/07/269219207.db2.gz CAWIXVVOYPHFLY-CYBMUJFWSA-N 1 1 348.403 2.312 20 5 EEBDMO Cn1ccnc1[C@@H](O)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000283319770 269542279 /nfs/dbraw/zinc/54/22/79/269542279.db2.gz ZOTRAWPMZNDJJJ-INIZCTEOSA-N 1 1 348.378 2.413 20 5 EEBDMO CCOCC[NH+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000112080356 273699395 /nfs/dbraw/zinc/69/93/95/273699395.db2.gz UEQPOIXSXDITTB-UHFFFAOYSA-N 1 1 330.388 2.302 20 5 EEBDMO COC(=O)CCC[NH+]1CCC(NCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000271841893 274157993 /nfs/dbraw/zinc/15/79/93/274157993.db2.gz TXSZQMCBMLRTRI-UHFFFAOYSA-N 1 1 335.404 2.102 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(C(=O)C(F)(F)c3ccc([N+](=O)[O-])cc3)[C@H]2C1 ZINC000272600409 274177051 /nfs/dbraw/zinc/17/70/51/274177051.db2.gz YLTXODAJMGBIEP-FZMZJTMJSA-N 1 1 339.342 2.239 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](O)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000275423962 274246851 /nfs/dbraw/zinc/24/68/51/274246851.db2.gz HZKXEBGIUYKNEO-HNNXBMFYSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](O)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000275429824 274248144 /nfs/dbraw/zinc/24/81/44/274248144.db2.gz IXIRRXITFGPGMR-SWLSCSKDSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](O)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000275429824 274248148 /nfs/dbraw/zinc/24/81/48/274248148.db2.gz IXIRRXITFGPGMR-SWLSCSKDSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](O)C(C)(C)C1 ZINC000275498356 274254016 /nfs/dbraw/zinc/25/40/16/274254016.db2.gz QPBJNMALHLLQSZ-HNNXBMFYSA-N 1 1 335.404 2.325 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000277565746 274310859 /nfs/dbraw/zinc/31/08/59/274310859.db2.gz KPVZSGPSIOYHMC-CYBMUJFWSA-N 1 1 333.344 2.229 20 5 EEBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 ZINC000278477384 274362248 /nfs/dbraw/zinc/36/22/48/274362248.db2.gz ZZLJFRMPQAQEGO-UHFFFAOYSA-N 1 1 330.344 2.310 20 5 EEBDMO O=[N+]([O-])c1cnc(N[C@H]2CCn3cc[nH+]c3C2)c(Br)c1 ZINC000489883091 275041650 /nfs/dbraw/zinc/04/16/50/275041650.db2.gz HZWIMCZDDVDEGC-QMMMGPOBSA-N 1 1 338.165 2.376 20 5 EEBDMO CCn1c(C)nc([N+](=O)[O-])c1Nc1ccc(N2CCOCC2)[nH+]c1C ZINC000288861223 275088818 /nfs/dbraw/zinc/08/88/18/275088818.db2.gz KZBCTOPYZUSUKB-UHFFFAOYSA-N 1 1 346.391 2.403 20 5 EEBDMO CC(C)C[C@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000173013965 279148518 /nfs/dbraw/zinc/14/85/18/279148518.db2.gz OIYOZLMGFWDODX-QGZVFWFLSA-N 1 1 349.431 2.000 20 5 EEBDMO CN1CCC[C@]2(CC[N@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)C1 ZINC000293074120 293118733 /nfs/dbraw/zinc/11/87/33/293118733.db2.gz VROKCBWAJQNYBF-SFHVURJKSA-N 1 1 346.431 2.341 20 5 EEBDMO CN1CCC[C@]2(CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)C1 ZINC000293074120 293118735 /nfs/dbraw/zinc/11/87/35/293118735.db2.gz VROKCBWAJQNYBF-SFHVURJKSA-N 1 1 346.431 2.341 20 5 EEBDMO C[N@@H+]1CCC[C@]2(CCN(CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)C1 ZINC000293074120 293118737 /nfs/dbraw/zinc/11/87/37/293118737.db2.gz VROKCBWAJQNYBF-SFHVURJKSA-N 1 1 346.431 2.341 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)C1 ZINC000293074120 293118740 /nfs/dbraw/zinc/11/87/40/293118740.db2.gz VROKCBWAJQNYBF-SFHVURJKSA-N 1 1 346.431 2.341 20 5 EEBDMO O=C(C[N@H+]1CCC[C@H](O)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000293285399 293170971 /nfs/dbraw/zinc/17/09/71/293170971.db2.gz VOZAHAAEGUPNJO-NSHDSACASA-N 1 1 327.768 2.034 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@H](O)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000293285399 293170972 /nfs/dbraw/zinc/17/09/72/293170972.db2.gz VOZAHAAEGUPNJO-NSHDSACASA-N 1 1 327.768 2.034 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+](Cc1ccccc1)[C@@H](CO)C1CC1 ZINC000339155258 303019147 /nfs/dbraw/zinc/01/91/47/303019147.db2.gz QSZXTMIZGFDUAS-INIZCTEOSA-N 1 1 330.388 2.101 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+](Cc1ccccc1)[C@@H](CO)C1CC1 ZINC000339155258 303019150 /nfs/dbraw/zinc/01/91/50/303019150.db2.gz QSZXTMIZGFDUAS-INIZCTEOSA-N 1 1 330.388 2.101 20 5 EEBDMO CC[C@@H]1C[NH+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H](CC)O1 ZINC000420956030 314009293 /nfs/dbraw/zinc/00/92/93/314009293.db2.gz MMGOOVXPICXNTO-RRFJBIMHSA-N 1 1 338.404 2.224 20 5 EEBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000421705167 314145544 /nfs/dbraw/zinc/14/55/44/314145544.db2.gz QRIJQDAJMJSMJP-ZDUSSCGKSA-N 1 1 325.796 2.343 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCCC[N@H+]1CCC[C@H]1CO ZINC000421781635 314162928 /nfs/dbraw/zinc/16/29/28/314162928.db2.gz AZMPGRRUBYYKLS-HNNXBMFYSA-N 1 1 349.431 2.178 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@H](CC[NH3+])C2)cccc1[N+](=O)[O-] ZINC000443056941 315226288 /nfs/dbraw/zinc/22/62/88/315226288.db2.gz DULRFSJRENJZSP-UONOGXRCSA-N 1 1 334.420 2.291 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)N2CCC[C@H](CC[NH3+])C2)cccc1[N+](=O)[O-] ZINC000443056943 315226669 /nfs/dbraw/zinc/22/66/69/315226669.db2.gz DULRFSJRENJZSP-ZIAGYGMSSA-N 1 1 334.420 2.291 20 5 EEBDMO C[N@H+](CCCNC(=O)C1CCC1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444695390 315317384 /nfs/dbraw/zinc/31/73/84/315317384.db2.gz RWTMRZZXAFDYDI-UHFFFAOYSA-N 1 1 345.403 2.209 20 5 EEBDMO C[N@@H+](CCCNC(=O)C1CCC1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444695390 315317387 /nfs/dbraw/zinc/31/73/87/315317387.db2.gz RWTMRZZXAFDYDI-UHFFFAOYSA-N 1 1 345.403 2.209 20 5 EEBDMO CNC(=O)OC[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000495837537 316134044 /nfs/dbraw/zinc/13/40/44/316134044.db2.gz PLCCPRNWPOFXQQ-CYBMUJFWSA-N 1 1 337.376 2.314 20 5 EEBDMO CNC(=O)OC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000495837537 316134046 /nfs/dbraw/zinc/13/40/46/316134046.db2.gz PLCCPRNWPOFXQQ-CYBMUJFWSA-N 1 1 337.376 2.314 20 5 EEBDMO Cc1cc([NH+]2CCCC2)ccc1NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000562998068 318955727 /nfs/dbraw/zinc/95/57/27/318955727.db2.gz YUYRUCKOHUIESF-INIZCTEOSA-N 1 1 345.403 2.173 20 5 EEBDMO COc1ccc(OCCN2[C@@H]3CC[C@H]2CC[N@H+](C)C3)c([N+](=O)[O-])c1 ZINC000564096343 319067277 /nfs/dbraw/zinc/06/72/77/319067277.db2.gz JPFXVMWCRXBJMS-UONOGXRCSA-N 1 1 335.404 2.151 20 5 EEBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@H]1c1ccccc1Cl ZINC000567671897 319403302 /nfs/dbraw/zinc/40/33/02/319403302.db2.gz RVISUSMLOVQLGN-HNNXBMFYSA-N 1 1 348.790 2.373 20 5 EEBDMO CN1C[C@H]([N@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCC1=O ZINC000577572748 320262543 /nfs/dbraw/zinc/26/25/43/320262543.db2.gz LGUXVCHKOGYTOH-OAHLLOKOSA-N 1 1 344.371 2.302 20 5 EEBDMO CN1C[C@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCC1=O ZINC000577572748 320262544 /nfs/dbraw/zinc/26/25/44/320262544.db2.gz LGUXVCHKOGYTOH-OAHLLOKOSA-N 1 1 344.371 2.302 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(c3nc4ccc([N+](=O)[O-])cc4c(=O)[nH]3)C2)C1 ZINC000292826417 464355491 /nfs/dbraw/zinc/35/54/91/464355491.db2.gz PHQHCVAINFUKNX-KRWDZBQOSA-N 1 1 343.387 2.166 20 5 EEBDMO Cc1cc(Cl)c(C(=O)NCC[N@@H+]2CCCOCC2)cc1[N+](=O)[O-] ZINC000295960808 465035148 /nfs/dbraw/zinc/03/51/48/465035148.db2.gz MRWRLOVBRMPSEX-UHFFFAOYSA-N 1 1 341.795 2.009 20 5 EEBDMO Cc1cc(Cl)c(C(=O)NCC[N@H+]2CCCOCC2)cc1[N+](=O)[O-] ZINC000295960808 465035152 /nfs/dbraw/zinc/03/51/52/465035152.db2.gz MRWRLOVBRMPSEX-UHFFFAOYSA-N 1 1 341.795 2.009 20 5 EEBDMO C[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC000354580413 465035915 /nfs/dbraw/zinc/03/59/15/465035915.db2.gz TXZVMQQHZVXGEC-KGLIPLIRSA-N 1 1 327.388 2.484 20 5 EEBDMO O=C(c1cc([O-])ccc1[N+](=O)[O-])N1CCC[N@@H+](CC2CCC2)CC1 ZINC000351028436 465057254 /nfs/dbraw/zinc/05/72/54/465057254.db2.gz QYUQUAWYLMPVNQ-UHFFFAOYSA-N 1 1 333.388 2.248 20 5 EEBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCc1ccc3c(c1)OCCO3)CC2 ZINC000347794160 465231844 /nfs/dbraw/zinc/23/18/44/465231844.db2.gz YVTSEDCDZYOTPD-UHFFFAOYSA-N 1 1 341.367 2.362 20 5 EEBDMO Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(Cl)c(C[NH+](C)C)c1 ZINC000337245033 465265711 /nfs/dbraw/zinc/26/57/11/465265711.db2.gz IRQBWPUHLZQOIZ-UHFFFAOYSA-N 1 1 337.767 2.296 20 5 EEBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000087155571 462592629 /nfs/dbraw/zinc/59/26/29/462592629.db2.gz UVCCEKZMEOPXGW-CYBMUJFWSA-N 1 1 330.388 2.485 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(NCCC[N@@H+]2CCC[C@H]2C(=O)N(C)C)c1 ZINC000088718025 462642148 /nfs/dbraw/zinc/64/21/48/462642148.db2.gz VRPYPIVVEWNGHC-INIZCTEOSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1cc(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c(N)c([N+](=O)[O-])c1 ZINC000075158544 462688701 /nfs/dbraw/zinc/68/87/01/462688701.db2.gz BWXYAKONJKRVLJ-CYBMUJFWSA-N 1 1 334.420 2.432 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOC[C@@H]1C1CC1 ZINC000090008673 462765569 /nfs/dbraw/zinc/76/55/69/462765569.db2.gz GCNHVVFHICEQNU-MRXNPFEDSA-N 1 1 333.388 2.343 20 5 EEBDMO CC(C)N(C(=O)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C(C)C ZINC000118866714 462858911 /nfs/dbraw/zinc/85/89/11/462858911.db2.gz RFMOGXLMGVMAKA-CQSZACIVSA-N 1 1 349.435 2.121 20 5 EEBDMO CC(C)N(C(=O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C(C)C ZINC000118866714 462858917 /nfs/dbraw/zinc/85/89/17/462858917.db2.gz RFMOGXLMGVMAKA-CQSZACIVSA-N 1 1 349.435 2.121 20 5 EEBDMO Cc1noc(C)c1CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000119443188 462901625 /nfs/dbraw/zinc/90/16/25/462901625.db2.gz PHUCRPIIMAUYDJ-CYBMUJFWSA-N 1 1 331.376 2.324 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](C[NH+]2CCOCC2)C1 ZINC000133636843 462954576 /nfs/dbraw/zinc/95/45/76/462954576.db2.gz BSTILPXORPVUPF-CQSZACIVSA-N 1 1 348.403 2.089 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)cc1OC(F)F ZINC000092628226 462967035 /nfs/dbraw/zinc/96/70/35/462967035.db2.gz ZBLPAYQRVRBRSG-VXGBXAGGSA-N 1 1 343.330 2.471 20 5 EEBDMO CCOC(=O)c1ccnc(N2CCC[N@H+](C(C)C)CC2)c1[N+](=O)[O-] ZINC000077963834 463075411 /nfs/dbraw/zinc/07/54/11/463075411.db2.gz TYXVMMXSBNMVMY-UHFFFAOYSA-N 1 1 336.392 2.087 20 5 EEBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@H](C(N)=O)C3)o2)c([N+](=O)[O-])c1 ZINC000157150397 463103820 /nfs/dbraw/zinc/10/38/20/463103820.db2.gz IYPDATNCTNCEPA-NSHDSACASA-N 1 1 345.355 2.171 20 5 EEBDMO CC(C)[NH+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1 ZINC000025136159 463111014 /nfs/dbraw/zinc/11/10/14/463111014.db2.gz VZOMHZRRHFLMSH-UHFFFAOYSA-N 1 1 332.404 2.335 20 5 EEBDMO CC(C)[N@H+]1CCCN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000068777645 463173022 /nfs/dbraw/zinc/17/30/22/463173022.db2.gz XKRZWMRIKYHJIX-UHFFFAOYSA-N 1 1 339.367 2.055 20 5 EEBDMO CNC(=O)c1ccc(NCC[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000053582791 463176984 /nfs/dbraw/zinc/17/69/84/463176984.db2.gz PEVKQZMBXNUZQH-UHFFFAOYSA-N 1 1 342.399 2.498 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)OC[C@@H]1C ZINC000027647589 463199696 /nfs/dbraw/zinc/19/96/96/463199696.db2.gz FNZYAENXCCHDBX-RYUDHWBXSA-N 1 1 337.376 2.041 20 5 EEBDMO CCCNC(=O)C[NH+]1CCC(Nc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000029622429 463265477 /nfs/dbraw/zinc/26/54/77/463265477.db2.gz NEAJFEGFBUTYNN-UHFFFAOYSA-N 1 1 338.383 2.136 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](CO)c1cccc(F)c1 ZINC000359523500 465430600 /nfs/dbraw/zinc/43/06/00/465430600.db2.gz SRVSNIUOSIRKMT-MRXNPFEDSA-N 1 1 347.346 2.304 20 5 EEBDMO Cc1cc[nH+]c(N2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000162693507 463531545 /nfs/dbraw/zinc/53/15/45/463531545.db2.gz BBUGLVPPIIBUBK-UHFFFAOYSA-N 1 1 340.383 2.190 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@H](CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000072672817 463533274 /nfs/dbraw/zinc/53/32/74/463533274.db2.gz MYRYLENNLWMFLE-CYBMUJFWSA-N 1 1 338.364 2.272 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](N2CCCC2=O)C1 ZINC000111294492 463675294 /nfs/dbraw/zinc/67/52/94/463675294.db2.gz MWILQYHXIUFZIW-OAHLLOKOSA-N 1 1 333.388 2.190 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](N2CCCC2=O)C1 ZINC000111294492 463675299 /nfs/dbraw/zinc/67/52/99/463675299.db2.gz MWILQYHXIUFZIW-OAHLLOKOSA-N 1 1 333.388 2.190 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1ccccc1[N+](=O)[O-] ZINC000177791139 463792850 /nfs/dbraw/zinc/79/28/50/463792850.db2.gz YHEUBCHPGJMHCS-KGLIPLIRSA-N 1 1 333.388 2.059 20 5 EEBDMO CC(=O)c1cc(N2CCC(C[NH+]3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000283518733 463913023 /nfs/dbraw/zinc/91/30/23/463913023.db2.gz KBZDEGGOJPCSEY-UHFFFAOYSA-N 1 1 347.415 2.346 20 5 EEBDMO O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000261981382 463916392 /nfs/dbraw/zinc/91/63/92/463916392.db2.gz OCPZLHSHIKMGDN-KRWDZBQOSA-N 1 1 340.383 2.096 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000172021258 463971203 /nfs/dbraw/zinc/97/12/03/463971203.db2.gz BYJBVUBHFQYQCB-CYBMUJFWSA-N 1 1 341.433 2.056 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(c3ccc(Br)cc3[N+](=O)[O-])C[C@H]2C1 ZINC000278799283 463987427 /nfs/dbraw/zinc/98/74/27/463987427.db2.gz QVYOKTYQDKUWLV-AOOOYVTPSA-N 1 1 326.194 2.355 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-] ZINC000269462313 463993039 /nfs/dbraw/zinc/99/30/39/463993039.db2.gz SKKZCSRNCVFHLM-LBPRGKRZSA-N 1 1 337.424 2.292 20 5 EEBDMO O=C(CN1CCC[N@H+](C2CCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000172584897 464110955 /nfs/dbraw/zinc/11/09/55/464110955.db2.gz XUEJWMMFOJXWCC-UHFFFAOYSA-N 1 1 346.431 2.484 20 5 EEBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC[N@@H+](C)CC1 ZINC000263835441 464210236 /nfs/dbraw/zinc/21/02/36/464210236.db2.gz BEPMJTJQUKAQHV-LBPRGKRZSA-N 1 1 331.376 2.343 20 5 EEBDMO CC(C)NC(=O)c1ccc(N2CC[C@@]3(CC[N@@H+](C)C3)C2)c([N+](=O)[O-])c1 ZINC000292417129 464226266 /nfs/dbraw/zinc/22/62/66/464226266.db2.gz WFKBHXPPHBZZPY-GOSISDBHSA-N 1 1 346.431 2.265 20 5 EEBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000270577225 464261011 /nfs/dbraw/zinc/26/10/11/464261011.db2.gz PQETVXCXRCHFGV-DJIMGWMZSA-N 1 1 349.431 2.282 20 5 EEBDMO C[C@H](O)[C@H]1CCCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000264391222 464307861 /nfs/dbraw/zinc/30/78/61/464307861.db2.gz FSEIQWXDBDQDAH-SMDDNHRTSA-N 1 1 332.360 2.380 20 5 EEBDMO C[C@H](O)[C@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000264391222 464307866 /nfs/dbraw/zinc/30/78/66/464307866.db2.gz FSEIQWXDBDQDAH-SMDDNHRTSA-N 1 1 332.360 2.380 20 5 EEBDMO C[N@@H+](CCCNC(=O)c1c(N)cccc1[N+](=O)[O-])Cc1ccccc1 ZINC000180606916 464347948 /nfs/dbraw/zinc/34/79/48/464347948.db2.gz KWWUOESFCZEWQZ-UHFFFAOYSA-N 1 1 342.399 2.429 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272133535 464490901 /nfs/dbraw/zinc/49/09/01/464490901.db2.gz XKTYFPPSRVWKAA-KGLIPLIRSA-N 1 1 339.342 2.430 20 5 EEBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000294522732 464525747 /nfs/dbraw/zinc/52/57/47/464525747.db2.gz IFWWPCBMZVOWTF-CYBMUJFWSA-N 1 1 335.404 2.404 20 5 EEBDMO CC[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)[C@H]1CCNC1=O ZINC000281686696 464548134 /nfs/dbraw/zinc/54/81/34/464548134.db2.gz FQKVUDMLUSJUAR-NSHDSACASA-N 1 1 342.193 2.068 20 5 EEBDMO CC[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)[C@H]1CCNC1=O ZINC000281686696 464548138 /nfs/dbraw/zinc/54/81/38/464548138.db2.gz FQKVUDMLUSJUAR-NSHDSACASA-N 1 1 342.193 2.068 20 5 EEBDMO CC(C)(O)C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000189952053 464569858 /nfs/dbraw/zinc/56/98/58/464569858.db2.gz COVYDCGPBUJTEY-UHFFFAOYSA-N 1 1 341.795 2.422 20 5 EEBDMO CCN1CC[NH+](CCCNc2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000265505635 464583442 /nfs/dbraw/zinc/58/34/42/464583442.db2.gz JDLFFHWVLGUAFM-UHFFFAOYSA-N 1 1 327.816 2.083 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)c1 ZINC000285496259 464584547 /nfs/dbraw/zinc/58/45/47/464584547.db2.gz XEKNZPKIOPAFLZ-WMLDXEAASA-N 1 1 346.387 2.285 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)c1 ZINC000285496259 464584548 /nfs/dbraw/zinc/58/45/48/464584548.db2.gz XEKNZPKIOPAFLZ-WMLDXEAASA-N 1 1 346.387 2.285 20 5 EEBDMO C[C@H]1C[C@H](C)C[NH+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000182168358 464588559 /nfs/dbraw/zinc/58/85/59/464588559.db2.gz AWSARUFFVAWXSA-STQMWFEESA-N 1 1 326.418 2.346 20 5 EEBDMO C[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000182196987 464596734 /nfs/dbraw/zinc/59/67/34/464596734.db2.gz DXVLMHVQDCYNSG-LBPRGKRZSA-N 1 1 335.385 2.114 20 5 EEBDMO Nc1c(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)cccc1[N+](=O)[O-] ZINC000175743645 464613561 /nfs/dbraw/zinc/61/35/61/464613561.db2.gz FTPDSHVAUJZMLD-CQSZACIVSA-N 1 1 344.371 2.337 20 5 EEBDMO CCOc1cc(C[N@H+]2C[C@H](N3CCOCC3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000285630907 464635909 /nfs/dbraw/zinc/63/59/09/464635909.db2.gz CVDNTABRUQYJBQ-GDBMZVCRSA-N 1 1 349.431 2.289 20 5 EEBDMO Cn1ncc(C2CC2)c1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000597014778 468417269 /nfs/dbraw/zinc/41/72/69/468417269.db2.gz RWNRFYWHOONOCA-ZDUSSCGKSA-N 1 1 342.403 2.287 20 5 EEBDMO COCC[C@@H](C)[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000274845721 464757269 /nfs/dbraw/zinc/75/72/69/464757269.db2.gz PUOISIFYZHMOKH-CYBMUJFWSA-N 1 1 347.419 2.408 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000266660036 464781179 /nfs/dbraw/zinc/78/11/79/464781179.db2.gz HVBABIJZQHLTNV-HNNXBMFYSA-N 1 1 346.387 2.332 20 5 EEBDMO Cc1cc(N2CC[N@H+](C[C@H](C)O)C[C@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000248664533 464784119 /nfs/dbraw/zinc/78/41/19/464784119.db2.gz JYTNLKKQPJDIGY-KGLIPLIRSA-N 1 1 344.415 2.343 20 5 EEBDMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000248876288 464813812 /nfs/dbraw/zinc/81/38/12/464813812.db2.gz QUWICSMAZFSXCI-STQMWFEESA-N 1 1 333.388 2.302 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000177042790 464913974 /nfs/dbraw/zinc/91/39/74/464913974.db2.gz INTQHNFRXAIWOM-STQMWFEESA-N 1 1 332.404 2.138 20 5 EEBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC ZINC000286454915 464923507 /nfs/dbraw/zinc/92/35/07/464923507.db2.gz MQSMBDCCWRAERE-AWEZNQCLSA-N 1 1 335.404 2.484 20 5 EEBDMO C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])c2cnccc21 ZINC000286468797 464929568 /nfs/dbraw/zinc/92/95/68/464929568.db2.gz 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EEBDMO COc1ccc(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000299325274 465698704 /nfs/dbraw/zinc/69/87/04/465698704.db2.gz ANEIEEFUTGENRR-ZDUSSCGKSA-N 1 1 335.404 2.454 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](CC(C)C)[NH+]1CCOCC1 ZINC000338005799 465744899 /nfs/dbraw/zinc/74/48/99/465744899.db2.gz OVABMYWISGJUMT-INIZCTEOSA-N 1 1 349.431 2.380 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H]1CCSC1 ZINC000299501953 465777956 /nfs/dbraw/zinc/77/79/56/465777956.db2.gz BRFWTYXZXZTAMG-GFCCVEGCSA-N 1 1 339.417 2.369 20 5 EEBDMO CNc1c(C(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000361125158 465783297 /nfs/dbraw/zinc/78/32/97/465783297.db2.gz VRJSZRYDBODQPS-OLZOCXBDSA-N 1 1 334.420 2.487 20 5 EEBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CC[N@H+](C2CC2)C1 ZINC000338056456 465785727 /nfs/dbraw/zinc/78/57/27/465785727.db2.gz HLRJNPJDXRKSGA-CQSZACIVSA-N 1 1 332.404 2.015 20 5 EEBDMO CNc1c(C(=O)NCCNc2cccc(C)[nH+]2)cccc1[N+](=O)[O-] ZINC000361210941 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ZINC000285613276 464627939 /nfs/dbraw/zinc/62/79/39/464627939.db2.gz WBABZRDXYADWRL-YIONKMFJSA-N 1 1 346.431 2.480 20 5 EEBDMO C[NH+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000285613276 464627944 /nfs/dbraw/zinc/62/79/44/464627944.db2.gz WBABZRDXYADWRL-YIONKMFJSA-N 1 1 346.431 2.480 20 5 EEBDMO C[NH+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000285613276 464627949 /nfs/dbraw/zinc/62/79/49/464627949.db2.gz WBABZRDXYADWRL-YIONKMFJSA-N 1 1 346.431 2.480 20 5 EEBDMO CN1[C@@H]2CC[C@H]1CC([N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000285613276 464627954 /nfs/dbraw/zinc/62/79/54/464627954.db2.gz WBABZRDXYADWRL-YIONKMFJSA-N 1 1 346.431 2.480 20 5 EEBDMO CN1[C@@H]2CC[C@H]1CC([N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000285613276 464627959 /nfs/dbraw/zinc/62/79/59/464627959.db2.gz WBABZRDXYADWRL-YIONKMFJSA-N 1 1 346.431 2.480 20 5 EEBDMO O=[N+]([O-])c1cccnc1N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1CO ZINC000265806737 464693093 /nfs/dbraw/zinc/69/30/93/464693093.db2.gz SAAUZNRCWNWBKA-JKSUJKDBSA-N 1 1 342.399 2.285 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCc2ccsc2C1 ZINC000273219773 464709784 /nfs/dbraw/zinc/70/97/84/464709784.db2.gz UXSXJKYATFKEBF-ZDUSSCGKSA-N 1 1 334.397 2.454 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@@H]2c2ccccc2)c1 ZINC000273870663 464727270 /nfs/dbraw/zinc/72/72/70/464727270.db2.gz QAQJLXZRBXXHCQ-IAGOWNOFSA-N 1 1 330.388 2.379 20 5 EEBDMO C[C@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000176288444 464739563 /nfs/dbraw/zinc/73/95/63/464739563.db2.gz OSYNDPBXHQRDBT-SPSFWMDKSA-N 1 1 336.417 2.222 20 5 EEBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@H]1CCN(CC(F)(F)F)C1=O ZINC000282540611 464857524 /nfs/dbraw/zinc/85/75/24/464857524.db2.gz VZYPEBSNGIYVRV-ZDUSSCGKSA-N 1 1 345.321 2.232 20 5 EEBDMO CC[N@H+]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000286316078 464877843 /nfs/dbraw/zinc/87/78/43/464877843.db2.gz KNIMSXRLMBSTKQ-GFCCVEGCSA-N 1 1 332.404 2.017 20 5 EEBDMO C[C@H]1[C@H]([NH+]2CCOCC2)CCN1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351998376 465465919 /nfs/dbraw/zinc/46/59/19/465465919.db2.gz UZARRQNJSONKCL-MEDUHNTESA-N 1 1 341.358 2.168 20 5 EEBDMO COc1cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccn1 ZINC000339864971 465560561 /nfs/dbraw/zinc/56/05/61/465560561.db2.gz GLVAIGQAZWHDGX-CYBMUJFWSA-N 1 1 329.360 2.080 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccn1 ZINC000339864971 465560567 /nfs/dbraw/zinc/56/05/67/465560567.db2.gz GLVAIGQAZWHDGX-CYBMUJFWSA-N 1 1 329.360 2.080 20 5 EEBDMO COCC[N@@H+](C)CCNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000362348229 465670128 /nfs/dbraw/zinc/67/01/28/465670128.db2.gz GBWULYKBJADEHN-UHFFFAOYSA-N 1 1 348.378 2.786 20 5 EEBDMO Cc1n[nH]c(C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)c1[N+](=O)[O-] ZINC000299446773 465751143 /nfs/dbraw/zinc/75/11/43/465751143.db2.gz NXNJLMAYFBYVPN-GFCCVEGCSA-N 1 1 347.375 2.176 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@H+](C)C[C@H]2C(C)C)c1 ZINC000330676978 465757857 /nfs/dbraw/zinc/75/78/57/465757857.db2.gz JBMDDKMVVKSKCQ-INIZCTEOSA-N 1 1 349.431 2.471 20 5 EEBDMO CC[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2F)CC[N@H+]1C[C@@H](C)O ZINC000330706739 465770416 /nfs/dbraw/zinc/77/04/16/465770416.db2.gz LZHSFYIPEAVQST-OCCSQVGLSA-N 1 1 325.384 2.011 20 5 EEBDMO CNc1c(C(=O)NC[C@H](c2ccco2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000361124859 465783495 /nfs/dbraw/zinc/78/34/95/465783495.db2.gz UNPZUPHTHRBFBZ-CYBMUJFWSA-N 1 1 332.360 2.262 20 5 EEBDMO O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1c[nH+]ccc1-n1cccn1 ZINC000357141536 465806522 /nfs/dbraw/zinc/80/65/22/465806522.db2.gz HWZPSDFWDONJNR-UHFFFAOYSA-N 1 1 341.302 2.496 20 5 EEBDMO C[C@@H]1[C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CCC[N@H+]1C ZINC000345318002 465854068 /nfs/dbraw/zinc/85/40/68/465854068.db2.gz LJSTYAPYKCNZCM-QMTHXVAHSA-N 1 1 344.371 2.061 20 5 EEBDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1(O)CCC1 ZINC000353482015 465918298 /nfs/dbraw/zinc/91/82/98/465918298.db2.gz DZSUWXSDKYEHSO-UHFFFAOYSA-N 1 1 327.768 2.034 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1(O)CCC1 ZINC000353482015 465918300 /nfs/dbraw/zinc/91/83/00/465918300.db2.gz DZSUWXSDKYEHSO-UHFFFAOYSA-N 1 1 327.768 2.034 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCCC[C@H]1CO ZINC000594016859 468461195 /nfs/dbraw/zinc/46/11/95/468461195.db2.gz LUVZALXCTAAUEM-HNNXBMFYSA-N 1 1 335.404 2.469 20 5 EEBDMO CC(C)[N@@H+](C)CCN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000353495560 465930637 /nfs/dbraw/zinc/93/06/37/465930637.db2.gz IPKQGFLLGDHRJR-MRXNPFEDSA-N 1 1 331.420 2.348 20 5 EEBDMO Cn1ccnc1[C@H](NC[C@H]1CCC[N@H+]1C)c1cccc([N+](=O)[O-])c1 ZINC000353498949 465935047 /nfs/dbraw/zinc/93/50/47/465935047.db2.gz SFWXOHVHJUUGHX-HZPDHXFCSA-N 1 1 329.404 2.102 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000346170545 465958110 /nfs/dbraw/zinc/95/81/10/465958110.db2.gz AOILASFMYSFRSW-YNEHKIRRSA-N 1 1 349.435 2.244 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CC[N@@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000346170545 465958120 /nfs/dbraw/zinc/95/81/20/465958120.db2.gz AOILASFMYSFRSW-YNEHKIRRSA-N 1 1 349.435 2.244 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000346170545 465958128 /nfs/dbraw/zinc/95/81/28/465958128.db2.gz AOILASFMYSFRSW-YNEHKIRRSA-N 1 1 349.435 2.244 20 5 EEBDMO CC[C@H](CCO)C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353536022 465961949 /nfs/dbraw/zinc/96/19/49/465961949.db2.gz WZYOQYJLPLRZCG-CZUORRHYSA-N 1 1 332.404 2.416 20 5 EEBDMO CCC[N@@H+](CC)CCNS(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000353555753 465974292 /nfs/dbraw/zinc/97/42/92/465974292.db2.gz WESIZEMXMFAIOB-UHFFFAOYSA-N 1 1 343.449 2.222 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@@H](CNc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000301746605 466022082 /nfs/dbraw/zinc/02/20/82/466022082.db2.gz QADMZXPFYOZOKU-LBPRGKRZSA-N 1 1 328.800 2.412 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)C[C@H]1[C@@H](C)O ZINC000331307002 466023525 /nfs/dbraw/zinc/02/35/25/466023525.db2.gz ZZPHXTSHMJYHDL-GHJWDPDVSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)C[C@H]1[C@@H](C)O ZINC000331307002 466023532 /nfs/dbraw/zinc/02/35/32/466023532.db2.gz ZZPHXTSHMJYHDL-GHJWDPDVSA-N 1 1 335.404 2.323 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]C[C@@H]1CC[C@H](O)C1)c1ccc([N+](=O)[O-])cc1 ZINC000353692623 466073638 /nfs/dbraw/zinc/07/36/38/466073638.db2.gz WDHZABQNLZAJMY-UHOFOFEASA-N 1 1 330.388 2.168 20 5 EEBDMO COC(=O)c1cnc(NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000302660404 466162662 /nfs/dbraw/zinc/16/26/62/466162662.db2.gz AVYFQNQEYVMYDK-RYUDHWBXSA-N 1 1 336.392 2.309 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@]1(C)CO ZINC000597236091 468490678 /nfs/dbraw/zinc/49/06/78/468490678.db2.gz NVVPODRXNDQJNA-ACJLOTCBSA-N 1 1 344.415 2.446 20 5 EEBDMO COc1c(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)cccc1[N+](=O)[O-] ZINC000332229946 466458274 /nfs/dbraw/zinc/45/82/74/466458274.db2.gz PSSYHEOBRIUVQJ-OCCSQVGLSA-N 1 1 333.388 2.160 20 5 EEBDMO C[N@H+]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C(C)(C)C1 ZINC000332300399 466496445 /nfs/dbraw/zinc/49/64/45/466496445.db2.gz VHCRZGIBZLMQDY-UHFFFAOYSA-N 1 1 330.388 2.102 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(n2cccn2)CC1 ZINC000372604142 466501696 /nfs/dbraw/zinc/50/16/96/466501696.db2.gz ICCZPBKYPMQRBM-ZDUSSCGKSA-N 1 1 343.387 2.455 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000347327993 466569205 /nfs/dbraw/zinc/56/92/05/466569205.db2.gz YMFFIINLRANZSS-CQSZACIVSA-N 1 1 333.388 2.350 20 5 EEBDMO COC(=O)C1([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000411385358 466818672 /nfs/dbraw/zinc/81/86/72/466818672.db2.gz OOEDFEQCKXFEMO-UHFFFAOYSA-N 1 1 349.387 2.341 20 5 EEBDMO O=C(C[N@H+]1CC[C@](O)(C2CC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000365839197 466958151 /nfs/dbraw/zinc/95/81/51/466958151.db2.gz QTXAHLLPOYYVDY-OAHLLOKOSA-N 1 1 339.779 2.034 20 5 EEBDMO O=C(C[N@@H+]1CC[C@](O)(C2CC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000365839197 466958154 /nfs/dbraw/zinc/95/81/54/466958154.db2.gz QTXAHLLPOYYVDY-OAHLLOKOSA-N 1 1 339.779 2.034 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H](CO)[C@H]2C)cccc1[N+](=O)[O-] ZINC000412092579 467004407 /nfs/dbraw/zinc/00/44/07/467004407.db2.gz RHELPMPGZHZNOS-ZIAGYGMSSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H](CO)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000412092577 467004912 /nfs/dbraw/zinc/00/49/12/467004912.db2.gz RHELPMPGZHZNOS-UONOGXRCSA-N 1 1 335.404 2.325 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)[C@@H]2C1 ZINC000412242370 467048379 /nfs/dbraw/zinc/04/83/79/467048379.db2.gz DCVORKRDGPLQKB-XLNGHYISSA-N 1 1 329.400 2.251 20 5 EEBDMO CC(C)[C@@H]1CN(C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000425488950 467098607 /nfs/dbraw/zinc/09/86/07/467098607.db2.gz 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COCC(C)(C)[N@@H+](C)Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000430125185 467401485 /nfs/dbraw/zinc/40/14/85/467401485.db2.gz BXDOFZKMFYAZIQ-UHFFFAOYSA-N 1 1 340.376 2.003 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C[C@H]1CCOC1)C1CC1 ZINC000434570812 467409868 /nfs/dbraw/zinc/40/98/68/467409868.db2.gz ANFVMUATHOASPL-CYBMUJFWSA-N 1 1 333.388 2.343 20 5 EEBDMO CN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C)C1 ZINC000449945350 467748781 /nfs/dbraw/zinc/74/87/81/467748781.db2.gz OTOZLNWFSYIAAL-OAHLLOKOSA-N 1 1 333.388 2.110 20 5 EEBDMO C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000487225037 468029254 /nfs/dbraw/zinc/02/92/54/468029254.db2.gz VXMLCWGKIYGDCE-ZWNOBZJWSA-N 1 1 325.796 2.105 20 5 EEBDMO CC(C)[C@H]1CN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000487956549 468062894 /nfs/dbraw/zinc/06/28/94/468062894.db2.gz LTPLRJJNDNSSPB-CZUORRHYSA-N 1 1 334.420 2.194 20 5 EEBDMO CNC(=O)c1ccc(N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c([N+](=O)[O-])c1 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Cc1[nH+]ccn1CCCC(=O)NCCNc1cccc(F)c1[N+](=O)[O-] ZINC001093729535 795635624 /nfs/dbraw/zinc/63/56/24/795635624.db2.gz YJCVAKYWDMRPOR-UHFFFAOYSA-N 1 1 349.366 2.247 20 5 EEBDMO O=C(CCc1cnc[nH]1)NCCCNc1ccc([N+](=O)[O-])cc1F ZINC001094856068 796825210 /nfs/dbraw/zinc/82/52/10/796825210.db2.gz MXWVFOBMQWTAQZ-UHFFFAOYSA-N 1 1 335.339 2.008 20 5 EEBDMO COc1ncnc2c1CC[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173226384 797310434 /nfs/dbraw/zinc/31/04/34/797310434.db2.gz JHHZKYGDFNNSLN-LBPRGKRZSA-N 1 1 328.372 2.383 20 5 EEBDMO COc1ncnc2c1CC[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173226384 797310442 /nfs/dbraw/zinc/31/04/42/797310442.db2.gz JHHZKYGDFNNSLN-LBPRGKRZSA-N 1 1 328.372 2.383 20 5 EEBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(CCC(C)(C)O)CC1 ZINC001173231500 797312532 /nfs/dbraw/zinc/31/25/32/797312532.db2.gz LTQSIWFVMKBSFQ-OAHLLOKOSA-N 1 1 335.448 2.304 20 5 EEBDMO Cc1cc(C(=O)NC2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)on1 ZINC001002329522 797890863 /nfs/dbraw/zinc/89/08/63/797890863.db2.gz PLVCWZLLFWKJTF-UHFFFAOYSA-N 1 1 344.371 2.286 20 5 EEBDMO Cn1ccc(C(=O)NC2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC001002595541 798305953 /nfs/dbraw/zinc/30/59/53/798305953.db2.gz WPWVTGJQDOQVKT-UHFFFAOYSA-N 1 1 342.399 2.328 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NCC1(Nc2ccc([N+](=O)[O-])c(C)n2)CC1 ZINC001110266480 801086484 /nfs/dbraw/zinc/08/64/84/801086484.db2.gz XADPFKPBZZEJQS-UHFFFAOYSA-N 1 1 349.435 2.089 20 5 EEBDMO CC(C)(C)OC(=O)N1C[C@@H]2CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]21 ZINC001169010299 803570686 /nfs/dbraw/zinc/57/06/86/803570686.db2.gz CMPXHEAJXRZUQG-BARDWOONSA-N 1 1 339.436 2.373 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[C@H]2C[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@H]21 ZINC001169012494 803571524 /nfs/dbraw/zinc/57/15/24/803571524.db2.gz QOIZOCFUGXGGTE-ZQDZILKHSA-N 1 1 339.436 2.373 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H]3[C@H]2CCN3Cc2cccnc2)C1 ZINC001169018997 803588071 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O=C(C[NH2+]Cc1csc([N+](=O)[O-])c1)N[C@@H]1CCOc2ccccc21 ZINC000374327446 154053625 /nfs/dbraw/zinc/05/36/25/154053625.db2.gz GNTWKPAWNXJVOB-CYBMUJFWSA-N 1 1 347.396 2.386 20 5 EEBDMO Cc1nccn1CCCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000128783382 292347266 /nfs/dbraw/zinc/34/72/66/292347266.db2.gz YIVHEPITTPPJQU-OAHLLOKOSA-N 1 1 344.419 2.461 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCc1ccccn1 ZINC000129936017 292365182 /nfs/dbraw/zinc/36/51/82/292365182.db2.gz WMSCUXGPJQQZRC-CYBMUJFWSA-N 1 1 328.372 2.491 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1ccccn1 ZINC000129936017 292365185 /nfs/dbraw/zinc/36/51/85/292365185.db2.gz WMSCUXGPJQQZRC-CYBMUJFWSA-N 1 1 328.372 2.491 20 5 EEBDMO CCC[C@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000131323368 292386094 /nfs/dbraw/zinc/38/60/94/292386094.db2.gz UIUJWBMBOGOBOW-AWEZNQCLSA-N 1 1 349.387 2.394 20 5 EEBDMO CCC[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000131323368 292386095 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ZNIICDJSOCJACC-CQSZACIVSA-N 1 1 348.447 2.234 20 5 EEBDMO CCC[C@@]1(CO)CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000444786885 315325049 /nfs/dbraw/zinc/32/50/49/315325049.db2.gz VNWIDRBKPPOLJP-KRWDZBQOSA-N 1 1 335.404 2.469 20 5 EEBDMO CCC[N@@H+](CC)CCNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000445113925 315344849 /nfs/dbraw/zinc/34/48/49/315344849.db2.gz OBSCLVVPKGREAT-UHFFFAOYSA-N 1 1 348.407 2.002 20 5 EEBDMO CC(C)[C@H](C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])N1CCN(C)CC1 ZINC000563417309 319008981 /nfs/dbraw/zinc/00/89/81/319008981.db2.gz LMMSKYNRNNTDIS-MJGOQNOKSA-N 1 1 346.475 2.444 20 5 EEBDMO C[C@H](C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])CN1CCN(C)CC1 ZINC000576172417 320147703 /nfs/dbraw/zinc/14/77/03/320147703.db2.gz LTYZJWRSQNWXLM-RHSMWYFYSA-N 1 1 332.448 2.055 20 5 EEBDMO COc1c(C(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000354591032 465041790 /nfs/dbraw/zinc/04/17/90/465041790.db2.gz BMLBQRIRDATVSB-QWHCGFSZSA-N 1 1 335.404 2.454 20 5 EEBDMO 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O=C1[C@@H]([NH2+]CC[N+](=O)[O-])CCCN1c1ccc(Cl)cc1Cl ZINC000905229839 694565068 /nfs/dbraw/zinc/56/50/68/694565068.db2.gz KLZSPPOCXYTYCA-NSHDSACASA-N 1 1 332.187 2.355 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@H](n3cc(Cl)cn3)C2)cc1 ZINC000810131599 1199286390 /nfs/dbraw/zinc/28/63/90/1199286390.db2.gz MESNSHYDMSVZOQ-GJZGRUSLSA-N 1 1 336.779 2.425 20 5 EEBDMO Cc1[nH+]ccn1C[C@H](C)OC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000810618899 1199617482 /nfs/dbraw/zinc/61/74/82/1199617482.db2.gz JYBARIKKTDDTTN-JTQLQIEISA-N 1 1 347.327 2.116 20 5 EEBDMO Cc1[nH+]ccn1C[C@@H](C)OC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000810615165 1199630062 /nfs/dbraw/zinc/63/00/62/1199630062.db2.gz HTAVLEYAFHGSAL-SNVBAGLBSA-N 1 1 347.327 2.116 20 5 EEBDMO COc1ccc(CC(=O)O[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000810846798 1199776125 /nfs/dbraw/zinc/77/61/25/1199776125.db2.gz KAVAIZFVAYQAEA-UONOGXRCSA-N 1 1 334.372 2.316 20 5 EEBDMO CC(C)CC(=O)N1CCC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 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UKRCYKPDIPQIPN-ZIAGYGMSSA-N 1 1 329.416 2.200 20 5 EEBDMO COC(=O)C1=C(C)O[C@H](C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])C1 ZINC000796112276 1215306835 /nfs/dbraw/zinc/30/68/35/1215306835.db2.gz IXWRQQRTXHZVFV-AWEZNQCLSA-N 1 1 334.372 2.305 20 5 EEBDMO C[N@H+](CC(=O)OCc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1CCSC1 ZINC000803415959 1240322151 /nfs/dbraw/zinc/32/21/51/1240322151.db2.gz SIRAHOXQGFICEK-VIFPVBQESA-N 1 1 346.355 2.354 20 5 EEBDMO C[N@@H+](CC(=O)OCc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1CCSC1 ZINC000803415959 1240322159 /nfs/dbraw/zinc/32/21/59/1240322159.db2.gz SIRAHOXQGFICEK-VIFPVBQESA-N 1 1 346.355 2.354 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)N[C@H]1C[C@H](CNc2ccccc2[N+](=O)[O-])C1 ZINC001068493460 1251161844 /nfs/dbraw/zinc/16/18/44/1251161844.db2.gz QFVPGSGSRYVAJS-HDJSIYSDSA-N 1 1 343.387 2.107 20 5 EEBDMO C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CC[N@@H+]1C ZINC000815700394 1278184323 /nfs/dbraw/zinc/18/43/23/1278184323.db2.gz GZPXYLCWDFTLQF-VIFPVBQESA-N 1 1 331.294 2.390 20 5 EEBDMO 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333.432 2.178 20 5 EEBDMO CCN1CCO[C@@H]2C[N@H+]([C@H](C)Cc3ccccc3[N+](=O)[O-])C[C@@H]2C1 ZINC001254557301 1318120515 /nfs/dbraw/zinc/12/05/15/1318120515.db2.gz PGSZQAZJABSYRC-UWWQBHOKSA-N 1 1 333.432 2.178 20 5 EEBDMO COC[C@@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2cn(C)nc21 ZINC001254594319 1318136544 /nfs/dbraw/zinc/13/65/44/1318136544.db2.gz DKYTVRNEGUYUNP-RDJZCZTQSA-N 1 1 342.399 2.041 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCC[C@H](Oc3cnccn3)C1)C2 ZINC001254610142 1318143664 /nfs/dbraw/zinc/14/36/64/1318143664.db2.gz IMINULFOWBGNBM-IRXDYDNUSA-N 1 1 340.383 2.395 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CCC[C@](C)(O)C3)CC2)ccc1[N+](=O)[O-] ZINC001256098491 1318647027 /nfs/dbraw/zinc/64/70/27/1318647027.db2.gz BBGIKVHTOFFBJD-SFHVURJKSA-N 1 1 349.431 2.419 20 5 EEBDMO O=[N+]([O-])c1cnc(NCC2([NH+]3CCCC3)COC2)c2ccccc21 ZINC001157655305 1318774291 /nfs/dbraw/zinc/77/42/91/1318774291.db2.gz NWQKQMLYEXSIKK-UHFFFAOYSA-N 1 1 328.372 2.420 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)n1 ZINC001160475823 1320172596 /nfs/dbraw/zinc/17/25/96/1320172596.db2.gz JUTUGIUAIAISGF-CNDDSTCGSA-N 1 1 334.376 2.204 20 5 EEBDMO CCOC(=O)c1ccnc(NCc2[nH+]cn3ccccc23)c1[N+](=O)[O-] ZINC001161686996 1320587410 /nfs/dbraw/zinc/58/74/10/1320587410.db2.gz LOIMHBUMTJOKJT-UHFFFAOYSA-N 1 1 341.327 2.426 20 5 EEBDMO COC(=O)c1cnc(N[C@@H]2CC[N@H+](C(C)C)C[C@H]2C)c([N+](=O)[O-])c1 ZINC001163362400 1321105674 /nfs/dbraw/zinc/10/56/74/1321105674.db2.gz NDOFXTCUSYPTIP-DGCLKSJQSA-N 1 1 336.392 2.307 20 5 EEBDMO C[NH+](C)/C=C/c1cc(NCc2cc3n(n2)CCCO3)ncc1[N+](=O)[O-] ZINC001163406308 1321117383 /nfs/dbraw/zinc/11/73/83/1321117383.db2.gz RHTGRLNITRMPBZ-GQCTYLIASA-N 1 1 344.375 2.113 20 5 EEBDMO Cc1ncc([N+](=O)[O-])c(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)n1 ZINC001165090000 1321452361 /nfs/dbraw/zinc/45/23/61/1321452361.db2.gz WXRXRSULMGBFHT-DOTOQJQBSA-N 1 1 339.399 2.404 20 5 EEBDMO C[N@@H+](C1CN(c2ccc3cccc([N+](=O)[O-])c3n2)C1)[C@@H]1CCOC1 ZINC001165205148 1321471632 /nfs/dbraw/zinc/47/16/32/1321471632.db2.gz CQANCRNDKUHKAN-CYBMUJFWSA-N 1 1 328.372 2.052 20 5 EEBDMO Cc1nccnc1[C@H](C)[NH2+][C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC001308054408 1331561989 /nfs/dbraw/zinc/56/19/89/1331561989.db2.gz IDNXVLGEABDZTN-WFASDCNBSA-N 1 1 341.371 2.149 20 5 EEBDMO Cc1nn(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c2ncc([N+](=O)[O-])cc12 ZINC001319328697 1332685529 /nfs/dbraw/zinc/68/55/29/1332685529.db2.gz PRJXNXMNAHNIFU-WFASDCNBSA-N 1 1 331.376 2.106 20 5 EEBDMO O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCC[NH+]1CC=CC1 ZINC001325263333 1333855038 /nfs/dbraw/zinc/85/50/38/1333855038.db2.gz VSWABGPVKOCXKD-UHFFFAOYSA-N 1 1 341.820 2.328 20 5 EEBDMO CC[N@H+]1CCC[C@@H](CNc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C1 ZINC001327617067 1334323336 /nfs/dbraw/zinc/32/33/36/1334323336.db2.gz QEGVEYOTZOZJQY-NSHDSACASA-N 1 1 331.376 2.387 20 5 EEBDMO C[C@H]1CC[N@@H+](CCNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001333877648 1336159713 /nfs/dbraw/zinc/15/97/13/1336159713.db2.gz YVGUDJCRFGOKFH-ZDUSSCGKSA-N 1 1 332.404 2.004 20 5 EEBDMO O=C(OCC[NH+]1CCSCC1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001344726225 1337411691 /nfs/dbraw/zinc/41/16/91/1337411691.db2.gz QMQUHNYAWLWDTO-GJZGRUSLSA-N 1 1 336.413 2.290 20 5 EEBDMO C[C@]([NH3+])(C(=O)Nc1nc(C2(C)CC2)ns1)c1cccc([N+](=O)[O-])c1 ZINC001576553389 1344030740 /nfs/dbraw/zinc/03/07/40/1344030740.db2.gz LAFFHMMQEOKZJY-OAHLLOKOSA-N 1 1 347.400 2.310 20 5 EEBDMO C[C@@H](CNc1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1C ZINC001590260623 1349235232 /nfs/dbraw/zinc/23/52/32/1349235232.db2.gz QLFBESVWZYTUIT-RYUDHWBXSA-N 1 1 345.407 2.450 20 5 EEBDMO Cc1ncc([C@H](C)[NH2+]Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])s1 ZINC001592408553 1349628485 /nfs/dbraw/zinc/62/84/85/1349628485.db2.gz HOPCJJBJWQNMFX-QMMMGPOBSA-N 1 1 345.388 2.391 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc1-c1nn[nH]n1 ZINC001593478019 1349810903 /nfs/dbraw/zinc/81/09/03/1349810903.db2.gz OUMCJHSTBYVYPP-DZGCQCFKSA-N 1 1 343.391 2.204 20 5 EEBDMO C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)C1 ZINC000839537329 1372908864 /nfs/dbraw/zinc/90/88/64/1372908864.db2.gz WSJDFASQMANPAF-DTTOXWODSA-N 1 1 345.443 2.446 20 5 EEBDMO CC(C)Cc1cc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)n(C)n1 ZINC001575648469 1403554503 /nfs/dbraw/zinc/55/45/03/1403554503.db2.gz MAXKERHBARFZJC-KRWDZBQOSA-N 1 1 345.403 2.339 20 5 EEBDMO O=[N+]([O-])c1cc(F)cnc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164781059 721398461 /nfs/dbraw/zinc/39/84/61/721398461.db2.gz AQEHAHAFHYRRPL-QWRGUYRKSA-N 1 1 349.391 2.154 20 5 EEBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000893877382 780267711 /nfs/dbraw/zinc/26/77/11/780267711.db2.gz VZDHBLJZGHRMKO-CVEARBPZSA-N 1 1 332.404 2.015 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)N(C)CCCN(C)c1ccccc1[N+](=O)[O-] ZINC001112145127 781310001 /nfs/dbraw/zinc/31/00/01/781310001.db2.gz QPYFGRRELJHANS-UHFFFAOYSA-N 1 1 345.403 2.085 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC000906790828 784160953 /nfs/dbraw/zinc/16/09/53/784160953.db2.gz JHTKHGIDBHYTMM-SKDRFNHKSA-N 1 1 340.811 2.243 20 5 EEBDMO C[N@@H+](CC(=O)NC[C@H]1C[C@H](Nc2ccccc2[N+](=O)[O-])C1)C1CCC1 ZINC001091520607 791060617 /nfs/dbraw/zinc/06/06/17/791060617.db2.gz PNZOSACTYJXFDB-HDJSIYSDSA-N 1 1 346.431 2.386 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NC/C=C\CNc1ccccc1[N+](=O)[O-] ZINC001107391524 787105768 /nfs/dbraw/zinc/10/57/68/787105768.db2.gz JXWJCYUOGKNQOF-HJWRWDBZSA-N 1 1 334.420 2.409 20 5 EEBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000923312019 789371656 /nfs/dbraw/zinc/37/16/56/789371656.db2.gz GITVLXPPKKKQOV-LSDHHAIUSA-N 1 1 344.415 2.478 20 5 EEBDMO C[N@@H+]1CCN(C(=O)CCC(C)(C)[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000844922291 789462719 /nfs/dbraw/zinc/46/27/19/789462719.db2.gz ANGOGBYXLCOOGL-MRXNPFEDSA-N 1 1 333.432 2.207 20 5 EEBDMO C[N@H+]1CCN(C(=O)CCC(C)(C)[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000844922291 789462725 /nfs/dbraw/zinc/46/27/25/789462725.db2.gz ANGOGBYXLCOOGL-MRXNPFEDSA-N 1 1 333.432 2.207 20 5 EEBDMO O=[N+]([O-])c1cccc2c1ccnc2NCC1([NH+]2CCCC2)COC1 ZINC001168442729 794249701 /nfs/dbraw/zinc/24/97/01/794249701.db2.gz PZQWSHMDQBUZQT-UHFFFAOYSA-N 1 1 328.372 2.420 20 5 EEBDMO COC[C@]12COC[C@H]1C[N@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172908133 797133244 /nfs/dbraw/zinc/13/32/44/797133244.db2.gz BBMVICGUCWVMMF-ZIFCJYIRSA-N 1 1 346.427 2.437 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N1CCC(Nc2ccc([N+](=O)[O-])c(C)n2)CC1 ZINC001095235434 797568795 /nfs/dbraw/zinc/56/87/95/797568795.db2.gz AKJGSGKFOFGBPG-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO CC(C)OCc1ncn2c1C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)CCC2 ZINC001169027413 803575191 /nfs/dbraw/zinc/57/51/91/803575191.db2.gz PIPJDLATMIMXTN-LSDHHAIUSA-N 1 1 336.436 2.459 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@]3(C2)CCCN(c2ncccn2)C3)C1 ZINC001169019348 803587510 /nfs/dbraw/zinc/58/75/10/803587510.db2.gz HXUIYMWGAKSEHL-RYRKJORJSA-N 1 1 345.447 2.214 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C[N@H+]1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169052481 803595791 /nfs/dbraw/zinc/59/57/91/803595791.db2.gz GFEYOFBYELCRDX-YIYPIFLZSA-N 1 1 327.425 2.419 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)N(C)CCCNc1ccc(C)cc1[N+](=O)[O-] ZINC001109455890 805495533 /nfs/dbraw/zinc/49/55/33/805495533.db2.gz VOYGVQSYIKQULD-UHFFFAOYSA-N 1 1 345.403 2.369 20 5 EEBDMO COC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CCOCC1 ZINC000790080988 808374731 /nfs/dbraw/zinc/37/47/31/808374731.db2.gz UAGXMWYLTQQMPK-UHFFFAOYSA-N 1 1 340.351 2.278 20 5 EEBDMO COC(=O)[C@]1(C)CC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170355730 809903083 /nfs/dbraw/zinc/90/30/83/809903083.db2.gz QNPVAHZVPPPQJF-YVEFUNNKSA-N 1 1 336.388 2.419 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H](n3cncn3)C2)c([N+](=O)[O-])c1 ZINC001170344412 809916203 /nfs/dbraw/zinc/91/62/03/809916203.db2.gz BUZABINFALJLBQ-UKRRQHHQSA-N 1 1 345.403 2.463 20 5 EEBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CC1(O)CCCC1 ZINC000181773592 529871366 /nfs/dbraw/zinc/87/13/66/529871366.db2.gz XIENYRJHVSSYIV-UHFFFAOYSA-N 1 1 339.367 2.299 20 5 EEBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000229605207 242184049 /nfs/dbraw/zinc/18/40/49/242184049.db2.gz DWEPEBQBGSTRRR-GJZGRUSLSA-N 1 1 332.404 2.140 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCC[C@@H]1C[C@H](C)O ZINC000447839136 242323645 /nfs/dbraw/zinc/32/36/45/242323645.db2.gz HRQLQWKCEHCXQR-UONOGXRCSA-N 1 1 335.404 2.467 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCCC[C@@H]1C[C@H](C)O ZINC000447839136 242323649 /nfs/dbraw/zinc/32/36/49/242323649.db2.gz HRQLQWKCEHCXQR-UONOGXRCSA-N 1 1 335.404 2.467 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCn1cccn1 ZINC000111280589 220132955 /nfs/dbraw/zinc/13/29/55/220132955.db2.gz WMTQMMRLXWMMPB-UHFFFAOYSA-N 1 1 331.376 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UKIKQPHRFDDMFD-GFCCVEGCSA-N 1 1 337.376 2.197 20 5 EEBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc(N)c([N+](=O)[O-])n2)cc1F ZINC000590574963 468277312 /nfs/dbraw/zinc/27/73/12/468277312.db2.gz QNAAOANEGXFNPL-UHFFFAOYSA-N 1 1 342.334 2.817 20 5 EEBDMO COc1cc(C[NH+]2CCC(CO)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000046091523 462647680 /nfs/dbraw/zinc/64/76/80/462647680.db2.gz WWWQEDAVZBWZSG-UHFFFAOYSA-N 1 1 346.330 2.409 20 5 EEBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000115273193 462704188 /nfs/dbraw/zinc/70/41/88/462704188.db2.gz CFFHNZZNWHDDGB-RHSMWYFYSA-N 1 1 349.431 2.462 20 5 EEBDMO O=[N+]([O-])c1ccc(NCC[NH+]2CCN(c3ccc(F)cc3)CC2)cn1 ZINC000075669685 462748306 /nfs/dbraw/zinc/74/83/06/462748306.db2.gz GLMPERBQTYRVKT-UHFFFAOYSA-N 1 1 345.378 2.363 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000066125542 462853874 /nfs/dbraw/zinc/85/38/74/462853874.db2.gz CMXBCGBYMXAEEE-ZDUSSCGKSA-N 1 1 345.403 2.241 20 5 EEBDMO CS(=O)(=O)c1ccc(NC2CC[NH+](C3CC3)CC2)c([N+](=O)[O-])c1 ZINC000014327091 462924456 /nfs/dbraw/zinc/92/44/56/462924456.db2.gz DIOIRXNNJXPJNU-UHFFFAOYSA-N 1 1 339.417 2.037 20 5 EEBDMO C[C@@H]1C[N@H+](CCCNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000067998378 463078647 /nfs/dbraw/zinc/07/86/47/463078647.db2.gz DGJVNPSTBBYJJL-QHLGLPELSA-N 1 1 347.415 2.224 20 5 EEBDMO CC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])ccc1SCCOC ZINC000157380046 463126133 /nfs/dbraw/zinc/12/61/33/463126133.db2.gz NANDMMMAWAIABL-UHFFFAOYSA-N 1 1 341.433 2.015 20 5 EEBDMO Cc1cc(N[C@H](C)CN2CC[NH+](C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000095988681 463130087 /nfs/dbraw/zinc/13/00/87/463130087.db2.gz ZGYVUVAURORTSN-CQSZACIVSA-N 1 1 343.431 2.499 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCO)Cc1ccccc1 ZINC000078648111 463137662 /nfs/dbraw/zinc/13/76/62/463137662.db2.gz DPQTZZWSJPYILZ-UHFFFAOYSA-N 1 1 343.383 2.336 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCO)Cc1ccccc1 ZINC000078648111 463137667 /nfs/dbraw/zinc/13/76/67/463137667.db2.gz DPQTZZWSJPYILZ-UHFFFAOYSA-N 1 1 343.383 2.336 20 5 EEBDMO COCC[N@@H+]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C[C@@H]1C ZINC000135462568 463159730 /nfs/dbraw/zinc/15/97/30/463159730.db2.gz ACAWFZYCUUTTIG-NSHDSACASA-N 1 1 341.795 2.041 20 5 EEBDMO COCC[N@H+]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C[C@@H]1C ZINC000135462568 463159735 /nfs/dbraw/zinc/15/97/35/463159735.db2.gz ACAWFZYCUUTTIG-NSHDSACASA-N 1 1 341.795 2.041 20 5 EEBDMO C[N@H+](CCOc1ccc(F)cc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027373285 463190089 /nfs/dbraw/zinc/19/00/89/463190089.db2.gz SYVPECPOMGQDDK-UHFFFAOYSA-N 1 1 347.346 2.344 20 5 EEBDMO C[N@@H+](CCOc1ccc(F)cc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027373285 463190090 /nfs/dbraw/zinc/19/00/90/463190090.db2.gz SYVPECPOMGQDDK-UHFFFAOYSA-N 1 1 347.346 2.344 20 5 EEBDMO COc1ccc(CC(=O)N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-] ZINC000553117400 468350061 /nfs/dbraw/zinc/35/00/61/468350061.db2.gz CCDVGQIYCUXBPB-YIONKMFJSA-N 1 1 347.415 2.230 20 5 EEBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](CN3CCOCC3)C2)c1 ZINC000069803473 463327706 /nfs/dbraw/zinc/32/77/06/463327706.db2.gz UMXOTARKKICIKQ-INIZCTEOSA-N 1 1 349.431 2.018 20 5 EEBDMO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(=O)NC1CC1 ZINC000104663145 463417532 /nfs/dbraw/zinc/41/75/32/463417532.db2.gz DEWVCNHAISAYPG-UHFFFAOYSA-N 1 1 344.371 2.003 20 5 EEBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(=O)NC1CC1 ZINC000104663145 463417535 /nfs/dbraw/zinc/41/75/35/463417535.db2.gz DEWVCNHAISAYPG-UHFFFAOYSA-N 1 1 344.371 2.003 20 5 EEBDMO C[C@@H]1CCC[C@@H](CO)[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000162381359 463505207 /nfs/dbraw/zinc/50/52/07/463505207.db2.gz XTGNMKHQJDIJAR-RISCZKNCSA-N 1 1 332.360 2.380 20 5 EEBDMO C[C@@H]1CCC[C@@H](CO)[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000162381359 463505213 /nfs/dbraw/zinc/50/52/13/463505213.db2.gz XTGNMKHQJDIJAR-RISCZKNCSA-N 1 1 332.360 2.380 20 5 EEBDMO C[N@H+]1CCC[C@@H](CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000108332686 463598095 /nfs/dbraw/zinc/59/80/95/463598095.db2.gz OCAQXLWQZVZNHD-LBPRGKRZSA-N 1 1 332.404 2.241 20 5 EEBDMO COCCC[N@@H+](C)CCNc1ncc([N+](=O)[O-])cc1Br ZINC000177545922 463732930 /nfs/dbraw/zinc/73/29/30/463732930.db2.gz FJRYIZQHONSURT-UHFFFAOYSA-N 1 1 347.213 2.133 20 5 EEBDMO Cc1nnc([C@@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)[nH]1 ZINC000268412730 463734704 /nfs/dbraw/zinc/73/47/04/463734704.db2.gz AZYOKPSYTDEMDI-CYBMUJFWSA-N 1 1 331.376 2.280 20 5 EEBDMO Cc1n[nH]c([C@@H]2CCC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000268412730 463734712 /nfs/dbraw/zinc/73/47/12/463734712.db2.gz AZYOKPSYTDEMDI-CYBMUJFWSA-N 1 1 331.376 2.280 20 5 EEBDMO Cc1n[nH]c([C@@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000268412730 463734715 /nfs/dbraw/zinc/73/47/15/463734715.db2.gz AZYOKPSYTDEMDI-CYBMUJFWSA-N 1 1 331.376 2.280 20 5 EEBDMO Cc1nc([C@@H]2CCC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)n[nH]1 ZINC000268412730 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C[C@@H]1C[NH+](C(C)(C)CNC(=O)Cc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000172716601 464133980 /nfs/dbraw/zinc/13/39/80/464133980.db2.gz PDQYXAVASDMAKK-ZIAGYGMSSA-N 1 1 349.431 2.141 20 5 EEBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCS(=O)(=O)C1 ZINC000279941964 464167202 /nfs/dbraw/zinc/16/72/02/464167202.db2.gz HEUQQDXTTISKJL-CQSZACIVSA-N 1 1 326.418 2.240 20 5 EEBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCS(=O)(=O)C1 ZINC000279941964 464167206 /nfs/dbraw/zinc/16/72/06/464167206.db2.gz HEUQQDXTTISKJL-CQSZACIVSA-N 1 1 326.418 2.240 20 5 EEBDMO C[N@H+]1CC[C@]2(CCN(c3ccc([N+](=O)[O-])cc3N3CCOC3=O)C2)C1 ZINC000292270398 464181301 /nfs/dbraw/zinc/18/13/01/464181301.db2.gz LMYVSXHSNRXDSH-KRWDZBQOSA-N 1 1 346.387 2.083 20 5 EEBDMO CCc1ccc(C(=O)N2CCC([N@@H+](C)CCCO)CC2)cc1[N+](=O)[O-] ZINC000179762875 464183557 /nfs/dbraw/zinc/18/35/57/464183557.db2.gz OGIGHRZISCULLH-UHFFFAOYSA-N 1 1 349.431 2.076 20 5 EEBDMO CCC(=O)c1ccc(N2CCN(c3[nH+]ccn3C)CC2)c([N+](=O)[O-])c1 ZINC000280757718 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DSZDKSQNKZOOQS-LLVKDONJSA-N 1 1 328.372 2.290 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@H]1[C@H]1CCCO1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000284962891 464407732 /nfs/dbraw/zinc/40/77/32/464407732.db2.gz XJIPGOJGNCKDTQ-DOTOQJQBSA-N 1 1 345.399 2.127 20 5 EEBDMO O=C(C[N@H+]1CCC[C@H]1[C@H]1CCCO1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000284962891 464407738 /nfs/dbraw/zinc/40/77/38/464407738.db2.gz XJIPGOJGNCKDTQ-DOTOQJQBSA-N 1 1 345.399 2.127 20 5 EEBDMO C[C@@H]([NH2+]CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)c1ccccn1 ZINC000271994185 464439978 /nfs/dbraw/zinc/43/99/78/464439978.db2.gz SCMMURTZEBNIDU-SNVBAGLBSA-N 1 1 344.327 2.008 20 5 EEBDMO CC[N@@H+]1CCCC[C@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000264781761 464462461 /nfs/dbraw/zinc/46/24/61/464462461.db2.gz QZOQWRPHBBDZGE-LBPRGKRZSA-N 1 1 341.433 2.285 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000264781761 464462465 /nfs/dbraw/zinc/46/24/65/464462465.db2.gz QZOQWRPHBBDZGE-LBPRGKRZSA-N 1 1 341.433 2.285 20 5 EEBDMO CC[N@@H+]1CCCC[C@@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000264781759 464462950 /nfs/dbraw/zinc/46/29/50/464462950.db2.gz QZOQWRPHBBDZGE-GFCCVEGCSA-N 1 1 341.433 2.285 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000264781759 464462960 /nfs/dbraw/zinc/46/29/60/464462960.db2.gz QZOQWRPHBBDZGE-GFCCVEGCSA-N 1 1 341.433 2.285 20 5 EEBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCc1ccccc1 ZINC000285153719 464469905 /nfs/dbraw/zinc/46/99/05/464469905.db2.gz ABKLIXAGRPDBLR-UHFFFAOYSA-N 1 1 327.384 2.386 20 5 EEBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCc1ccccc1 ZINC000285153719 464469913 /nfs/dbraw/zinc/46/99/13/464469913.db2.gz ABKLIXAGRPDBLR-UHFFFAOYSA-N 1 1 327.384 2.386 20 5 EEBDMO CN1CC[N@@H+](C)C[C@@H]1CNc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000264817285 464477163 /nfs/dbraw/zinc/47/71/63/464477163.db2.gz XJZUAEKYNUFAJQ-NSHDSACASA-N 1 1 332.326 2.271 20 5 EEBDMO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[C@H]1S(C)(=O)=O ZINC000245441150 464481570 /nfs/dbraw/zinc/48/15/70/464481570.db2.gz VERQFYREERTKPN-JKSUJKDBSA-N 1 1 340.445 2.425 20 5 EEBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[C@H]1S(C)(=O)=O ZINC000245441150 464481576 /nfs/dbraw/zinc/48/15/76/464481576.db2.gz VERQFYREERTKPN-JKSUJKDBSA-N 1 1 340.445 2.425 20 5 EEBDMO C[C@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000294407943 464492283 /nfs/dbraw/zinc/49/22/83/464492283.db2.gz AMEYEAFUDZTUEV-GFCCVEGCSA-N 1 1 333.388 2.157 20 5 EEBDMO C[N@@H+]1CC[C@@H]2CCN(c3ncc([N+](=O)[O-])cc3Br)[C@H]2C1 ZINC000272166833 464502852 /nfs/dbraw/zinc/50/28/52/464502852.db2.gz GZYXINPETAKSQP-SKDRFNHKSA-N 1 1 341.209 2.283 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(c3ncc([N+](=O)[O-])cc3Br)[C@H]2C1 ZINC000272166833 464502856 /nfs/dbraw/zinc/50/28/56/464502856.db2.gz GZYXINPETAKSQP-SKDRFNHKSA-N 1 1 341.209 2.283 20 5 EEBDMO COC(=O)c1cc(N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)cc(C)c1[N+](=O)[O-] ZINC000272225431 464526171 /nfs/dbraw/zinc/52/61/71/464526171.db2.gz SVHAMYOINBTEFD-WFASDCNBSA-N 1 1 333.388 2.220 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(C)[C@@H]2CC[N@H+](C)C[C@H]2C)c1 ZINC000281632195 464527723 /nfs/dbraw/zinc/52/77/23/464527723.db2.gz QOYRHWWWBXKUFS-HUUCEWRRSA-N 1 1 349.431 2.471 20 5 EEBDMO CN(C)C(=O)CC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000182161891 464587090 /nfs/dbraw/zinc/58/70/90/464587090.db2.gz VFPRJKXOQHKVHR-UHFFFAOYSA-N 1 1 346.387 2.426 20 5 EEBDMO O=[N+]([O-])c1ccc(OC(F)F)c(CNCc2n[nH]c(C3CC3)n2)c1 ZINC000294864835 464630387 /nfs/dbraw/zinc/63/03/87/464630387.db2.gz UBZAGRJYSQLPHC-UHFFFAOYSA-N 1 1 339.302 2.482 20 5 EEBDMO O=C(N1CC[NH+](CC2CC2)CC1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272610658 464679447 /nfs/dbraw/zinc/67/94/47/464679447.db2.gz WQIZODQWROQUHI-UHFFFAOYSA-N 1 1 339.342 2.241 20 5 EEBDMO O=[N+]([O-])c1ccn(CCN2CC[NH+](C/C=C/c3ccccc3)CC2)n1 ZINC000176190256 464715897 /nfs/dbraw/zinc/71/58/97/464715897.db2.gz GANMYOMZDBZICB-QPJJXVBHSA-N 1 1 341.415 2.122 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[NH+]2CCN(C/C=C/c3ccccc3)CC2)n1 ZINC000176190256 464715899 /nfs/dbraw/zinc/71/58/99/464715899.db2.gz GANMYOMZDBZICB-QPJJXVBHSA-N 1 1 341.415 2.122 20 5 EEBDMO C[C@@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000176288431 464740393 /nfs/dbraw/zinc/74/03/93/464740393.db2.gz OSYNDPBXHQRDBT-MYODQAERSA-N 1 1 336.417 2.222 20 5 EEBDMO COCc1cc([N+](=O)[O-])ccc1N1CC[NH+](Cc2ccncc2)CC1 ZINC000265969444 464753244 /nfs/dbraw/zinc/75/32/44/464753244.db2.gz ASXNIBNDSBXLDS-UHFFFAOYSA-N 1 1 342.399 2.458 20 5 EEBDMO COc1cccc(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000248861439 464812373 /nfs/dbraw/zinc/81/23/73/464812373.db2.gz METACXBSIOXKGM-OLZOCXBDSA-N 1 1 335.404 2.454 20 5 EEBDMO C[C@@H](O)[C@H]1CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000183185369 464815946 /nfs/dbraw/zinc/81/59/46/464815946.db2.gz IVSAVWMNFQHNJT-LOWVWBTDSA-N 1 1 332.360 2.409 20 5 EEBDMO C[C@@H]1CN(c2ccccc2F)CC[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000191623001 464823249 /nfs/dbraw/zinc/82/32/49/464823249.db2.gz UKYPEKJJBOBNQK-CYBMUJFWSA-N 1 1 333.367 2.141 20 5 EEBDMO C[C@@H]1CN(c2ccccc2F)CC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000191623001 464823251 /nfs/dbraw/zinc/82/32/51/464823251.db2.gz UKYPEKJJBOBNQK-CYBMUJFWSA-N 1 1 333.367 2.141 20 5 EEBDMO CC[N@@H+](CCNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000282496764 464840994 /nfs/dbraw/zinc/84/09/94/464840994.db2.gz ROTGMYKZCDZRPJ-UHFFFAOYSA-N 1 1 334.420 2.263 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000249456412 464876718 /nfs/dbraw/zinc/87/67/18/464876718.db2.gz YBWRVEPDJKJVFN-RYUDHWBXSA-N 1 1 327.812 2.135 20 5 EEBDMO CC[C@@H](C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)OC ZINC000337450152 465377175 /nfs/dbraw/zinc/37/71/75/465377175.db2.gz FBJUIOXWHCTEIU-GFCCVEGCSA-N 1 1 337.376 2.197 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342930786 465396116 /nfs/dbraw/zinc/39/61/16/465396116.db2.gz VKXBZCIAWQRORL-NWDGAFQWSA-N 1 1 328.372 2.433 20 5 EEBDMO CCOC(=O)c1ccnc(N[C@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000348164381 465460950 /nfs/dbraw/zinc/46/09/50/465460950.db2.gz SRSYZCHMYKNBKE-QWHCGFSZSA-N 1 1 334.376 2.205 20 5 EEBDMO Cn1nccc1[C@@H]1OCC[C@@H]1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000343579308 465530529 /nfs/dbraw/zinc/53/05/29/465530529.db2.gz KFZNTNJAJMZVSB-RDTXWAMCSA-N 1 1 342.399 2.464 20 5 EEBDMO C[C@@H]1CC[N@H+](C)CCN1c1ncc([N+](=O)[O-])cc1Br ZINC000362250977 465606719 /nfs/dbraw/zinc/60/67/19/465606719.db2.gz SOBIDZNXNGTWFX-SECBINFHSA-N 1 1 329.198 2.283 20 5 EEBDMO C[C@@H]1CC[N@@H+](C)CCN1c1ncc([N+](=O)[O-])cc1Br ZINC000362250977 465606723 /nfs/dbraw/zinc/60/67/23/465606723.db2.gz SOBIDZNXNGTWFX-SECBINFHSA-N 1 1 329.198 2.283 20 5 EEBDMO C[C@@H]1[C@H](C)N(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000356975629 465672211 /nfs/dbraw/zinc/67/22/11/465672211.db2.gz BHZMMZDPADIIAZ-MNOVXSKESA-N 1 1 340.811 2.211 20 5 EEBDMO O=[N+]([O-])c1cc(CNC[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000344556501 465674388 /nfs/dbraw/zinc/67/43/88/465674388.db2.gz ZHUUXQHWQJHLAH-KRWDZBQOSA-N 1 1 347.440 2.383 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000330871748 465839074 /nfs/dbraw/zinc/83/90/74/465839074.db2.gz RFTNUXQUXAFJAV-RHSMWYFYSA-N 1 1 348.447 2.362 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[N@@H+](C)CC1 ZINC000340169239 465839063 /nfs/dbraw/zinc/83/90/63/465839063.db2.gz VNPMBHWIAPHXJN-NSHDSACASA-N 1 1 340.811 2.213 20 5 EEBDMO CCOC(=O)c1ccnc(N2C[C@@H](C)[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-] ZINC000345191151 465841355 /nfs/dbraw/zinc/84/13/55/465841355.db2.gz PHJOIGHWNPCFGZ-NEPJUHHUSA-N 1 1 336.392 2.085 20 5 EEBDMO CC(C)(C)OC(=O)CN[C@@]1(C)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000349148152 465998165 /nfs/dbraw/zinc/99/81/65/465998165.db2.gz IUTJTWJZUYDPLQ-SFHVURJKSA-N 1 1 349.431 2.491 20 5 EEBDMO CC(C)(C)OC(=O)CN[C@@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000349148152 465998176 /nfs/dbraw/zinc/99/81/76/465998176.db2.gz IUTJTWJZUYDPLQ-SFHVURJKSA-N 1 1 349.431 2.491 20 5 EEBDMO C[N@H+]1CCC[C@@H](N2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC000301775620 466028368 /nfs/dbraw/zinc/02/83/68/466028368.db2.gz HHOZKZTYJRCWNE-GFCCVEGCSA-N 1 1 340.374 2.089 20 5 EEBDMO O=C(CC[N@@H+]1CC[C@@H](N2CCCCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000331524002 466122795 /nfs/dbraw/zinc/12/27/95/466122795.db2.gz CUHBLQXRLBLJMP-QGZVFWFLSA-N 1 1 346.431 2.484 20 5 EEBDMO O=C(CC[N@H+]1CC[C@@H](N2CCCCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000331524002 466122803 /nfs/dbraw/zinc/12/28/03/466122803.db2.gz CUHBLQXRLBLJMP-QGZVFWFLSA-N 1 1 346.431 2.484 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N2C[C@H]3CCCC[N@@H+]3C[C@H]2C)c1[N+](=O)[O-] ZINC000331913292 466302266 /nfs/dbraw/zinc/30/22/66/466302266.db2.gz BDAMELAZVFARSV-VXGBXAGGSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N2C[C@H]3CCCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-] ZINC000331913292 466302272 /nfs/dbraw/zinc/30/22/72/466302272.db2.gz BDAMELAZVFARSV-VXGBXAGGSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2C[C@H]3CCCC[N@@H+]3C[C@H]2C)c1[N+](=O)[O-] ZINC000331913292 466302286 /nfs/dbraw/zinc/30/22/86/466302286.db2.gz BDAMELAZVFARSV-VXGBXAGGSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2C[C@H]3CCCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-] ZINC000331913292 466302290 /nfs/dbraw/zinc/30/22/90/466302290.db2.gz BDAMELAZVFARSV-VXGBXAGGSA-N 1 1 335.408 2.140 20 5 EEBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000354007558 466322742 /nfs/dbraw/zinc/32/27/42/466322742.db2.gz QNJOOFWYIYIYMI-CYBMUJFWSA-N 1 1 330.388 2.102 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C ZINC000332019781 466348108 /nfs/dbraw/zinc/34/81/08/466348108.db2.gz FYLMSSCLXVOJCC-YPMHNXCESA-N 1 1 330.388 2.218 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CN(C)c2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000361887591 466380939 /nfs/dbraw/zinc/38/09/39/466380939.db2.gz FQKVPRIAPITZAK-HUUCEWRRSA-N 1 1 348.447 2.362 20 5 EEBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NCC[N@@H+](C)Cc1ccccc1 ZINC000350276566 466447235 /nfs/dbraw/zinc/44/72/35/466447235.db2.gz CPFAPGPFFNLKGQ-UHFFFAOYSA-N 1 1 342.399 2.498 20 5 EEBDMO C[N@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)Cc1nccs1 ZINC000350760541 466599412 /nfs/dbraw/zinc/59/94/12/466599412.db2.gz AVVGQNLCADPRMX-UHFFFAOYSA-N 1 1 348.384 2.481 20 5 EEBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)Cc1nccs1 ZINC000350760541 466599419 /nfs/dbraw/zinc/59/94/19/466599419.db2.gz AVVGQNLCADPRMX-UHFFFAOYSA-N 1 1 348.384 2.481 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000363798826 466621780 /nfs/dbraw/zinc/62/17/80/466621780.db2.gz DJORWKOXYOYAGA-KBPBESRZSA-N 1 1 348.403 2.196 20 5 EEBDMO Cc1[nH+]ccn1CCCCNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000341160637 466625431 /nfs/dbraw/zinc/62/54/31/466625431.db2.gz UDUCWWSBCZKEBQ-UHFFFAOYSA-N 1 1 345.403 2.422 20 5 EEBDMO Cc1ccc(NC(=O)C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000373284930 466752644 /nfs/dbraw/zinc/75/26/44/466752644.db2.gz MZHIWRVZGQUWAM-UHFFFAOYSA-N 1 1 343.387 2.375 20 5 EEBDMO CC[C@H](C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(=O)OC ZINC000411672107 466872115 /nfs/dbraw/zinc/87/21/15/466872115.db2.gz MWPQLTHEMXHLIP-LBPRGKRZSA-N 1 1 337.376 2.197 20 5 EEBDMO CCN1C[C@H](C)[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000411726124 466887602 /nfs/dbraw/zinc/88/76/02/466887602.db2.gz XMMWKMCWUUMFOL-KBPBESRZSA-N 1 1 334.420 2.338 20 5 EEBDMO CCCCCCNC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365819323 466949985 /nfs/dbraw/zinc/94/99/85/466949985.db2.gz IXZXCPDUOHGABX-UHFFFAOYSA-N 1 1 337.424 2.125 20 5 EEBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C(C)(C)CN1CCOCC1 ZINC000412098558 467007072 /nfs/dbraw/zinc/00/70/72/467007072.db2.gz XWNIAPDAFVWHNC-UHFFFAOYSA-N 1 1 337.420 2.016 20 5 EEBDMO CCC[N@@H+](CC)CCNC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412169526 467030205 /nfs/dbraw/zinc/03/02/05/467030205.db2.gz YGWUHEHDAYZJBA-UHFFFAOYSA-N 1 1 341.383 2.133 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@H]2[C@H](O)c2ccccc2)n1 ZINC000377954097 467170435 /nfs/dbraw/zinc/17/04/35/467170435.db2.gz NICSZXVPSDCPTL-DOTOQJQBSA-N 1 1 330.388 2.379 20 5 EEBDMO CO[C@@H](CC(C)C)C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000419286040 467183939 /nfs/dbraw/zinc/18/39/39/467183939.db2.gz NREHXUUCGGMEGE-HNNXBMFYSA-N 1 1 349.431 2.414 20 5 EEBDMO C[N@H+]1C[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000378304618 467257337 /nfs/dbraw/zinc/25/73/37/467257337.db2.gz HOHPANWRPGEEIX-SJORKVTESA-N 1 1 339.395 2.351 20 5 EEBDMO C[C@@H]1C[N@@H+](CCN(C)c2ncnc3cccc([N+](=O)[O-])c32)C[C@H](C)O1 ZINC000432941017 467277204 /nfs/dbraw/zinc/27/72/04/467277204.db2.gz ZCZDZWQVYFSNLW-BETUJISGSA-N 1 1 345.403 2.083 20 5 EEBDMO C[C@@H]1C[N@H+](CCN(C)c2ncnc3cccc([N+](=O)[O-])c32)C[C@H](C)O1 ZINC000432941017 467277209 /nfs/dbraw/zinc/27/72/09/467277209.db2.gz ZCZDZWQVYFSNLW-BETUJISGSA-N 1 1 345.403 2.083 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c([N+](=O)[O-])c1 ZINC000378397481 467291004 /nfs/dbraw/zinc/29/10/04/467291004.db2.gz OZFOBBJYVPALAY-KGLIPLIRSA-N 1 1 347.415 2.332 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H]1[C@H](C)CCN[C@@H]1C ZINC000420369810 467380671 /nfs/dbraw/zinc/38/06/71/467380671.db2.gz ONPGVSATWXDJMH-CJBNDPTMSA-N 1 1 334.420 2.208 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCCNC(=O)C1CCC1 ZINC000430242863 467410999 /nfs/dbraw/zinc/41/09/99/467410999.db2.gz YPDIVALBIUUMHI-UHFFFAOYSA-N 1 1 335.404 2.342 20 5 EEBDMO COc1cc(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000457095802 467751704 /nfs/dbraw/zinc/75/17/04/467751704.db2.gz QIEUGFLJRZRVSK-LLVKDONJSA-N 1 1 339.367 2.297 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000458592958 467863234 /nfs/dbraw/zinc/86/32/34/467863234.db2.gz UIGOEKOXZBAWCE-MRXNPFEDSA-N 1 1 334.420 2.261 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@@H+](C)[C@@H](C(C)C)C1 ZINC000487946758 468061691 /nfs/dbraw/zinc/06/16/91/468061691.db2.gz CDMIETIPZUHHSN-MRXNPFEDSA-N 1 1 334.420 2.114 20 5 EEBDMO CC(C)Oc1nc(NCCc2cn3c([nH+]2)CCCC3)ccc1[N+](=O)[O-] ZINC000577886714 468193946 /nfs/dbraw/zinc/19/39/46/468193946.db2.gz SLJMBDVGQDSYLZ-UHFFFAOYSA-N 1 1 345.403 2.964 20 5 EEBDMO C[N@@H+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1(C)C ZINC000549729299 468194074 /nfs/dbraw/zinc/19/40/74/468194074.db2.gz VFXKKVCEAHJLKG-UHFFFAOYSA-N 1 1 332.404 2.335 20 5 EEBDMO C[N@H+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1(C)C ZINC000549729299 468194078 /nfs/dbraw/zinc/19/40/78/468194078.db2.gz VFXKKVCEAHJLKG-UHFFFAOYSA-N 1 1 332.404 2.335 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594235246 468524087 /nfs/dbraw/zinc/52/40/87/468524087.db2.gz UNTPPHXROYKWIV-IRXDYDNUSA-N 1 1 346.431 2.453 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000597606530 468614309 /nfs/dbraw/zinc/61/43/09/468614309.db2.gz WQRQXGAPAFCBML-CQSZACIVSA-N 1 1 335.404 2.089 20 5 EEBDMO CN1CCN(c2cc[nH+]c(NCc3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000601067781 468733199 /nfs/dbraw/zinc/73/31/99/468733199.db2.gz BVLKCPYCTDRLRT-UHFFFAOYSA-N 1 1 327.388 2.354 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H]1CCCCS1(=O)=O ZINC000595032265 468746355 /nfs/dbraw/zinc/74/63/55/468746355.db2.gz LVRAJXSXLDSQEH-YPMHNXCESA-N 1 1 342.417 2.221 20 5 EEBDMO O=[N+]([O-])c1ccccc1-c1cnn(CC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1 ZINC000583763405 468752817 /nfs/dbraw/zinc/75/28/17/468752817.db2.gz YCGNAZQKWNXDCN-GASCZTMLSA-N 1 1 328.372 2.322 20 5 EEBDMO C[C@H](O)C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000583784027 468753944 /nfs/dbraw/zinc/75/39/44/468753944.db2.gz JMKGZEYSJBRPJD-AWEZNQCLSA-N 1 1 343.383 2.416 20 5 EEBDMO C[C@H](O)C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000583784027 468753950 /nfs/dbraw/zinc/75/39/50/468753950.db2.gz JMKGZEYSJBRPJD-AWEZNQCLSA-N 1 1 343.383 2.416 20 5 EEBDMO CCCN1C[C@H](CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1=O ZINC000601174981 468770849 /nfs/dbraw/zinc/77/08/49/468770849.db2.gz JBBNAGPJGCCBBT-LBPRGKRZSA-N 1 1 328.372 2.235 20 5 EEBDMO O=C(N[C@H]1CC[N@@H+](C2CCCCC2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000598217798 468795747 /nfs/dbraw/zinc/79/57/47/468795747.db2.gz BWBOLAAGPCWSEY-ZDUSSCGKSA-N 1 1 333.388 2.437 20 5 EEBDMO O=C(N[C@H]1CC[N@H+](C2CCCCC2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000598217798 468795752 /nfs/dbraw/zinc/79/57/52/468795752.db2.gz BWBOLAAGPCWSEY-ZDUSSCGKSA-N 1 1 333.388 2.437 20 5 EEBDMO CCO[C@H]1C[C@H](O)C12CC[NH+](Cc1ccc(F)cc1[N+](=O)[O-])CC2 ZINC000595334833 468815947 /nfs/dbraw/zinc/81/59/47/468815947.db2.gz WISFPUWMUCHMGF-HOTGVXAUSA-N 1 1 338.379 2.486 20 5 EEBDMO CC(C)O[C@H]1CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000593055575 468854827 /nfs/dbraw/zinc/85/48/27/468854827.db2.gz MAOGGQMMNCRYHT-INIZCTEOSA-N 1 1 335.404 2.447 20 5 EEBDMO CC(C)O[C@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000593055575 468854832 /nfs/dbraw/zinc/85/48/32/468854832.db2.gz MAOGGQMMNCRYHT-INIZCTEOSA-N 1 1 335.404 2.447 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1CCC([C@@H](C)CO)CC1 ZINC000593083655 468864804 /nfs/dbraw/zinc/86/48/04/468864804.db2.gz KJGRPZCIPODDGQ-ZDUSSCGKSA-N 1 1 335.404 2.182 20 5 EEBDMO C[C@@H](CO)C1CC[NH+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000593085868 468865487 /nfs/dbraw/zinc/86/54/87/468865487.db2.gz YHKGTQOFCGGZQD-LBPRGKRZSA-N 1 1 346.387 2.485 20 5 EEBDMO CC[N@H+]1CCCN(S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000601440856 468874427 /nfs/dbraw/zinc/87/44/27/468874427.db2.gz ZLMMVLAIHKRKAF-ZDUSSCGKSA-N 1 1 341.433 2.008 20 5 EEBDMO Cc1cc(OCC(=O)N2[C@H](C)C[N@@H+](C)[C@@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000593189633 468899992 /nfs/dbraw/zinc/89/99/92/468899992.db2.gz WIDGPJAWPMUYFS-RDBSUJKOSA-N 1 1 335.404 2.222 20 5 EEBDMO COC(=O)c1ccnc(NC[C@@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-] 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/nfs/dbraw/zinc/23/91/33/160239133.db2.gz YTGLNAGPBTZJHD-YPMHNXCESA-N 1 1 334.376 2.304 20 5 EEBDMO C[C@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H]1C ZINC000245931805 160257941 /nfs/dbraw/zinc/25/79/41/160257941.db2.gz PKKPZVUROKIGMO-WDEREUQCSA-N 1 1 335.360 2.240 20 5 EEBDMO C[C@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H]1C ZINC000245931805 160257943 /nfs/dbraw/zinc/25/79/43/160257943.db2.gz PKKPZVUROKIGMO-WDEREUQCSA-N 1 1 335.360 2.240 20 5 EEBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000247333446 160320549 /nfs/dbraw/zinc/32/05/49/160320549.db2.gz VMKWKYVBTJSBQX-GJZGRUSLSA-N 1 1 347.415 2.306 20 5 EEBDMO COc1ccc(OCCN2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)c([N+](=O)[O-])c1 ZINC000342106110 161040024 /nfs/dbraw/zinc/04/00/24/161040024.db2.gz OUSVOUOAKKTCHB-AEGPPILISA-N 1 1 335.404 2.041 20 5 EEBDMO C[C@H]1[C@@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCC[N@@H+]1C ZINC000343962581 161184859 /nfs/dbraw/zinc/18/48/59/161184859.db2.gz 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CCC[N@H+](CC)C[C@@H](C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000352560490 162189163 /nfs/dbraw/zinc/18/91/63/162189163.db2.gz POMOYXLCTKTHKP-LLVKDONJSA-N 1 1 347.412 2.133 20 5 EEBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000352560490 162189168 /nfs/dbraw/zinc/18/91/68/162189168.db2.gz POMOYXLCTKTHKP-LLVKDONJSA-N 1 1 347.412 2.133 20 5 EEBDMO O=C(NC[C@@H]1CCC[N@H+]1CC1CCCCC1)c1cc([N+](=O)[O-])n[nH]1 ZINC000352695716 162250465 /nfs/dbraw/zinc/25/04/65/162250465.db2.gz FBVZCJYNGOBIMT-ZDUSSCGKSA-N 1 1 335.408 2.092 20 5 EEBDMO CCn1nc(C)c([N+](=O)[O-])c1NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000358916329 164014963 /nfs/dbraw/zinc/01/49/63/164014963.db2.gz SKQNIZOIBVFYQQ-LBPRGKRZSA-N 1 1 325.413 2.032 20 5 EEBDMO Cc1c(CNC(=O)N[C@H]2C[N@@H+](C3CC3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000359214005 164084999 /nfs/dbraw/zinc/08/49/99/164084999.db2.gz PEIUBAJWQVOEDP-ABAIWWIYSA-N 1 1 332.404 2.185 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000364640114 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CQBMACXWUMLQLY-CYBMUJFWSA-N 1 1 332.404 2.387 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(c3ccc([N+](=O)[O-])cc3Br)C[C@H]2C1 ZINC000278266623 269220744 /nfs/dbraw/zinc/22/07/44/269220744.db2.gz AGRQVVLQPUKPSW-AOOOYVTPSA-N 1 1 326.194 2.355 20 5 EEBDMO CC[N@@H+](C)CCNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278494203 269233533 /nfs/dbraw/zinc/23/35/33/269233533.db2.gz ULWRXASVMBWAFC-UHFFFAOYSA-N 1 1 348.325 2.365 20 5 EEBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000279384221 269275876 /nfs/dbraw/zinc/27/58/76/269275876.db2.gz UPCNRDSKIIRLCO-RMKNXTFCSA-N 1 1 347.415 2.177 20 5 EEBDMO CN(CC[N@H+]1CCOC(C)(C)C1)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000279384221 269275877 /nfs/dbraw/zinc/27/58/77/269275877.db2.gz UPCNRDSKIIRLCO-RMKNXTFCSA-N 1 1 347.415 2.177 20 5 EEBDMO CC(C)CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C1CC[NH+](C)CC1 ZINC000269419750 274110234 /nfs/dbraw/zinc/11/02/34/274110234.db2.gz YYLPGZPPXGVLSG-UHFFFAOYSA-N 1 1 335.404 2.493 20 5 EEBDMO Cc1noc([C@@H]2CCC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000269663630 274116680 /nfs/dbraw/zinc/11/66/80/274116680.db2.gz RJWDPTJZQCDEEA-UKRRQHHQSA-N 1 1 332.360 2.199 20 5 EEBDMO O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000272614335 274177729 /nfs/dbraw/zinc/17/77/29/274177729.db2.gz ZXBHQZWUSNSARP-CQSZACIVSA-N 1 1 333.388 2.391 20 5 EEBDMO C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000286438987 274872024 /nfs/dbraw/zinc/87/20/24/274872024.db2.gz SKZHNDVSVRPGNK-XJKSGUPXSA-N 1 1 342.399 2.442 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000289703802 275140769 /nfs/dbraw/zinc/14/07/69/275140769.db2.gz MLCCCVWTXFLUME-LBPRGKRZSA-N 1 1 339.440 2.035 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CC[C@H](n4cccn4)C3)o2)cc1 ZINC000291597534 275321360 /nfs/dbraw/zinc/32/13/60/275321360.db2.gz BUEDDVRKTLPNSN-AWEZNQCLSA-N 1 1 340.343 2.288 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@H](n4cccn4)C3)o2)cc1 ZINC000291597534 275321362 /nfs/dbraw/zinc/32/13/62/275321362.db2.gz BUEDDVRKTLPNSN-AWEZNQCLSA-N 1 1 340.343 2.288 20 5 EEBDMO COc1cc(C(=O)N[C@H](C)C[N@@H+](C)C(C)C)cc([N+](=O)[O-])c1OC ZINC000292061945 275369995 /nfs/dbraw/zinc/36/99/95/275369995.db2.gz ZWOUXYIGDZAUCJ-LLVKDONJSA-N 1 1 339.392 2.071 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](N2CCNC2=O)C1 ZINC000368021470 281019708 /nfs/dbraw/zinc/01/97/08/281019708.db2.gz RJAAUZLUKSFAPS-UKRRQHHQSA-N 1 1 332.404 2.454 20 5 EEBDMO CCc1nocc1C[N@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000293460271 293214977 /nfs/dbraw/zinc/21/49/77/293214977.db2.gz QCYCESDLBPWVHE-CYBMUJFWSA-N 1 1 335.360 2.017 20 5 EEBDMO CCc1nocc1C[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000293460271 293214978 /nfs/dbraw/zinc/21/49/78/293214978.db2.gz QCYCESDLBPWVHE-CYBMUJFWSA-N 1 1 335.360 2.017 20 5 EEBDMO C[C@H](NC(=O)N[C@@H]1C[N@H+](C2CC2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000296536704 294002249 /nfs/dbraw/zinc/00/22/49/294002249.db2.gz SAWINLYTUKPPDE-MQIPJXDCSA-N 1 1 332.404 2.438 20 5 EEBDMO COC(=O)Cc1ccc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000297192584 294176565 /nfs/dbraw/zinc/17/65/65/294176565.db2.gz QTLJQLPTZKPQJC-ZDUSSCGKSA-N 1 1 344.371 2.417 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+]2CCCC[C@H]2C1 ZINC000332473833 312012549 /nfs/dbraw/zinc/01/25/49/312012549.db2.gz KUAVAVWRZAQBHK-AWEZNQCLSA-N 1 1 332.404 2.012 20 5 EEBDMO C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CC(OC(C)(C)C)C1 ZINC000421003262 314021007 /nfs/dbraw/zinc/02/10/07/314021007.db2.gz GYNSFOWFULIMCI-UHFFFAOYSA-N 1 1 335.404 2.472 20 5 EEBDMO CC1(C)[C@H](c2ccccc2)CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000421009670 314023702 /nfs/dbraw/zinc/02/37/02/314023702.db2.gz CDIXRWYFQIOEFV-SJORKVTESA-N 1 1 344.415 2.420 20 5 EEBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)c2cc([N+](=O)[O-])cn2C)c1 ZINC000533115651 317900036 /nfs/dbraw/zinc/90/00/36/317900036.db2.gz DQNXFLSTHNCOKZ-UHFFFAOYSA-N 1 1 326.316 2.075 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000545194376 318206656 /nfs/dbraw/zinc/20/66/56/318206656.db2.gz USEGHKHIGNGBAY-BBRMVZONSA-N 1 1 342.399 2.184 20 5 EEBDMO Cn1cc(C(C)(C)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)cn1 ZINC000545293274 318214491 /nfs/dbraw/zinc/21/44/91/318214491.db2.gz UWKSRALQBXYIKP-UHFFFAOYSA-N 1 1 332.360 2.220 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000574355501 320017707 /nfs/dbraw/zinc/01/77/07/320017707.db2.gz WMSYLXAKELGNJG-HZPDHXFCSA-N 1 1 343.383 2.219 20 5 EEBDMO CC(C)[C@H](CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000574981869 320076457 /nfs/dbraw/zinc/07/64/57/320076457.db2.gz CGQLIFLWXWZLDR-PBHICJAKSA-N 1 1 349.431 2.171 20 5 EEBDMO CCCC[N@@H+](CCCO)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000182155972 323366172 /nfs/dbraw/zinc/36/61/72/323366172.db2.gz UJSTXGCLFNUNTJ-MRXNPFEDSA-N 1 1 335.404 2.185 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000133662276 462956787 /nfs/dbraw/zinc/95/67/87/462956787.db2.gz MMKJYVWHGMMWOS-SKDRFNHKSA-N 1 1 348.359 2.166 20 5 EEBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000358409128 465104936 /nfs/dbraw/zinc/10/49/36/465104936.db2.gz HSMCTLSYYKXCLG-NSHDSACASA-N 1 1 334.351 2.234 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)N2CCC3(C2)CC[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000358504177 465163433 /nfs/dbraw/zinc/16/34/33/465163433.db2.gz HNCRJQOYXNHJGZ-AWEZNQCLSA-N 1 1 346.431 2.306 20 5 EEBDMO CC[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc2c(c1)OCCO2 ZINC000341582348 465242975 /nfs/dbraw/zinc/24/29/75/465242975.db2.gz BLMQORGYXQOYFV-GFCCVEGCSA-N 1 1 332.360 2.340 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCO)[C@@H]1CC[C@@H](C)C1 ZINC000351618485 465255374 /nfs/dbraw/zinc/25/53/74/465255374.db2.gz HLRVQURBVIEFPD-TZMCWYRMSA-N 1 1 335.404 2.325 20 5 EEBDMO CCNc1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000356384225 465351446 /nfs/dbraw/zinc/35/14/46/465351446.db2.gz DELBFVUAYJBVBC-SWLSCSKDSA-N 1 1 334.420 2.439 20 5 EEBDMO CC1(C)C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]2COC[C@@H]21 ZINC000590663654 468299096 /nfs/dbraw/zinc/29/90/96/468299096.db2.gz JIQNXQPPYJEERT-LSDHHAIUSA-N 1 1 334.372 2.318 20 5 EEBDMO CC1(C)C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]2COC[C@@H]21 ZINC000590663654 468299101 /nfs/dbraw/zinc/29/91/01/468299101.db2.gz JIQNXQPPYJEERT-LSDHHAIUSA-N 1 1 334.372 2.318 20 5 EEBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000087155569 462592889 /nfs/dbraw/zinc/59/28/89/462592889.db2.gz UVCCEKZMEOPXGW-ZDUSSCGKSA-N 1 1 330.388 2.485 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@H](C[NH+](C)C)C1 ZINC000114198723 462631144 /nfs/dbraw/zinc/63/11/44/462631144.db2.gz GTNHGIKMHMHMCT-AWEZNQCLSA-N 1 1 334.420 2.115 20 5 EEBDMO O=C1NCCN1C1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153456680 462652528 /nfs/dbraw/zinc/65/25/28/462652528.db2.gz BJFNOBATWVQQMF-UHFFFAOYSA-N 1 1 338.795 2.238 20 5 EEBDMO CCOc1ccc(NC(=O)C[N@@H+]2CC[C@@]3(CCOC3)C2)c([N+](=O)[O-])c1 ZINC000153744924 462686268 /nfs/dbraw/zinc/68/62/68/462686268.db2.gz LNQYYZWBWXPXGI-QGZVFWFLSA-N 1 1 349.387 2.044 20 5 EEBDMO CCOc1ccc(NC(=O)C[N@H+]2CC[C@@]3(CCOC3)C2)c([N+](=O)[O-])c1 ZINC000153744924 462686276 /nfs/dbraw/zinc/68/62/76/462686276.db2.gz LNQYYZWBWXPXGI-QGZVFWFLSA-N 1 1 349.387 2.044 20 5 EEBDMO Cc1ccc(C(C)(C)C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000075861741 462766723 /nfs/dbraw/zinc/76/67/23/462766723.db2.gz LZLLRAABJAQQIK-QGZVFWFLSA-N 1 1 346.431 2.370 20 5 EEBDMO CCc1nn(C)c(NCCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000091736629 462900874 /nfs/dbraw/zinc/90/08/74/462900874.db2.gz QTFZHQVHGJNJIM-BETUJISGSA-N 1 1 339.440 2.192 20 5 EEBDMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000119451262 462902480 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EEBDMO CCOC(=O)c1ccnc(N[C@H]2CC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-] ZINC000077965628 463075912 /nfs/dbraw/zinc/07/59/12/463075912.db2.gz QVWZWSKLEDFGEX-LBPRGKRZSA-N 1 1 334.376 2.063 20 5 EEBDMO CSC[C@H]1CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000135452290 463158530 /nfs/dbraw/zinc/15/85/30/463158530.db2.gz UNFSNPKCXPHGKZ-KGLIPLIRSA-N 1 1 326.418 2.162 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1ccncc1 ZINC000121574100 463160309 /nfs/dbraw/zinc/16/03/09/463160309.db2.gz ALAQFPNFBFZVDO-ZDUSSCGKSA-N 1 1 328.372 2.491 20 5 EEBDMO CC(C)C(=O)N1CCC[N@H+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000069608888 463286009 /nfs/dbraw/zinc/28/60/09/463286009.db2.gz REKHAUPTXORYQX-UHFFFAOYSA-N 1 1 335.404 2.164 20 5 EEBDMO CC(C)C(=O)N1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000069608888 463286021 /nfs/dbraw/zinc/28/60/21/463286021.db2.gz REKHAUPTXORYQX-UHFFFAOYSA-N 1 1 335.404 2.164 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000140423562 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347.462 2.055 20 5 EEBDMO CCc1n[nH]c(C(=O)NCCC[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000171368723 529466786 /nfs/dbraw/zinc/46/67/86/529466786.db2.gz WINRHWHFNFTDTG-UHFFFAOYSA-N 1 1 345.403 2.132 20 5 EEBDMO CCc1n[nH]c(C(=O)NCc2cccc(C[N@H+](C)CC)c2)c1[N+](=O)[O-] ZINC000171804175 529467959 /nfs/dbraw/zinc/46/79/59/529467959.db2.gz JKRCXNVOTHNOQM-UHFFFAOYSA-N 1 1 345.403 2.262 20 5 EEBDMO CC[C@@]1(CO)CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000189671835 529562263 /nfs/dbraw/zinc/56/22/63/529562263.db2.gz CBSRKIUDBPJMNE-INIZCTEOSA-N 1 1 339.367 2.299 20 5 EEBDMO CC[N@@H+]1CCN(c2ncc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000104139705 219351340 /nfs/dbraw/zinc/35/13/40/219351340.db2.gz APXVYHIKCIQWMI-VIFPVBQESA-N 1 1 329.198 2.283 20 5 EEBDMO CC[N@H+]1CCN(c2ncc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000104139705 219351344 /nfs/dbraw/zinc/35/13/44/219351344.db2.gz APXVYHIKCIQWMI-VIFPVBQESA-N 1 1 329.198 2.283 20 5 EEBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@@H](O)C[C@H]2CO)s1 ZINC000187663363 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O=C(Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1)c1ccc([N+](=O)[O-])o1 ZINC000428546468 467245446 /nfs/dbraw/zinc/24/54/46/467245446.db2.gz NBASQRPYTQULFA-CYBMUJFWSA-N 1 1 331.328 2.007 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)c(CN2CC[NH+]([C@H]3CCOC3)CC2)c1 ZINC000378401028 467291333 /nfs/dbraw/zinc/29/13/33/467291333.db2.gz WXLPYLJJKVJMDX-AWEZNQCLSA-N 1 1 325.796 2.155 20 5 EEBDMO COC[C@H]1CCCC[N@H+]1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000452034662 467309790 /nfs/dbraw/zinc/30/97/90/467309790.db2.gz FBIDFLDAJOSQFF-CQSZACIVSA-N 1 1 349.387 2.394 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H]1[C@H](C)CCN[C@H]1C ZINC000420380218 467386294 /nfs/dbraw/zinc/38/62/94/467386294.db2.gz YFISKGNJRAODNO-IIYDPXPESA-N 1 1 334.420 2.208 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](C)[C@H]2CN)cccc1[N+](=O)[O-] ZINC000430553977 467438108 /nfs/dbraw/zinc/43/81/08/467438108.db2.gz LXBUKLFOWMKZJM-MLGOLLRUSA-N 1 1 334.420 2.291 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H](C)[C@H]2CN)cccc1[N+](=O)[O-] ZINC000430553977 467438111 /nfs/dbraw/zinc/43/81/11/467438111.db2.gz LXBUKLFOWMKZJM-MLGOLLRUSA-N 1 1 334.420 2.291 20 5 EEBDMO COc1ccccc1CCNC(=O)C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000435751268 467493415 /nfs/dbraw/zinc/49/34/15/467493415.db2.gz FMVHBTJORICJNK-UHFFFAOYSA-N 1 1 349.412 2.113 20 5 EEBDMO CNc1nc(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000454709286 467611147 /nfs/dbraw/zinc/61/11/47/467611147.db2.gz HKXGCERQVZQUBS-NWDGAFQWSA-N 1 1 335.408 2.024 20 5 EEBDMO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCCN2CCCO)c(Cl)c1 ZINC000449388186 467635756 /nfs/dbraw/zinc/63/57/56/467635756.db2.gz OLMJEGBEKCJEDT-CQSZACIVSA-N 1 1 327.812 2.185 20 5 EEBDMO O=[N+]([O-])c1ccc(CNC[C@H]2CCC[N@@H+]2CCCO)c(Cl)c1 ZINC000449388186 467635755 /nfs/dbraw/zinc/63/57/55/467635755.db2.gz OLMJEGBEKCJEDT-CQSZACIVSA-N 1 1 327.812 2.185 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000458459063 467838610 /nfs/dbraw/zinc/83/86/10/467838610.db2.gz PHIQXBHPCOHWNQ-OAHLLOKOSA-N 1 1 334.420 2.261 20 5 EEBDMO COc1cc(NC[C@H]2CCC[N@H+]2CCCO)c(F)cc1[N+](=O)[O-] ZINC000450587970 467874847 /nfs/dbraw/zinc/87/48/47/467874847.db2.gz AMWJRLQBXCJSFK-LLVKDONJSA-N 1 1 327.356 2.001 20 5 EEBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)C2)C1 ZINC000590456374 468261234 /nfs/dbraw/zinc/26/12/34/468261234.db2.gz ARHIMNAOQVLYJG-KRWDZBQOSA-N 1 1 328.372 2.244 20 5 EEBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000594201693 468511330 /nfs/dbraw/zinc/51/13/30/468511330.db2.gz PGPZXFMAUZPWKO-STQMWFEESA-N 1 1 347.371 2.070 20 5 EEBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594217081 468516224 /nfs/dbraw/zinc/51/62/24/468516224.db2.gz OWHSDBYPZWQSHB-IAGOWNOFSA-N 1 1 346.431 2.453 20 5 EEBDMO C[N@H+]1CCCC[C@H](CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000600316285 468531209 /nfs/dbraw/zinc/53/12/09/468531209.db2.gz YXFOAINGGGOKAU-CQSZACIVSA-N 1 1 344.415 2.398 20 5 EEBDMO CNc1c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-] ZINC000594418833 468579734 /nfs/dbraw/zinc/57/97/34/468579734.db2.gz MFMHRGDZZQDXLU-KBPBESRZSA-N 1 1 332.404 2.383 20 5 EEBDMO COc1cc(C(=O)N2CCC[C@@]3(CC[N@@H+](C)C3)C2)cc([N+](=O)[O-])c1C ZINC000597712074 468648309 /nfs/dbraw/zinc/64/83/09/468648309.db2.gz ZPATXAMGAAFYBK-SFHVURJKSA-N 1 1 347.415 2.470 20 5 EEBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)CCc1cccc([N+](=O)[O-])c1)C2 ZINC000597716649 468649131 /nfs/dbraw/zinc/64/91/31/468649131.db2.gz RCXMAZOWBAWHNA-SFHVURJKSA-N 1 1 331.416 2.472 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000597854645 468694221 /nfs/dbraw/zinc/69/42/21/468694221.db2.gz KMMRZEWOCWCZOJ-ZDUSSCGKSA-N 1 1 335.404 2.210 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1CCC([C@H](C)CO)CC1 ZINC000593085855 468865323 /nfs/dbraw/zinc/86/53/23/468865323.db2.gz YAKPAOOQYONMMI-CYBMUJFWSA-N 1 1 335.404 2.182 20 5 EEBDMO COC(=O)[C@H](Cc1ccccc1)[C@H](C)[NH2+]Cc1onc(C)c1[N+](=O)[O-] ZINC000595476310 468868938 /nfs/dbraw/zinc/86/89/38/468868938.db2.gz NDVQKFICAOOSHH-SMDDNHRTSA-N 1 1 347.371 2.401 20 5 EEBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])NCc1c[nH+]c2n1CCCC2 ZINC000593152034 468888863 /nfs/dbraw/zinc/88/88/63/468888863.db2.gz VYEBJWHROXVZED-UHFFFAOYSA-N 1 1 332.335 2.126 20 5 EEBDMO Cc1ccc(S(=O)(=O)N[C@H](C)C[N@H+](C)C(C)C)c(C)c1[N+](=O)[O-] ZINC000598613137 468933198 /nfs/dbraw/zinc/93/31/98/468933198.db2.gz GECIAFUXSRDABX-GFCCVEGCSA-N 1 1 343.449 2.219 20 5 EEBDMO CC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C[C@H]1COc2ccccc2O1 ZINC000610704522 469043910 /nfs/dbraw/zinc/04/39/10/469043910.db2.gz ZYGOFVHUUSBBIF-AWEZNQCLSA-N 1 1 346.387 2.262 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@@H](C)[C@@](C)(CO)C2)cccc1[N+](=O)[O-] ZINC000595880414 469060321 /nfs/dbraw/zinc/06/03/21/469060321.db2.gz YVDOEZNZIMYROK-BTJLNZGRSA-N 1 1 335.404 2.181 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@@H](C)[C@@](C)(CO)C2)cccc1[N+](=O)[O-] ZINC000595880414 469060326 /nfs/dbraw/zinc/06/03/26/469060326.db2.gz YVDOEZNZIMYROK-BTJLNZGRSA-N 1 1 335.404 2.181 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCN(c2cccc(F)c2)C[C@@H]1C ZINC000602843060 469110717 /nfs/dbraw/zinc/11/07/17/469110717.db2.gz YOVBOHKCIXGBAL-ZDUSSCGKSA-N 1 1 347.394 2.450 20 5 EEBDMO COCC[N@@H+](C)CCNc1c(Br)cccc1[N+](=O)[O-] ZINC000596103781 469155677 /nfs/dbraw/zinc/15/56/77/469155677.db2.gz GLRPULQZBLXILU-UHFFFAOYSA-N 1 1 332.198 2.347 20 5 EEBDMO C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC[C@H]1C(=O)OC(C)(C)C ZINC000599588776 469301323 /nfs/dbraw/zinc/30/13/23/469301323.db2.gz KLLKTYUHPSPGMZ-GXTWGEPZSA-N 1 1 338.408 2.091 20 5 EEBDMO C[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@H](C)[NH+]1CCOCC1 ZINC000611706330 469306322 /nfs/dbraw/zinc/30/63/22/469306322.db2.gz IWCZIQBLLLQVRR-RYUDHWBXSA-N 1 1 331.376 2.059 20 5 EEBDMO Cn1ccnc1[C@@H](C1CC1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000602474722 469332126 /nfs/dbraw/zinc/33/21/26/469332126.db2.gz RKUKETNFEAUIIF-XJKSGUPXSA-N 1 1 342.403 2.361 20 5 EEBDMO Cn1ccnc1[C@@H](C1CC1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000602474722 469332129 /nfs/dbraw/zinc/33/21/29/469332129.db2.gz RKUKETNFEAUIIF-XJKSGUPXSA-N 1 1 342.403 2.361 20 5 EEBDMO C[C@H]1COCC[N@H+]1C1CCN(c2c(Cl)cncc2[N+](=O)[O-])CC1 ZINC000603399441 469377197 /nfs/dbraw/zinc/37/71/97/469377197.db2.gz ASNUSBFYRFDSAE-NSHDSACASA-N 1 1 340.811 2.333 20 5 EEBDMO CCc1nn(C)c(N2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)c1[N+](=O)[O-] ZINC000603414688 469387216 /nfs/dbraw/zinc/38/72/16/469387216.db2.gz AKROHXIOQJFRSG-GJZGRUSLSA-N 1 1 341.415 2.354 20 5 EEBDMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CCc3cn[nH]c3C2)n1 ZINC000618571440 469393330 /nfs/dbraw/zinc/39/33/30/469393330.db2.gz QISVHTCLFVXBSW-VNHYZAJKSA-N 1 1 330.392 2.145 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000619578443 469644277 /nfs/dbraw/zinc/64/42/77/469644277.db2.gz IDECMKQOCOEZMI-NSHDSACASA-N 1 1 331.376 2.027 20 5 EEBDMO CC[C@H]1C[N@H+](C)CCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000619578443 469644278 /nfs/dbraw/zinc/64/42/78/469644278.db2.gz IDECMKQOCOEZMI-NSHDSACASA-N 1 1 331.376 2.027 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000619578443 469644280 /nfs/dbraw/zinc/64/42/80/469644280.db2.gz IDECMKQOCOEZMI-NSHDSACASA-N 1 1 331.376 2.027 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2C[C@@H]3CC[C@H](O)C[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000595633832 485607250 /nfs/dbraw/zinc/60/72/50/485607250.db2.gz AQSLZPATTPIPBA-BARDWOONSA-N 1 1 347.415 2.323 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CCOC3(CCC3)C2)c([N+](=O)[O-])c1 ZINC000154115972 534067305 /nfs/dbraw/zinc/06/73/05/534067305.db2.gz QMWVOSMGAXXSRM-UHFFFAOYSA-N 1 1 349.387 2.187 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CC[C@@H](O)C2)n1 ZINC000181143130 534327069 /nfs/dbraw/zinc/32/70/69/534327069.db2.gz CBZXZHDKOGSWTO-MRXNPFEDSA-N 1 1 342.399 2.477 20 5 EEBDMO CCCCNC(=O)C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174241111 528504623 /nfs/dbraw/zinc/50/46/23/528504623.db2.gz UHCUPWYGHOPTRE-UHFFFAOYSA-N 1 1 335.404 2.354 20 5 EEBDMO CCOCC[NH+]1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000174734276 528754817 /nfs/dbraw/zinc/75/48/17/528754817.db2.gz UWTFVMHTXSXDRC-UHFFFAOYSA-N 1 1 345.346 2.355 20 5 EEBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000246681020 535519452 /nfs/dbraw/zinc/51/94/52/535519452.db2.gz CFFHNZZNWHDDGB-WMLDXEAASA-N 1 1 349.431 2.462 20 5 EEBDMO CCC[N@@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1CC1 ZINC000728903140 576558560 /nfs/dbraw/zinc/55/85/60/576558560.db2.gz TUIRLCYRGQLHDV-UHFFFAOYSA-N 1 1 332.360 2.195 20 5 EEBDMO Cc1nn(CN2CCC(Oc3cc[nH+]cc3C)CC2)cc1[N+](=O)[O-] ZINC000773340542 577334695 /nfs/dbraw/zinc/33/46/95/577334695.db2.gz PHRSCFYPCCDBOY-UHFFFAOYSA-N 1 1 331.376 2.304 20 5 EEBDMO C[C@@H](O)C[C@H]1CCC[N@H+]1CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000752813959 577776641 /nfs/dbraw/zinc/77/66/41/577776641.db2.gz VWBKEXNGIABNEK-ZIAGYGMSSA-N 1 1 348.403 2.030 20 5 EEBDMO C[C@@H](C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741021373 578111471 /nfs/dbraw/zinc/11/14/71/578111471.db2.gz DJKBPENXHVLGLJ-XQQFMLRXSA-N 1 1 349.387 2.338 20 5 EEBDMO C[C@@H](C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741021373 578111472 /nfs/dbraw/zinc/11/14/72/578111472.db2.gz DJKBPENXHVLGLJ-XQQFMLRXSA-N 1 1 349.387 2.338 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CNC(=S)NCCc1ccccc1[N+](=O)[O-] ZINC000741870421 578125435 /nfs/dbraw/zinc/12/54/35/578125435.db2.gz SXDMDMPRIDKDSH-AWEZNQCLSA-N 1 1 336.461 2.086 20 5 EEBDMO Cc1cc(C)c(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)c1 ZINC001022063695 676628144 /nfs/dbraw/zinc/62/81/44/676628144.db2.gz HPCIRNHAMQUPOP-JYYAWHABSA-N 1 1 331.416 2.014 20 5 EEBDMO C[C@@H]1C[C@@H](Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000892875651 683159170 /nfs/dbraw/zinc/15/91/70/683159170.db2.gz HPPZRFNXINAJIO-VXGBXAGGSA-N 1 1 342.399 2.484 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C[C@H]1C ZINC000893050710 683642360 /nfs/dbraw/zinc/64/23/60/683642360.db2.gz MSSCTRXCSCLUPK-CHWSQXEVSA-N 1 1 344.415 2.366 20 5 EEBDMO C[C@]1(CO)C[C@@H](O)C[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000895330349 684505836 /nfs/dbraw/zinc/50/58/36/684505836.db2.gz LJYFSRKUKHVKQZ-GDBMZVCRSA-N 1 1 349.412 2.036 20 5 EEBDMO C[C@]1(CO)C[C@@H](O)C[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000895330349 684505839 /nfs/dbraw/zinc/50/58/39/684505839.db2.gz LJYFSRKUKHVKQZ-GDBMZVCRSA-N 1 1 349.412 2.036 20 5 EEBDMO C[C@H]1C[N@@H+](CCCOC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc32)CCO1 ZINC000893392996 685244104 /nfs/dbraw/zinc/24/41/04/685244104.db2.gz WCXOMUTVTQEYJA-LBPRGKRZSA-N 1 1 347.371 2.344 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCOC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc32)CCO1 ZINC000893392993 685244640 /nfs/dbraw/zinc/24/46/40/685244640.db2.gz WCXOMUTVTQEYJA-GFCCVEGCSA-N 1 1 347.371 2.344 20 5 EEBDMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N1CCN(c2[nH]cc[nH+]2)CC1 ZINC000893521859 692956005 /nfs/dbraw/zinc/95/60/05/692956005.db2.gz 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CO[C@@]1(C)C[C@H]([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1(C)C ZINC000072897777 216325585 /nfs/dbraw/zinc/32/55/85/216325585.db2.gz XLFFBCQJNAZJCS-YOEHRIQHSA-N 1 1 335.404 2.329 20 5 EEBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000421713489 240021424 /nfs/dbraw/zinc/02/14/24/240021424.db2.gz STHUUXFCBZIITN-CQSZACIVSA-N 1 1 330.388 2.171 20 5 EEBDMO Cc1c(CC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000133206367 223396810 /nfs/dbraw/zinc/39/68/10/223396810.db2.gz JVNMPINAGLKOCI-WBVHZDCISA-N 1 1 331.416 2.388 20 5 EEBDMO C[C@@H]1CN(CC[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000451542804 243151355 /nfs/dbraw/zinc/15/13/55/243151355.db2.gz AFZWQBIWXHZHRK-NVXWUHKLSA-N 1 1 333.432 2.495 20 5 EEBDMO C[C@H](c1cc(F)ccc1F)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266410010 248286489 /nfs/dbraw/zinc/28/64/89/248286489.db2.gz GISPNORVRPBBIZ-ZWNOBZJWSA-N 1 1 340.330 2.123 20 5 EEBDMO 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CC(C)(C)[C@@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(N)=O ZINC000119943272 273501107 /nfs/dbraw/zinc/50/11/07/273501107.db2.gz KVZJTVYXVICFFU-ZDUSSCGKSA-N 1 1 332.360 2.239 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[NH+]1CCSCC1 ZINC000274237461 274187416 /nfs/dbraw/zinc/18/74/16/274187416.db2.gz FXAIALNUGJVVMW-UHFFFAOYSA-N 1 1 338.433 2.382 20 5 EEBDMO C[C@H]1CN(c2ccc3ncccc3c2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000275390709 274245020 /nfs/dbraw/zinc/24/50/20/274245020.db2.gz ARMPKFFYWSXKOK-ZDUSSCGKSA-N 1 1 344.415 2.424 20 5 EEBDMO COCc1cc([N+](=O)[O-])ccc1N1CC[N@@H+](CC(C)(C)O)[C@@H](C)C1 ZINC000275657110 274258625 /nfs/dbraw/zinc/25/86/25/274258625.db2.gz YDKMLDQMHJTBSB-ZDUSSCGKSA-N 1 1 337.420 2.023 20 5 EEBDMO O=C(CNc1ccccc1[N+](=O)[O-])NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000277393912 274287932 /nfs/dbraw/zinc/28/79/32/274287932.db2.gz ASNHRYFDVGUJII-AWEZNQCLSA-N 1 1 332.404 2.140 20 5 EEBDMO COCCC[N@@H+](C)CCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278460014 274358785 /nfs/dbraw/zinc/35/87/85/274358785.db2.gz SREQUBXSPQDKCK-UHFFFAOYSA-N 1 1 336.314 2.389 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@]3(CCO)CCOC3)cs2)c1 ZINC000278480111 274362772 /nfs/dbraw/zinc/36/27/72/274362772.db2.gz JDNLJXLTBVYHRP-MRXNPFEDSA-N 1 1 349.412 2.349 20 5 EEBDMO CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000289661417 275136815 /nfs/dbraw/zinc/13/68/15/275136815.db2.gz FKGDRKJNPLJXHZ-CQSZACIVSA-N 1 1 335.404 2.473 20 5 EEBDMO COCC[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC1 ZINC000289675295 275138193 /nfs/dbraw/zinc/13/81/93/275138193.db2.gz MXZREZWJPMQSJF-UHFFFAOYSA-N 1 1 342.783 2.044 20 5 EEBDMO CC1(C)C[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]1[C@H]1CCCO1 ZINC000290001615 275169525 /nfs/dbraw/zinc/16/95/25/275169525.db2.gz ZBFRDFPHCSXQDD-HUUCEWRRSA-N 1 1 333.388 2.083 20 5 EEBDMO CC1(C)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]1[C@H]1CCCO1 ZINC000290001615 275169526 /nfs/dbraw/zinc/16/95/26/275169526.db2.gz ZBFRDFPHCSXQDD-HUUCEWRRSA-N 1 1 333.388 2.083 20 5 EEBDMO C[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000290887779 275249417 /nfs/dbraw/zinc/24/94/17/275249417.db2.gz CPRPCAZGGGWELU-LBPRGKRZSA-N 1 1 343.387 2.021 20 5 EEBDMO O=C(c1cc(C[NH+]2CCCC2)on1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000291383476 275300139 /nfs/dbraw/zinc/30/01/39/275300139.db2.gz BSQIJEJFFPLOOD-UHFFFAOYSA-N 1 1 342.355 2.382 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](n3cccn3)C2)cccc1[N+](=O)[O-] ZINC000291756870 275337233 /nfs/dbraw/zinc/33/72/33/275337233.db2.gz KXVWGLGYSCXOCE-UONOGXRCSA-N 1 1 343.387 2.374 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](n3cccn3)C2)cccc1[N+](=O)[O-] ZINC000291756870 275337235 /nfs/dbraw/zinc/33/72/35/275337235.db2.gz KXVWGLGYSCXOCE-UONOGXRCSA-N 1 1 343.387 2.374 20 5 EEBDMO C[N@H+]1CCC[C@H](N2CCN(c3cc(Cl)ccc3[N+](=O)[O-])CC2)C1 ZINC000376173243 277074159 /nfs/dbraw/zinc/07/41/59/277074159.db2.gz NLCKVFMBRNTVDY-AWEZNQCLSA-N 1 1 338.839 2.464 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](C[N@@H+](C)CC)C2)c1 ZINC000284059481 293024227 /nfs/dbraw/zinc/02/42/27/293024227.db2.gz QWTDWPPEQPTSKS-ZDUSSCGKSA-N 1 1 335.404 2.407 20 5 EEBDMO Cc1cc(OCC(=O)N2C[C@H]3CCCC[N@@H+]3C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000332465564 312011580 /nfs/dbraw/zinc/01/15/80/312011580.db2.gz IVTDRROBQQADJT-LSDHHAIUSA-N 1 1 347.415 2.367 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000332485391 312014467 /nfs/dbraw/zinc/01/44/67/312014467.db2.gz NKTBHVODBWJLHN-KSSFIOAISA-N 1 1 347.415 2.469 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000332485391 312014469 /nfs/dbraw/zinc/01/44/69/312014469.db2.gz NKTBHVODBWJLHN-KSSFIOAISA-N 1 1 347.415 2.469 20 5 EEBDMO CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@@H]1CCC[N@H+]1C ZINC000420996634 314019300 /nfs/dbraw/zinc/01/93/00/314019300.db2.gz GAZXQEGCLCTJEP-AWEZNQCLSA-N 1 1 331.376 2.171 20 5 EEBDMO C[C@@H]1C[C@H](C(=O)OC(C)(C)C)C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC000421025490 314029035 /nfs/dbraw/zinc/02/90/35/314029035.db2.gz QXZLJVCZDCRGRN-OLZOCXBDSA-N 1 1 338.408 2.091 20 5 EEBDMO C[C@@H](C(=O)N1CCC[C@H]2C[N@@H+](C)C[C@H]21)c1ccc([N+](=O)[O-])cc1F ZINC000425067872 314328294 /nfs/dbraw/zinc/32/82/94/314328294.db2.gz SAGXEFDNZWVXGC-BFQNTYOBSA-N 1 1 335.379 2.390 20 5 EEBDMO CC(C)(C)[C@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])C(N)=O ZINC000425413728 314388853 /nfs/dbraw/zinc/38/88/53/314388853.db2.gz HMHAYIHPJBVMNR-LLVKDONJSA-N 1 1 344.209 2.347 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccc4c[nH]nc4c3)CC2)cn1 ZINC000535785853 317982227 /nfs/dbraw/zinc/98/22/27/317982227.db2.gz YOYJDZCWRYDMIZ-UHFFFAOYSA-N 1 1 338.371 2.188 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCc2c[nH+]c(C)n2C1 ZINC000563286396 318992751 /nfs/dbraw/zinc/99/27/51/318992751.db2.gz UBJPGVIBLANYBP-LLVKDONJSA-N 1 1 329.360 2.343 20 5 EEBDMO CC1(C)CC[N@@H+](CC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000578336621 320308741 /nfs/dbraw/zinc/30/87/41/320308741.db2.gz LCBKRQMITGYETC-UHFFFAOYSA-N 1 1 344.415 2.467 20 5 EEBDMO CSC[C@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182034800 323362710 /nfs/dbraw/zinc/36/27/10/323362710.db2.gz HQTNIOKAUASWRK-OLZOCXBDSA-N 1 1 326.418 2.162 20 5 EEBDMO CCOC(=O)C[C@@H](C)[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000182660329 323382888 /nfs/dbraw/zinc/38/28/88/323382888.db2.gz MKSXITBWKWQCOH-LLVKDONJSA-N 1 1 348.359 2.418 20 5 EEBDMO CCOC(=O)C[C@@H](C)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000182660329 323382891 /nfs/dbraw/zinc/38/28/91/323382891.db2.gz MKSXITBWKWQCOH-LLVKDONJSA-N 1 1 348.359 2.418 20 5 EEBDMO CNc1c(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000326429598 465038734 /nfs/dbraw/zinc/03/87/34/465038734.db2.gz OKGYAZZKDHPFDV-OCCSQVGLSA-N 1 1 332.404 2.193 20 5 EEBDMO CC[C@@H](c1ccccc1OC)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000347553602 465089997 /nfs/dbraw/zinc/08/99/97/465089997.db2.gz DESAHUGJFAXUCJ-HOCLYGCPSA-N 1 1 348.403 2.244 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCc2ccc(O)cc2C1 ZINC000342758110 465347016 /nfs/dbraw/zinc/34/70/16/465347016.db2.gz VQFLRWMZEYZBSK-MRXNPFEDSA-N 1 1 344.367 2.098 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCc2ccc(O)cc2C1 ZINC000342758110 465347024 /nfs/dbraw/zinc/34/70/24/465347024.db2.gz VQFLRWMZEYZBSK-MRXNPFEDSA-N 1 1 344.367 2.098 20 5 EEBDMO COc1cc(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000074317052 462583929 /nfs/dbraw/zinc/58/39/29/462583929.db2.gz QIOJJSSOCDEFJP-CQSZACIVSA-N 1 1 347.415 2.407 20 5 EEBDMO CC(C)OCC[NH+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1 ZINC000074390216 462593822 /nfs/dbraw/zinc/59/38/22/462593822.db2.gz XCPLGSXFTNAELG-VMPITWQZSA-N 1 1 347.415 2.177 20 5 EEBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2NC[C@@H]1CCC[N@@H+](C)C1 ZINC000590689634 468306955 /nfs/dbraw/zinc/30/69/55/468306955.db2.gz NCAMMANSZXXRQX-LBPRGKRZSA-N 1 1 330.388 2.327 20 5 EEBDMO CC[N@@H+]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C[C@@H]1C ZINC000590690869 468308403 /nfs/dbraw/zinc/30/84/03/468308403.db2.gz IUHSEDLUUUTJDI-LBPRGKRZSA-N 1 1 343.387 2.151 20 5 EEBDMO CC[N@H+]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C[C@@H]1C ZINC000590690869 468308410 /nfs/dbraw/zinc/30/84/10/468308410.db2.gz IUHSEDLUUUTJDI-LBPRGKRZSA-N 1 1 343.387 2.151 20 5 EEBDMO Cc1c(C(=O)N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)cccc1[N+](=O)[O-] ZINC000046047914 462641390 /nfs/dbraw/zinc/64/13/90/462641390.db2.gz DKMGUORRSSTYFW-HNNXBMFYSA-N 1 1 347.415 2.230 20 5 EEBDMO CC[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000046063610 462643563 /nfs/dbraw/zinc/64/35/63/462643563.db2.gz LCGFQPBRCCIYQV-HNNXBMFYSA-N 1 1 342.399 2.490 20 5 EEBDMO C[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000153472487 462654895 /nfs/dbraw/zinc/65/48/95/462654895.db2.gz UVZRFLXXJRVQPT-GFCCVEGCSA-N 1 1 328.372 2.215 20 5 EEBDMO CC(C)(C)[N@H+]1CCCN(C(=O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000063723094 462666529 /nfs/dbraw/zinc/66/65/29/462666529.db2.gz GNYBLFBGOGFNHO-UHFFFAOYSA-N 1 1 335.404 2.306 20 5 EEBDMO Cn1cc[nH+]c1N1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000075053029 462668511 /nfs/dbraw/zinc/66/85/11/462668511.db2.gz IEZSTKJXOKUDDE-UHFFFAOYSA-N 1 1 338.371 2.203 20 5 EEBDMO C[C@H](C[NH+]1CCCCC1)Nc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000089619980 462699228 /nfs/dbraw/zinc/69/92/28/462699228.db2.gz UVOLJMYLGCMGGM-GFCCVEGCSA-N 1 1 341.433 2.285 20 5 EEBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000115433815 462713395 /nfs/dbraw/zinc/71/33/95/462713395.db2.gz VQWSUKNSOCBIQE-LBPRGKRZSA-N 1 1 330.388 2.490 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000065674437 462817615 /nfs/dbraw/zinc/81/76/15/462817615.db2.gz VTFCIOIFHVQSDD-KGLIPLIRSA-N 1 1 335.404 2.210 20 5 EEBDMO CC(C)CO[C@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000119651614 462920329 /nfs/dbraw/zinc/92/03/29/462920329.db2.gz XMBAQGXRHVCETD-INIZCTEOSA-N 1 1 347.415 2.231 20 5 EEBDMO CC(C)CO[C@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000119651614 462920332 /nfs/dbraw/zinc/92/03/32/462920332.db2.gz XMBAQGXRHVCETD-INIZCTEOSA-N 1 1 347.415 2.231 20 5 EEBDMO CCc1nn(C)c(NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000092827750 462983092 /nfs/dbraw/zinc/98/30/92/462983092.db2.gz KKKLIJZXRCXYFR-RYUDHWBXSA-N 1 1 339.440 2.190 20 5 EEBDMO CCCNC(=O)[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000050995551 463014847 /nfs/dbraw/zinc/01/48/47/463014847.db2.gz MPBYMGSZFGCWIE-CQSZACIVSA-N 1 1 335.404 2.212 20 5 EEBDMO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)CN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000120897668 463052364 /nfs/dbraw/zinc/05/23/64/463052364.db2.gz NZQNIVADCCNIHS-GOEBONIOSA-N 1 1 334.464 2.437 20 5 EEBDMO Cc1cc([C@@H]2CCC[N@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)on1 ZINC000052007535 463057612 /nfs/dbraw/zinc/05/76/12/463057612.db2.gz GDHMDWFJFYIYAO-HOCLYGCPSA-N 1 1 347.371 2.468 20 5 EEBDMO 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O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@@H]([C@H]4CCOC4)C3)n2)cc1 ZINC000749802565 577982221 /nfs/dbraw/zinc/98/22/21/577982221.db2.gz YFGMHXXSBCCKAJ-CABCVRRESA-N 1 1 343.387 2.169 20 5 EEBDMO Cc1nn(C[N@@H+](C[C@H]2CCOC2)C2CC2)c2ncc([N+](=O)[O-])cc12 ZINC000749938407 577984082 /nfs/dbraw/zinc/98/40/82/577984082.db2.gz KQZKUFBGFIIPFE-GFCCVEGCSA-N 1 1 331.376 2.106 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(O)c(OC)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000892106468 678010105 /nfs/dbraw/zinc/01/01/05/678010105.db2.gz VVWMDNNCUICVRS-JSGCOSHPSA-N 1 1 337.420 2.471 20 5 EEBDMO CC(C)[N@@H+](C)CCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000159103709 684158096 /nfs/dbraw/zinc/15/80/96/684158096.db2.gz GMJJOPRHFILSFE-UHFFFAOYSA-N 1 1 344.209 2.427 20 5 EEBDMO C[C@H](Nc1nccc2c1cccc2[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C ZINC000895245608 684372287 /nfs/dbraw/zinc/37/22/87/684372287.db2.gz GVYYFUCJRCWUQB-LRDDRELGSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1nccc2c1cccc2[N+](=O)[O-])[C@@H]1CN(C)CC[N@@H+]1C ZINC000895245608 684372292 /nfs/dbraw/zinc/37/22/92/684372292.db2.gz GVYYFUCJRCWUQB-LRDDRELGSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1nccc2c1cccc2[N+](=O)[O-])[C@@H]1CN(C)CC[N@H+]1C ZINC000895245608 684372295 /nfs/dbraw/zinc/37/22/95/684372295.db2.gz GVYYFUCJRCWUQB-LRDDRELGSA-N 1 1 329.404 2.189 20 5 EEBDMO CC[C@H](C[NH+]1CCOCC1)Nc1ncnc2cccc([N+](=O)[O-])c21 ZINC000895802388 684730850 /nfs/dbraw/zinc/73/08/50/684730850.db2.gz RIICXTPLUTWUSC-GFCCVEGCSA-N 1 1 331.376 2.061 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C[C@@H]1CCCCS1(=O)=O ZINC000893516076 692878532 /nfs/dbraw/zinc/87/85/32/692878532.db2.gz YYAOVUFGFXJKBV-LBPRGKRZSA-N 1 1 332.809 2.305 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC([NH+]3CCOCC3)CC2)c1C ZINC000898798406 693461165 /nfs/dbraw/zinc/46/11/65/693461165.db2.gz CRWNBTSZAFLVOT-UHFFFAOYSA-N 1 1 347.415 2.148 20 5 EEBDMO O=C1OCCN1[C@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000865939070 1198431228 /nfs/dbraw/zinc/43/12/28/1198431228.db2.gz WRIOTOXPBKCWGC-LBPRGKRZSA-N 1 1 328.328 2.174 20 5 EEBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])[C@@H](C)C1 ZINC000825874015 1199617161 /nfs/dbraw/zinc/61/71/61/1199617161.db2.gz SKFVEXSQGIUAJI-LSDHHAIUSA-N 1 1 343.468 2.075 20 5 EEBDMO C[N@@H+](CCCO)C1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000217213741 1199743446 /nfs/dbraw/zinc/74/34/46/1199743446.db2.gz JJSLSEOCNADEDP-UHFFFAOYSA-N 1 1 325.384 2.013 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000878188754 1200311172 /nfs/dbraw/zinc/31/11/72/1200311172.db2.gz NYQCORBYNVTOHB-ZIAGYGMSSA-N 1 1 334.376 2.281 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)C[C@@H]2C1 ZINC000812338381 1200670615 /nfs/dbraw/zinc/67/06/15/1200670615.db2.gz LKDRTRJHUPRHOZ-NEPJUHHUSA-N 1 1 328.372 2.100 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C(C)(C)O)C1 ZINC000879961753 1201325679 /nfs/dbraw/zinc/32/56/79/1201325679.db2.gz HQMHPLFPSOGWSK-STQMWFEESA-N 1 1 335.404 2.405 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C(C)(C)O)C1 ZINC000879961753 1201325680 /nfs/dbraw/zinc/32/56/80/1201325680.db2.gz HQMHPLFPSOGWSK-STQMWFEESA-N 1 1 335.404 2.405 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@H](CF)C2)c([N+](=O)[O-])c1 ZINC000880298279 1201451001 /nfs/dbraw/zinc/45/10/01/1201451001.db2.gz XBQFLIXXTLDZCB-NSHDSACASA-N 1 1 325.340 2.223 20 5 EEBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])C1 ZINC000866282030 1201482892 /nfs/dbraw/zinc/48/28/92/1201482892.db2.gz LRFAIWZRRAESJJ-CQSZACIVSA-N 1 1 349.406 2.467 20 5 EEBDMO CCc1[nH+]ccn1Cc1cn(Cc2cc(F)ccc2[N+](=O)[O-])nn1 ZINC000881226589 1201661263 /nfs/dbraw/zinc/66/12/63/1201661263.db2.gz QXRZYKAPAKDPBE-UHFFFAOYSA-N 1 1 330.323 2.181 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC1CCN(c2cc(C)ccc2[N+](=O)[O-])CC1 ZINC001095427512 1205736942 /nfs/dbraw/zinc/73/69/42/1205736942.db2.gz FMTYDQPFIUFYCU-UHFFFAOYSA-N 1 1 348.447 2.330 20 5 EEBDMO CCOC(=O)[C@@H]1[C@H](C)C[C@@H](C)[N@@H+](CCn2ccc([N+](=O)[O-])n2)[C@H]1C ZINC000934161682 1207913833 /nfs/dbraw/zinc/91/38/33/1207913833.db2.gz GIYCFIQAAMDUDZ-GUIRCDHDSA-N 1 1 338.408 2.089 20 5 EEBDMO O=C(NC1CC2(C1)CC([NH2+]CC1=CCCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC000963789446 1218040472 /nfs/dbraw/zinc/04/04/72/1218040472.db2.gz ZHPPDXKADGSXJA-YVXVDGILSA-N 1 1 333.432 2.169 20 5 EEBDMO O=C(NCC1=CC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1)c1cc[nH]c1 ZINC001000717231 1240786411 /nfs/dbraw/zinc/78/64/11/1240786411.db2.gz KILAEKZQDFVQSL-UHFFFAOYSA-N 1 1 340.383 2.485 20 5 EEBDMO O=C(NCC1=CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1)c1cc[nH]c1 ZINC001000717231 1240786417 /nfs/dbraw/zinc/78/64/17/1240786417.db2.gz KILAEKZQDFVQSL-UHFFFAOYSA-N 1 1 340.383 2.485 20 5 EEBDMO Cc1ccc(N[C@H]2C[C@@H](NC(=O)C[N@H+](C)C3CCC3)C2)c([N+](=O)[O-])c1 ZINC001097261207 1243888460 /nfs/dbraw/zinc/88/84/60/1243888460.db2.gz UPUSIRUCVFIZMH-OKILXGFUSA-N 1 1 346.431 2.447 20 5 EEBDMO CCCSc1nc(O[C@@H]2C[NH2+]CCC[C@@H]2F)c([N+](=O)[O-])c(=O)[nH]1 ZINC001217977796 1297539857 /nfs/dbraw/zinc/53/98/57/1297539857.db2.gz BMCNGYMRFKLCFR-DTWKUNHWSA-N 1 1 346.384 2.061 20 5 EEBDMO C[N@H+]1CCC[C@@H](Oc2ccc3c(c2)oc2cc(=O)ccc-2[n+]3[O-])CC1 ZINC001227448502 1301832412 /nfs/dbraw/zinc/83/24/12/1301832412.db2.gz FOXNSHZYROGBOT-CQSZACIVSA-N 1 1 340.379 2.394 20 5 EEBDMO COC(=O)c1c(OC2CC[NH+](CCF)CC2)cccc1[N+](=O)[O-] ZINC001229047469 1302587781 /nfs/dbraw/zinc/58/77/81/1302587781.db2.gz ZZMTYORYRZYUKG-UHFFFAOYSA-N 1 1 326.324 2.194 20 5 EEBDMO COC(=O)c1cc(O[C@H]2CC[N@H+](C(C)C)C2)c(F)cc1[N+](=O)[O-] ZINC001229942705 1302993062 /nfs/dbraw/zinc/99/30/62/1302993062.db2.gz PSNLZLFDLJXXOC-JTQLQIEISA-N 1 1 326.324 2.382 20 5 EEBDMO Cc1cc([N+](=O)[O-])cnc1NC1(CNC(=O)C[N@H+](C)C(C)C)CCC1 ZINC001111814721 1303931621 /nfs/dbraw/zinc/93/16/21/1303931621.db2.gz YBHPLHAHHUNPEG-UHFFFAOYSA-N 1 1 349.435 2.089 20 5 EEBDMO Cc1nnsc1C(=O)NCCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001233818253 1304602772 /nfs/dbraw/zinc/60/27/72/1304602772.db2.gz DELPMDIZHNDMIS-UHFFFAOYSA-N 1 1 349.416 2.007 20 5 EEBDMO C[N@@H+](CCCNC(=O)CC(F)(F)F)Cc1ccccc1[N+](=O)[O-] ZINC001235044378 1305095540 /nfs/dbraw/zinc/09/55/40/1305095540.db2.gz TXDPWRQCWZZWSB-UHFFFAOYSA-N 1 1 333.310 2.485 20 5 EEBDMO COc1cc(N2CCC([NH2+]CC3(N)CCCC3)CC2)ccc1[N+](=O)[O-] ZINC001246076826 1310231090 /nfs/dbraw/zinc/23/10/90/1310231090.db2.gz QZBOZUNYRAGFLB-UHFFFAOYSA-N 1 1 348.447 2.433 20 5 EEBDMO O=[N+]([O-])c1cc(F)c(N2CCC(N[C@H]3CCC[NH2+]C3)CC2)c(F)c1 ZINC001246127615 1310242408 /nfs/dbraw/zinc/24/24/08/1310242408.db2.gz LLGQXORZLZUYFO-LBPRGKRZSA-N 1 1 340.374 2.183 20 5 EEBDMO COc1ccc(C[C@@H](C)N2CCC(F)(F)[C@@H]([NH3+])C2)c([N+](=O)[O-])c1 ZINC001246595564 1310353812 /nfs/dbraw/zinc/35/38/12/1310353812.db2.gz IHYNMFRJFHAREI-YGRLFVJLSA-N 1 1 329.347 2.203 20 5 EEBDMO O=[N+]([O-])CCc1nc(-c2ccc([C@H]3CCc4c[nH+]cn43)c(F)c2)no1 ZINC001247521218 1310627389 /nfs/dbraw/zinc/62/73/89/1310627389.db2.gz LCZGNROECIFRAU-CQSZACIVSA-N 1 1 343.318 2.427 20 5 EEBDMO CN(CC(=O)OCC[C@@H]1CCCC[N@H+]1C)c1ccccc1[N+](=O)[O-] ZINC000840237336 1315331940 /nfs/dbraw/zinc/33/19/40/1315331940.db2.gz JIWRJJSBHYIOMZ-AWEZNQCLSA-N 1 1 335.404 2.449 20 5 EEBDMO C[NH+](C)/C=C/c1cc(NCCOc2cccnc2)ncc1[N+](=O)[O-] ZINC001157813618 1318880513 /nfs/dbraw/zinc/88/05/13/1318880513.db2.gz LDZYTNTZWLBMFW-VMPITWQZSA-N 1 1 329.360 2.408 20 5 EEBDMO CCOC(=O)c1ccnc(N2CC[N@@H+](C(C)C)[C@@H](C)C2)c1[N+](=O)[O-] ZINC001158500966 1319273576 /nfs/dbraw/zinc/27/35/76/1319273576.db2.gz DXXYABMRTOOELN-LBPRGKRZSA-N 1 1 336.392 2.085 20 5 EEBDMO CCc1ccc(C[NH2+]CC2(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001164494286 1321395914 /nfs/dbraw/zinc/39/59/14/1321395914.db2.gz DBRUZHGTCILQIE-IAGOWNOFSA-N 1 1 345.443 2.290 20 5 EEBDMO Nc1cc(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001165084523 1321451835 /nfs/dbraw/zinc/45/18/35/1321451835.db2.gz LEOHZXRQSOUXPM-WMLDXEAASA-N 1 1 339.399 2.283 20 5 EEBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1ncc(Cl)cc1[N+](=O)[O-])CC2 ZINC001166032713 1321639674 /nfs/dbraw/zinc/63/96/74/1321639674.db2.gz REYVTJXSCIYWNT-UHFFFAOYSA-N 1 1 339.783 2.278 20 5 EEBDMO C[C@@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1CO ZINC001307967677 1331556706 /nfs/dbraw/zinc/55/67/06/1331556706.db2.gz PWJUGNFBCUHESD-BXUZGUMPSA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1CO ZINC001307967677 1331556709 /nfs/dbraw/zinc/55/67/09/1331556709.db2.gz PWJUGNFBCUHESD-BXUZGUMPSA-N 1 1 332.360 2.238 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001318829991 1332605846 /nfs/dbraw/zinc/60/58/46/1332605846.db2.gz ZDFXBOCCMVMICT-JKSUJKDBSA-N 1 1 330.388 2.247 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001322194421 1333225538 /nfs/dbraw/zinc/22/55/38/1333225538.db2.gz LNKWGXRGGXFYSG-GJZGRUSLSA-N 1 1 330.388 2.247 20 5 EEBDMO CCc1ccc(S(=O)(=O)Nc2cc(C)[nH+]c(C)c2)cc1[N+](=O)[O-] ZINC001326985723 1334197041 /nfs/dbraw/zinc/19/70/41/1334197041.db2.gz XAGKBKWVDLVFLI-UHFFFAOYSA-N 1 1 335.385 2.392 20 5 EEBDMO CCC[C@H]([NH2+]CC[N+](=O)[O-])C(=O)Nc1cccc(N2CCCC2)c1 ZINC001335409456 1336372209 /nfs/dbraw/zinc/37/22/09/1336372209.db2.gz UDDKTNCFDUHPGS-INIZCTEOSA-N 1 1 334.420 2.260 20 5 EEBDMO CC[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3C)n2C)C[C@H]1C ZINC001338152358 1336803790 /nfs/dbraw/zinc/80/37/90/1336803790.db2.gz DSUWMYUKUCMLDD-GFCCVEGCSA-N 1 1 344.419 2.229 20 5 EEBDMO CCn1cc(Cl)c(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)n1 ZINC001578347913 1344267130 /nfs/dbraw/zinc/26/71/30/1344267130.db2.gz HBGDGKTVSHZLHP-CQSZACIVSA-N 1 1 337.767 2.277 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H]2CC[C@@]21CN ZINC001579642876 1344402458 /nfs/dbraw/zinc/40/24/58/1344402458.db2.gz ZWOXYVUKONXYQB-SUMWQHHRSA-N 1 1 332.404 2.045 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]2CC[C@@]21CN ZINC001579642876 1344402461 /nfs/dbraw/zinc/40/24/61/1344402461.db2.gz ZWOXYVUKONXYQB-SUMWQHHRSA-N 1 1 332.404 2.045 20 5 EEBDMO CC(C)C[N@@H+](C)CCCNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] ZINC001589614310 1349012100 /nfs/dbraw/zinc/01/21/00/1349012100.db2.gz TTXUGZIWXKUGEH-UHFFFAOYSA-N 1 1 333.396 2.165 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590733070 1349393232 /nfs/dbraw/zinc/39/32/32/1349393232.db2.gz URHHOKDQIBACMX-LLVKDONJSA-N 1 1 331.380 2.061 20 5 EEBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CCS1 ZINC001604110561 1350861567 /nfs/dbraw/zinc/86/15/67/1350861567.db2.gz YNYSNXPBRQNRPO-LBPRGKRZSA-N 1 1 334.405 2.102 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CCc1ccc(-c3nn[nH]n3)cc1)C2 ZINC001607083325 1351410972 /nfs/dbraw/zinc/41/09/72/1351410972.db2.gz BSIWSOVVLARSBO-UHFFFAOYSA-N 1 1 336.355 2.333 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCc1ccc(-c3nn[nH]n3)cc1)C2 ZINC001607083325 1351410974 /nfs/dbraw/zinc/41/09/74/1351410974.db2.gz BSIWSOVVLARSBO-UHFFFAOYSA-N 1 1 336.355 2.333 20 5 EEBDMO O=[N+]([O-])c1sc(-c2nn[nH]n2)cc1NC[C@H]1CCCC[N@@H+]1C1CC1 ZINC001607087941 1351413561 /nfs/dbraw/zinc/41/35/61/1351413561.db2.gz BHLCFXWALPFPEK-SNVBAGLBSA-N 1 1 349.420 2.265 20 5 EEBDMO O=[N+]([O-])c1sc(-c2nn[nH]n2)cc1NC[C@H]1CCCC[N@H+]1C1CC1 ZINC001607087941 1351413562 /nfs/dbraw/zinc/41/35/62/1351413562.db2.gz BHLCFXWALPFPEK-SNVBAGLBSA-N 1 1 349.420 2.265 20 5 EEBDMO CC(C)C[N@@H+]1CCO[C@H](CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000815553449 1368032910 /nfs/dbraw/zinc/03/29/10/1368032910.db2.gz ANMOQTWQGVMGNK-UKRRQHHQSA-N 1 1 336.436 2.184 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@H](CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000815553449 1368032912 /nfs/dbraw/zinc/03/29/12/1368032912.db2.gz ANMOQTWQGVMGNK-UKRRQHHQSA-N 1 1 336.436 2.184 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)nc1-c1ccccn1 ZINC000853511206 1369343342 /nfs/dbraw/zinc/34/33/42/1369343342.db2.gz KKAMTANAIZQIBH-GDBMZVCRSA-N 1 1 343.387 2.454 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)nc1-c1ccccn1 ZINC000853511206 1369343346 /nfs/dbraw/zinc/34/33/46/1369343346.db2.gz KKAMTANAIZQIBH-GDBMZVCRSA-N 1 1 343.387 2.454 20 5 EEBDMO CC(C)Cc1cc(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)n(C)n1 ZINC001575648470 1403554511 /nfs/dbraw/zinc/55/45/11/1403554511.db2.gz MAXKERHBARFZJC-QGZVFWFLSA-N 1 1 345.403 2.339 20 5 EEBDMO CC1CC[NH+](CCCNC(=O)[C@@](C)(N)c2cccc([N+](=O)[O-])c2)CC1 ZINC001576731225 1403600462 /nfs/dbraw/zinc/60/04/62/1403600462.db2.gz GVQIUROXTOELEC-SFHVURJKSA-N 1 1 348.447 2.007 20 5 EEBDMO C[N@H+]1CCO[C@@H]2CN(c3nc4ccccc4c(Cl)c3[N+](=O)[O-])C[C@H]21 ZINC001164664314 719388628 /nfs/dbraw/zinc/38/86/28/719388628.db2.gz AZUGJYIANZJVNH-CHWSQXEVSA-N 1 1 348.790 2.316 20 5 EEBDMO O=[N+]([O-])c1cccc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164786526 721398383 /nfs/dbraw/zinc/39/83/83/721398383.db2.gz NWVQNMSJMVXBLX-TXEJJXNPSA-N 1 1 331.401 2.015 20 5 EEBDMO O=[N+]([O-])c1cccc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164786526 721398385 /nfs/dbraw/zinc/39/83/85/721398385.db2.gz NWVQNMSJMVXBLX-TXEJJXNPSA-N 1 1 331.401 2.015 20 5 EEBDMO O=[N+]([O-])c1ccc2ccnc(NC[C@@H]3C[N@H+]4CCC[C@@H]4CO3)c2c1 ZINC000840252766 782457507 /nfs/dbraw/zinc/45/75/07/782457507.db2.gz YHRBTIUKHHCXKM-HUUCEWRRSA-N 1 1 328.372 2.418 20 5 EEBDMO O=[N+]([O-])c1ccc2ccnc(NC[C@H]3C[N@H+]4CCC[C@@H]4CO3)c2c1 ZINC000840252761 782457646 /nfs/dbraw/zinc/45/76/46/782457646.db2.gz YHRBTIUKHHCXKM-CABCVRRESA-N 1 1 328.372 2.418 20 5 EEBDMO CC[N@H+]1CC[C@H]1CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893874563 780264470 /nfs/dbraw/zinc/26/44/70/780264470.db2.gz YWRJLGSJGOIIKR-LBPRGKRZSA-N 1 1 341.795 2.228 20 5 EEBDMO C[C@H](CNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1 ZINC000824003034 787996539 /nfs/dbraw/zinc/99/65/39/787996539.db2.gz MFAZGKXYCCRVRR-VXGBXAGGSA-N 1 1 335.408 2.419 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H]2[C@@H](C1)C2(F)F 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SQFWXIYTTDJTFC-UHFFFAOYSA-N 1 1 342.355 2.420 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCCN3CCOCC3)C2)cc1 ZINC000451553155 243155810 /nfs/dbraw/zinc/15/58/10/243155810.db2.gz XQNZTLKKPAZRSE-QGZVFWFLSA-N 1 1 333.432 2.497 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](CCCO)C2)cccc1[N+](=O)[O-] ZINC000452134799 243351692 /nfs/dbraw/zinc/35/16/92/243351692.db2.gz VCHYXEJIJGBGTH-UONOGXRCSA-N 1 1 335.404 2.325 20 5 EEBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000456366255 244232090 /nfs/dbraw/zinc/23/20/90/244232090.db2.gz ZOXJLDPNSUCAPO-OAHLLOKOSA-N 1 1 344.415 2.492 20 5 EEBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000265206601 247297834 /nfs/dbraw/zinc/29/78/34/247297834.db2.gz AEULZASTLWMHAU-GFCCVEGCSA-N 1 1 330.388 2.490 20 5 EEBDMO CCO[C@H]1C[C@H](O)C12CC[NH+](Cc1csc([N+](=O)[O-])c1)CC2 ZINC000266098351 248095199 /nfs/dbraw/zinc/09/51/99/248095199.db2.gz ZXUFVENIXPPRKI-STQMWFEESA-N 1 1 326.418 2.408 20 5 EEBDMO C[C@@H](C(=O)NC1CC1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000266603702 248379519 /nfs/dbraw/zinc/37/95/19/248379519.db2.gz RURHOJNLCQHJCO-LBPRGKRZSA-N 1 1 333.388 2.105 20 5 EEBDMO O=[N+]([O-])c1ccc(OCC[NH+]2CCN(Cc3ccncc3)CC2)cc1 ZINC000153212601 224074433 /nfs/dbraw/zinc/07/44/33/224074433.db2.gz CWSQSEDFIZIPCY-UHFFFAOYSA-N 1 1 342.399 2.186 20 5 EEBDMO COC(=O)[C@@H]1C[C@H](C)CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411555535 533058017 /nfs/dbraw/zinc/05/80/17/533058017.db2.gz NHKAVQPGTYNURG-DOMZBBRYSA-N 1 1 349.387 2.197 20 5 EEBDMO COC(=O)[C@@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411555535 533058018 /nfs/dbraw/zinc/05/80/18/533058018.db2.gz NHKAVQPGTYNURG-DOMZBBRYSA-N 1 1 349.387 2.197 20 5 EEBDMO C[N@H+]1CC[C@H](CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000273109095 256266448 /nfs/dbraw/zinc/26/64/48/256266448.db2.gz KJTDTQLZZBQLAZ-SNVBAGLBSA-N 1 1 343.836 2.408 20 5 EEBDMO CC[C@H]1CN(c2ncc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000273725877 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C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(CCCO)CC1 ZINC000272768621 269017630 /nfs/dbraw/zinc/01/76/30/269017630.db2.gz BRDQBIUSHPZMBD-ZDUSSCGKSA-N 1 1 335.404 2.406 20 5 EEBDMO CC(C)[C@@H](CNc1c2c(ccc1[N+](=O)[O-])NCC2)[NH+]1CCOCC1 ZINC000275354484 269109682 /nfs/dbraw/zinc/10/96/82/269109682.db2.gz KJCLJJBPGRVIQA-MRXNPFEDSA-N 1 1 334.420 2.332 20 5 EEBDMO CCOc1cccc(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)c1[N+](=O)[O-] ZINC000275435346 269115151 /nfs/dbraw/zinc/11/51/51/269115151.db2.gz FIERSVQYSWIGJI-CYBMUJFWSA-N 1 1 337.420 2.275 20 5 EEBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000278251907 269219217 /nfs/dbraw/zinc/21/92/17/269219217.db2.gz CAWIXVVOYPHFLY-ZDUSSCGKSA-N 1 1 348.403 2.312 20 5 EEBDMO CC(C)[NH+]1CC(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000275221637 274230068 /nfs/dbraw/zinc/23/00/68/274230068.db2.gz LERZUKYXNWYDSY-UHFFFAOYSA-N 1 1 332.404 2.017 20 5 EEBDMO C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000286438983 274871887 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339.392 2.289 20 5 EEBDMO C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)c2ccccc2C1 ZINC000191087754 277096676 /nfs/dbraw/zinc/09/66/76/277096676.db2.gz XNQBYVIGRQKNRH-UHFFFAOYSA-N 1 1 326.356 2.269 20 5 EEBDMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)c2ccccc2C1 ZINC000191087754 277096677 /nfs/dbraw/zinc/09/66/77/277096677.db2.gz XNQBYVIGRQKNRH-UHFFFAOYSA-N 1 1 326.356 2.269 20 5 EEBDMO COc1cc(C[NH+]2CCC3(CC2)OCCCO3)c([N+](=O)[O-])cc1F ZINC000292917763 293077995 /nfs/dbraw/zinc/07/79/95/293077995.db2.gz FZKUURARIVLFQI-UHFFFAOYSA-N 1 1 340.351 2.472 20 5 EEBDMO C[N@H+](CCN1CCOCC1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000292955996 293087796 /nfs/dbraw/zinc/08/77/96/293087796.db2.gz CIQILZLWAYQJIC-UHFFFAOYSA-N 1 1 347.337 2.378 20 5 EEBDMO C[N@@H+](CCN1CCOCC1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000292955996 293087801 /nfs/dbraw/zinc/08/78/01/293087801.db2.gz CIQILZLWAYQJIC-UHFFFAOYSA-N 1 1 347.337 2.378 20 5 EEBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC4(CC3)OCCCO4)nc2c1 ZINC000293049467 293111533 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20 5 EEBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NCC[N@H+]1CCCC(C)(C)C1 ZINC000443963395 315266995 /nfs/dbraw/zinc/26/69/95/315266995.db2.gz UQSOUAVBCHRYCY-UHFFFAOYSA-N 1 1 334.420 2.488 20 5 EEBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc3c(c2)CCS3(=O)=O)cs1 ZINC000538423252 318036024 /nfs/dbraw/zinc/03/60/24/318036024.db2.gz GGFIVIWITMHABL-UHFFFAOYSA-N 1 1 338.410 2.276 20 5 EEBDMO CN(C(=O)C[N@@H+]1CCSC[C@@H]1C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000577149539 320235573 /nfs/dbraw/zinc/23/55/73/320235573.db2.gz YFIYVPKYLSXQAE-OAHLLOKOSA-N 1 1 335.429 2.385 20 5 EEBDMO CN(C(=O)C[N@H+]1CCSC[C@@H]1C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000577149539 320235575 /nfs/dbraw/zinc/23/55/75/320235575.db2.gz YFIYVPKYLSXQAE-OAHLLOKOSA-N 1 1 335.429 2.385 20 5 EEBDMO C[C@H]1COCC[N@@H+]1C1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000581981719 324352917 /nfs/dbraw/zinc/35/29/17/324352917.db2.gz JQARKXPNZVNTPZ-HNNXBMFYSA-N 1 1 349.431 2.159 20 5 EEBDMO C[C@H]1COCC[N@H+]1C1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000581981719 324352922 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KVQBASUFVQENOQ-LOWVWBTDSA-N 1 1 335.408 2.104 20 5 EEBDMO Cc1[nH]nc(C(=O)N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000354810601 465166269 /nfs/dbraw/zinc/16/62/69/465166269.db2.gz KVQBASUFVQENOQ-LOWVWBTDSA-N 1 1 335.408 2.104 20 5 EEBDMO Cc1c(CNC(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-] ZINC000358682606 465262416 /nfs/dbraw/zinc/26/24/16/465262416.db2.gz LSDPQWDMTFFYLJ-ZBFHGGJFSA-N 1 1 332.404 2.329 20 5 EEBDMO COc1cc(C[N@H+]2C[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000351815155 465378973 /nfs/dbraw/zinc/37/89/73/465378973.db2.gz UXAHIDYCIUXVFB-KWQFWETISA-N 1 1 332.303 2.017 20 5 EEBDMO COc1cc(C[N@@H+]2C[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000351815155 465378977 /nfs/dbraw/zinc/37/89/77/465378977.db2.gz UXAHIDYCIUXVFB-KWQFWETISA-N 1 1 332.303 2.017 20 5 EEBDMO C[C@H]1CC[N@@H+](CCN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552048271 468302827 /nfs/dbraw/zinc/30/28/27/468302827.db2.gz MSZQGPGKSODDFY-WMLDXEAASA-N 1 1 343.431 2.349 20 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ZINC000153763080 462688058 /nfs/dbraw/zinc/68/80/58/462688058.db2.gz QHLVLTGIECUPJF-ZNMIVQPWSA-N 1 1 338.404 2.061 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C)cc1OC[C@@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000153763080 462688062 /nfs/dbraw/zinc/68/80/62/462688062.db2.gz QHLVLTGIECUPJF-ZNMIVQPWSA-N 1 1 338.404 2.061 20 5 EEBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@H]1C[C@H](O)C[N@H+]1Cc1ccccc1 ZINC000089644491 462702875 /nfs/dbraw/zinc/70/28/75/462702875.db2.gz YVOJXAMJBZKJQQ-WBVHZDCISA-N 1 1 342.399 2.346 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCOC[C@@H]2C2CC2)cccc1[N+](=O)[O-] ZINC000090008424 462763929 /nfs/dbraw/zinc/76/39/29/462763929.db2.gz HXPYWFCQNVDOGS-MRXNPFEDSA-N 1 1 333.388 2.343 20 5 EEBDMO CCc1nn(C)c(N2CCC[C@@H](Cc3[nH+]ccn3C)C2)c1[N+](=O)[O-] ZINC000091742892 462902257 /nfs/dbraw/zinc/90/22/57/462902257.db2.gz SMMVCEGABWNOCB-LBPRGKRZSA-N 1 1 332.408 2.083 20 5 EEBDMO Cc1cccc(C[NH+]2CCN(C(=O)c3cc([N+](=O)[O-])c[nH]3)CC2)c1 ZINC000051864717 463051541 /nfs/dbraw/zinc/05/15/41/463051541.db2.gz VSXPUARVYCHUOY-UHFFFAOYSA-N 1 1 328.372 2.189 20 5 EEBDMO COc1ccc(CC(=O)NC[C@H](C)Cn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000067913627 463066203 /nfs/dbraw/zinc/06/62/03/463066203.db2.gz MIVZCJJDSOKEHN-LBPRGKRZSA-N 1 1 346.387 2.103 20 5 EEBDMO C[C@@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC[N@H+]1Cc1ccccc1 ZINC000078689635 463141836 /nfs/dbraw/zinc/14/18/36/463141836.db2.gz MHIJTAGQJCBYNN-CYBMUJFWSA-N 1 1 342.403 2.068 20 5 EEBDMO CCOCCO[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000157594776 463148227 /nfs/dbraw/zinc/14/82/27/463148227.db2.gz IUSRQQSZCGFJPM-ZDUSSCGKSA-N 1 1 335.360 2.363 20 5 EEBDMO CCOCCO[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000157594776 463148231 /nfs/dbraw/zinc/14/82/31/463148231.db2.gz IUSRQQSZCGFJPM-ZDUSSCGKSA-N 1 1 335.360 2.363 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+](C(C)C)C1 ZINC000069044538 463202091 /nfs/dbraw/zinc/20/20/91/463202091.db2.gz PJPSEAKGOHVOGE-CYBMUJFWSA-N 1 1 335.404 2.454 20 5 EEBDMO C[N@H+](Cc1ccc2c(c1)OCO2)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136821939 463260552 /nfs/dbraw/zinc/26/05/52/463260552.db2.gz DFUDRCJENWDWHG-OAHLLOKOSA-N 1 1 330.340 2.489 20 5 EEBDMO CN(c1ccc(F)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000069739100 463314763 /nfs/dbraw/zinc/31/47/63/463314763.db2.gz KYTZZVQEEMVERR-HNNXBMFYSA-N 1 1 336.411 2.339 20 5 EEBDMO CN(c1ccc(F)cc1[N+](=O)[O-])[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000069739100 463314767 /nfs/dbraw/zinc/31/47/67/463314767.db2.gz KYTZZVQEEMVERR-HNNXBMFYSA-N 1 1 336.411 2.339 20 5 EEBDMO C[C@H]1CC[C@H](C)[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000072897315 463560734 /nfs/dbraw/zinc/56/07/34/463560734.db2.gz SJURGURKOSAGGP-QWRGUYRKSA-N 1 1 335.360 2.382 20 5 EEBDMO C[C@H]1CC[C@H](C)[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000072897315 463560736 /nfs/dbraw/zinc/56/07/36/463560736.db2.gz SJURGURKOSAGGP-QWRGUYRKSA-N 1 1 335.360 2.382 20 5 EEBDMO CC(C)[N@H+](CC(=O)N1C[C@H](C)O[C@@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000125764027 463576625 /nfs/dbraw/zinc/57/66/25/463576625.db2.gz SBKPXXWMMATWML-GJZGRUSLSA-N 1 1 349.431 2.441 20 5 EEBDMO CC(C)[N@@H+](CC(=O)N1C[C@H](C)O[C@@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000125764027 463576631 /nfs/dbraw/zinc/57/66/31/463576631.db2.gz SBKPXXWMMATWML-GJZGRUSLSA-N 1 1 349.431 2.441 20 5 EEBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000108308116 463597071 /nfs/dbraw/zinc/59/70/71/463597071.db2.gz MZRJBTLENPMBRO-INIZCTEOSA-N 1 1 346.431 2.387 20 5 EEBDMO C[C@H](NC(=O)N(C)CCc1ccccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000286828160 463718268 /nfs/dbraw/zinc/71/82/68/463718268.db2.gz OKOFNEFBJBEBDF-AWEZNQCLSA-N 1 1 346.431 2.429 20 5 EEBDMO CC(C)N1CCC[C@@H]([NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)C1=O ZINC000177686652 463766796 /nfs/dbraw/zinc/76/67/96/463766796.db2.gz HBYJRVMGOLAQKG-QGZVFWFLSA-N 1 1 346.431 2.116 20 5 EEBDMO CCOc1cc(C[NH+]2CCC(N(C)C(C)=O)CC2)ccc1[N+](=O)[O-] ZINC000276834506 463773330 /nfs/dbraw/zinc/77/33/30/463773330.db2.gz BMJDBTYOTOHJCX-UHFFFAOYSA-N 1 1 335.404 2.436 20 5 EEBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@@H]1c1cccc(F)c1 ZINC000261693847 463830078 /nfs/dbraw/zinc/83/00/78/463830078.db2.gz CNLPKDFSPNVYON-QGZVFWFLSA-N 1 1 343.358 2.450 20 5 EEBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000178177213 463857343 /nfs/dbraw/zinc/85/73/43/463857343.db2.gz MTKZTRZQXWOIPZ-GFCCVEGCSA-N 1 1 334.420 2.417 20 5 EEBDMO COC(=O)CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1 ZINC000269116156 463879777 /nfs/dbraw/zinc/87/97/77/463879777.db2.gz ZXQBVLVYTYNNRG-UHFFFAOYSA-N 1 1 346.387 2.247 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])c1ccco1 ZINC000194626174 463897995 /nfs/dbraw/zinc/89/79/95/463897995.db2.gz KCXGHDBUXBDKCU-ZDUSSCGKSA-N 1 1 339.298 2.499 20 5 EEBDMO Cn1ccnc1[C@H](O)[C@@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000269288322 463942133 /nfs/dbraw/zinc/94/21/33/463942133.db2.gz SGVIREVGSMECOR-GDBMZVCRSA-N 1 1 330.388 2.274 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@H](CNc2c3c(ccc2[N+](=O)[O-])NCC3)C1 ZINC000195178938 464011667 /nfs/dbraw/zinc/01/16/67/464011667.db2.gz VFWMEHJGLOOQDB-CYBMUJFWSA-N 1 1 334.420 2.332 20 5 EEBDMO Cc1ccc(NCCCNC(=O)Cc2ccccc2[N+](=O)[O-])[nH+]c1 ZINC000172401312 464072714 /nfs/dbraw/zinc/07/27/14/464072714.db2.gz DIHWCTZVSHWXGQ-UHFFFAOYSA-N 1 1 328.372 2.459 20 5 EEBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000172838192 464151672 /nfs/dbraw/zinc/15/16/72/464151672.db2.gz KHBMBRIXLYLTLZ-LBPRGKRZSA-N 1 1 338.383 2.263 20 5 EEBDMO CC(C)n1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000179819155 464194636 /nfs/dbraw/zinc/19/46/36/464194636.db2.gz NXVNMUPLYQRAFC-AWEZNQCLSA-N 1 1 330.392 2.454 20 5 EEBDMO CC(C)n1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000179819155 464194640 /nfs/dbraw/zinc/19/46/40/464194640.db2.gz NXVNMUPLYQRAFC-AWEZNQCLSA-N 1 1 330.392 2.454 20 5 EEBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H]1CCC[C@@H]1O ZINC000270132277 464195421 /nfs/dbraw/zinc/19/54/21/464195421.db2.gz OSWRSJSIEIIDDC-OCCSQVGLSA-N 1 1 332.360 2.238 20 5 EEBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H]1CCC[C@@H]1O ZINC000270132277 464195430 /nfs/dbraw/zinc/19/54/30/464195430.db2.gz OSWRSJSIEIIDDC-OCCSQVGLSA-N 1 1 332.360 2.238 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)C(F)(F)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000292417384 464226786 /nfs/dbraw/zinc/22/67/86/464226786.db2.gz BNLBZJXZKWGLIW-OAHLLOKOSA-N 1 1 339.342 2.241 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000188464893 464287959 /nfs/dbraw/zinc/28/79/59/464287959.db2.gz ITAXKGBGIKFXDM-ZDUSSCGKSA-N 1 1 335.404 2.326 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000173714314 464309386 /nfs/dbraw/zinc/30/93/86/464309386.db2.gz ZSCSLUOPZSZSBB-AWEZNQCLSA-N 1 1 334.420 2.468 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCN1CCOCC1 ZINC000264808808 464473558 /nfs/dbraw/zinc/47/35/58/464473558.db2.gz AWHZCULGXNWSOH-UHFFFAOYSA-N 1 1 337.420 2.146 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCN1CCOCC1 ZINC000264808808 464473564 /nfs/dbraw/zinc/47/35/64/464473564.db2.gz AWHZCULGXNWSOH-UHFFFAOYSA-N 1 1 337.420 2.146 20 5 EEBDMO CC[N@@H+](C)CCNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000264934936 464504715 /nfs/dbraw/zinc/50/47/15/464504715.db2.gz UEWMEDGRXMMCNH-UHFFFAOYSA-N 1 1 337.423 2.223 20 5 EEBDMO C[N@H+]1CCN(CCNc2c(F)cc([N+](=O)[O-])cc2F)CC1(C)C ZINC000281580532 464510765 /nfs/dbraw/zinc/51/07/65/464510765.db2.gz FXITUTRCUQQPEE-UHFFFAOYSA-N 1 1 328.363 2.311 20 5 EEBDMO COc1cc(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc([N+](=O)[O-])c1C ZINC000189498005 464519705 /nfs/dbraw/zinc/51/97/05/464519705.db2.gz SOFLHQDRKGKSLH-UKRRQHHQSA-N 1 1 347.415 2.468 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)c1 ZINC000285496257 464584599 /nfs/dbraw/zinc/58/45/99/464584599.db2.gz XEKNZPKIOPAFLZ-RHSMWYFYSA-N 1 1 346.387 2.285 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)c1 ZINC000285496257 464584601 /nfs/dbraw/zinc/58/46/01/464584601.db2.gz XEKNZPKIOPAFLZ-RHSMWYFYSA-N 1 1 346.387 2.285 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(C(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)[C@H]2C1 ZINC000272498683 464633445 /nfs/dbraw/zinc/63/34/45/464633445.db2.gz NRLAFAVUILHAJP-SJCJKPOMSA-N 1 1 342.399 2.171 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@@H]2CCC[N@@H+]2C[C@H]1C ZINC000247409316 464677120 /nfs/dbraw/zinc/67/71/20/464677120.db2.gz PZPXTAXWRJZVAZ-HIFRSBDPSA-N 1 1 332.404 2.010 20 5 EEBDMO CCn1cc([C@H](C)[NH2+]CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cn1 ZINC000295281768 464772905 /nfs/dbraw/zinc/77/29/05/464772905.db2.gz BLDHECUDGUCFEM-NSHDSACASA-N 1 1 347.375 2.109 20 5 EEBDMO C[C@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@H]1O ZINC000249596084 464897348 /nfs/dbraw/zinc/89/73/48/464897348.db2.gz WXACAORZSFWIKQ-SWLSCSKDSA-N 1 1 331.372 2.495 20 5 EEBDMO CCn1nc(C)c([N+](=O)[O-])c1N1CC([N@@H+](C)Cc2ccccc2)C1 ZINC000286498641 464940461 /nfs/dbraw/zinc/94/04/61/464940461.db2.gz YBEGRRSBXHFHKX-UHFFFAOYSA-N 1 1 329.404 2.440 20 5 EEBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](Cc4ccc([N+](=O)[O-])cc4[N+](=O)[O-])[C@H]1[C@H]3C2 ZINC000286606239 464975783 /nfs/dbraw/zinc/97/57/83/464975783.db2.gz RISSATXPSDPGEB-GSJWJAIFSA-N 1 1 333.344 2.358 20 5 EEBDMO CCc1ccc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])c[nH]3)CC[NH2+]2)cc1 ZINC000337607313 465466846 /nfs/dbraw/zinc/46/68/46/465466846.db2.gz VRZMSRBIFQSBMI-INIZCTEOSA-N 1 1 328.372 2.272 20 5 EEBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000356870074 465589620 /nfs/dbraw/zinc/58/96/20/465589620.db2.gz CXIHTJGAAKBKPL-STQMWFEESA-N 1 1 330.388 2.101 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]([C@@H]2CCOC2)C1 ZINC000371233169 465658131 /nfs/dbraw/zinc/65/81/31/465658131.db2.gz WUSKTIRUJCQBKC-HZSPNIEDSA-N 1 1 333.388 2.280 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000299253619 465666484 /nfs/dbraw/zinc/66/64/84/465666484.db2.gz PZRABIXBERAIIF-MNOVXSKESA-N 1 1 338.383 2.166 20 5 EEBDMO CNC(=O)COc1cccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)c1 ZINC000353147522 465670808 /nfs/dbraw/zinc/67/08/08/465670808.db2.gz YDWFVTOTRIMRBV-UHFFFAOYSA-N 1 1 335.385 2.071 20 5 EEBDMO COC(=O)CCC[NH+]1CCC(NCc2cccc([N+](=O)[O-])c2C)CC1 ZINC000361135913 465791341 /nfs/dbraw/zinc/79/13/41/465791341.db2.gz JVODMRABDOVDHN-UHFFFAOYSA-N 1 1 349.431 2.410 20 5 EEBDMO C[C@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)[NH+]1CCSCC1 ZINC000338150364 465852966 /nfs/dbraw/zinc/85/29/66/465852966.db2.gz RJZYIHTYYCSWSH-CYBMUJFWSA-N 1 1 337.445 2.033 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(Cc2noc([C@H]3C[N@@H+](C)C[C@H]3C)n2)c1 ZINC000361252298 465863733 /nfs/dbraw/zinc/86/37/33/465863733.db2.gz OPMUUHKGVBGSSY-MFKMUULPSA-N 1 1 332.360 2.242 20 5 EEBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN(c3[nH]cc[nH+]3)CC2)c1 ZINC000548717554 468459507 /nfs/dbraw/zinc/45/95/07/468459507.db2.gz HDWIJMLGNNYMHG-UHFFFAOYSA-N 1 1 347.400 2.002 20 5 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2.442 20 5 EEBDMO CN(CCC1CCOCC1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867951090 1201713045 /nfs/dbraw/zinc/71/30/45/1201713045.db2.gz CKFVXDMFSACSGL-QGZVFWFLSA-N 1 1 335.404 2.044 20 5 EEBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCS[C@@H]3COCC[C@@H]32)c1 ZINC000131147646 1202024811 /nfs/dbraw/zinc/02/48/11/1202024811.db2.gz IPTYOFBNEOEKBW-LSDHHAIUSA-N 1 1 334.401 2.108 20 5 EEBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCS[C@@H]3COCC[C@@H]32)c1 ZINC000131147646 1202024813 /nfs/dbraw/zinc/02/48/13/1202024813.db2.gz IPTYOFBNEOEKBW-LSDHHAIUSA-N 1 1 334.401 2.108 20 5 EEBDMO C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ncc([N+](=O)[O-])c2ccccc21 ZINC000884505959 1202328667 /nfs/dbraw/zinc/32/86/67/1202328667.db2.gz RJPGHDRBSHRERQ-UONOGXRCSA-N 1 1 342.399 2.442 20 5 EEBDMO CC[N@H+]1CC[C@H]1CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000890065338 1204774862 /nfs/dbraw/zinc/77/48/62/1204774862.db2.gz FYEHETZAHOVRSO-HNNXBMFYSA-N 1 1 332.404 2.363 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)NCCCN(C)c1ccc([N+](=O)[O-])c(C)c1 ZINC001095562276 1205875475 /nfs/dbraw/zinc/87/54/75/1205875475.db2.gz JTXYLYOCYGJMLN-UHFFFAOYSA-N 1 1 345.403 2.051 20 5 EEBDMO CC(C)[C@H]1C[N@H+](C)CCN1C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000778007272 1207410762 /nfs/dbraw/zinc/41/07/62/1207410762.db2.gz MUXNVXGUSDYALK-CQSZACIVSA-N 1 1 341.358 2.485 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000778007272 1207410764 /nfs/dbraw/zinc/41/07/64/1207410764.db2.gz MUXNVXGUSDYALK-CQSZACIVSA-N 1 1 341.358 2.485 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C[C@@H](O)c3ccccc3F)C2)nc1 ZINC000245434247 1212378205 /nfs/dbraw/zinc/37/82/05/1212378205.db2.gz CDMFXJAMCGJMSM-MLGOLLRUSA-N 1 1 346.362 2.349 20 5 EEBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2cccc(F)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050325973 1243352291 /nfs/dbraw/zinc/35/22/91/1243352291.db2.gz PLXVZQYEBBOHNG-BASLNEPJSA-N 1 1 349.406 2.256 20 5 EEBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(C)(C)NC(=O)OC(C)(C)C ZINC000852308090 1292085522 /nfs/dbraw/zinc/08/55/22/1292085522.db2.gz UOFDUFJZRLKWEI-UHFFFAOYSA-N 1 1 341.412 2.026 20 5 EEBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C1 ZINC000856073622 1293398128 /nfs/dbraw/zinc/39/81/28/1293398128.db2.gz UJNHQZKTZQWZPO-LLVKDONJSA-N 1 1 338.383 2.014 20 5 EEBDMO Cn1nccc1[C@@H](O)C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000856801090 1293638169 /nfs/dbraw/zinc/63/81/69/1293638169.db2.gz JZSWVZLEQAVGRQ-KRWDZBQOSA-N 1 1 348.378 2.413 20 5 EEBDMO CC[NH2+][C@H](C)c1nc(Cc2cc(OC)cc(OC)c2[N+](=O)[O-])no1 ZINC000863671596 1296380121 /nfs/dbraw/zinc/38/01/21/1296380121.db2.gz DJTWUAASFRLUBE-SECBINFHSA-N 1 1 336.348 2.256 20 5 EEBDMO C[N@@H+]1[C@@H]2C[C@@H](OCc3nc4cc([N+](=O)[O-])ccc4o3)[C@H]1CC(=O)C2 ZINC001222929620 1299923528 /nfs/dbraw/zinc/92/35/28/1299923528.db2.gz PYYCGDZJNRPWJQ-PSOPSSQASA-N 1 1 331.328 2.057 20 5 EEBDMO C[N@H+]1[C@@H]2C[C@@H](OCc3nc4cc([N+](=O)[O-])ccc4o3)[C@H]1CC(=O)C2 ZINC001222929620 1299923531 /nfs/dbraw/zinc/92/35/31/1299923531.db2.gz PYYCGDZJNRPWJQ-PSOPSSQASA-N 1 1 331.328 2.057 20 5 EEBDMO C[N@@H+]1[C@@H]2C[C@H](Oc3ncc([N+](=O)[O-])cc3C(F)(F)F)[C@H]1CC(=O)C2 ZINC001225893808 1301191262 /nfs/dbraw/zinc/19/12/62/1301191262.db2.gz YUXNLYQIYVLTAD-BPTDKIDVSA-N 1 1 345.277 2.192 20 5 EEBDMO C[N@H+]1[C@@H]2C[C@H](Oc3ncc([N+](=O)[O-])cc3C(F)(F)F)[C@H]1CC(=O)C2 ZINC001225893808 1301191271 /nfs/dbraw/zinc/19/12/71/1301191271.db2.gz YUXNLYQIYVLTAD-BPTDKIDVSA-N 1 1 345.277 2.192 20 5 EEBDMO Cc1nc(Cl)nc(O[C@@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c1[N+](=O)[O-] ZINC001227337863 1301786753 /nfs/dbraw/zinc/78/67/53/1301786753.db2.gz NQRBLSRDCPTEPS-PEGIJTEDSA-N 1 1 326.784 2.456 20 5 EEBDMO C[N@H+]1CC[C@H](Oc2cc(I)ccc2[N+](=O)[O-])C1 ZINC001229150727 1302643122 /nfs/dbraw/zinc/64/31/22/1302643122.db2.gz AHONYOVWXDOVNM-VIFPVBQESA-N 1 1 348.140 2.282 20 5 EEBDMO Cc1nc(OC2CC[NH+](Cc3ccccc3)CC2)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229375486 1302753207 /nfs/dbraw/zinc/75/32/07/1302753207.db2.gz FPWXNXFSECSAII-UHFFFAOYSA-N 1 1 344.371 2.442 20 5 EEBDMO CC[N@H+]1CCN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)[C@H](C)C1 ZINC001230368338 1303180638 /nfs/dbraw/zinc/18/06/38/1303180638.db2.gz LLISQDQFQIUJIJ-LLVKDONJSA-N 1 1 340.811 2.484 20 5 EEBDMO CC[N@@H+](CCc1ccccn1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000784172278 1304430018 /nfs/dbraw/zinc/43/00/18/1304430018.db2.gz AHJPMBUNAGPZLX-MRXNPFEDSA-N 1 1 345.399 2.294 20 5 EEBDMO Cc1cc(C(=O)NCCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)on1 ZINC001233864287 1304619300 /nfs/dbraw/zinc/61/93/00/1304619300.db2.gz UPJMJFDVWRWHAS-UHFFFAOYSA-N 1 1 332.360 2.143 20 5 EEBDMO C[N@H+]1CCCC[C@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC001120810709 1309765619 /nfs/dbraw/zinc/76/56/19/1309765619.db2.gz UZKAQQIITABJBV-AWEZNQCLSA-N 1 1 332.404 2.383 20 5 EEBDMO C[C@H](Nc1ccnc2c1cccc2[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C ZINC001120874082 1309805822 /nfs/dbraw/zinc/80/58/22/1309805822.db2.gz IQVZBIJUPMTYOQ-BLLLJJGKSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1ccnc2c1cccc2[N+](=O)[O-])[C@H]1CN(C)CC[N@@H+]1C ZINC001120874082 1309805828 /nfs/dbraw/zinc/80/58/28/1309805828.db2.gz IQVZBIJUPMTYOQ-BLLLJJGKSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1ccnc2c1cccc2[N+](=O)[O-])[C@H]1CN(C)CC[N@H+]1C ZINC001120874082 1309805835 /nfs/dbraw/zinc/80/58/35/1309805835.db2.gz IQVZBIJUPMTYOQ-BLLLJJGKSA-N 1 1 329.404 2.189 20 5 EEBDMO O=[N+]([O-])c1ccc(OCC[NH+]2CCN(c3ccnc(F)c3)CC2)cc1 ZINC000831447596 1314592242 /nfs/dbraw/zinc/59/22/42/1314592242.db2.gz SJBKGKJRQKXLGE-UHFFFAOYSA-N 1 1 346.362 2.330 20 5 EEBDMO CCC[C@H]1C[NH2+]CCN1S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000842826384 1315779895 /nfs/dbraw/zinc/77/98/95/1315779895.db2.gz PADZFWYSRYUDIT-NSHDSACASA-N 1 1 347.824 2.011 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCO[C@]4(CCOC4)C3)CC2)cc1 ZINC001254474087 1318083013 /nfs/dbraw/zinc/08/30/13/1318083013.db2.gz LNJZWPXUKZZGQM-GOSISDBHSA-N 1 1 347.415 2.055 20 5 EEBDMO CCOC(=O)[C@H]1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254480115 1318084944 /nfs/dbraw/zinc/08/49/44/1318084944.db2.gz VKCRQSLYCWPNNL-AWEZNQCLSA-N 1 1 347.415 2.449 20 5 EEBDMO COCc1noc2c1C[N@@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001254593857 1318136989 /nfs/dbraw/zinc/13/69/89/1318136989.db2.gz ALLHNCDVYJNRGJ-AWEZNQCLSA-N 1 1 329.356 2.255 20 5 EEBDMO COCc1noc2c1C[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001254593857 1318136998 /nfs/dbraw/zinc/13/69/98/1318136998.db2.gz ALLHNCDVYJNRGJ-AWEZNQCLSA-N 1 1 329.356 2.255 20 5 EEBDMO COC[C@@H]1Cn2nccc2C[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254596840 1318138493 /nfs/dbraw/zinc/13/84/93/1318138493.db2.gz RYUGWQQHEOWABM-SCLBCKFNSA-N 1 1 342.399 2.037 20 5 EEBDMO COC[C@@H]1Cn2nccc2C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254596840 1318138501 /nfs/dbraw/zinc/13/85/01/1318138501.db2.gz RYUGWQQHEOWABM-SCLBCKFNSA-N 1 1 342.399 2.037 20 5 EEBDMO C[C@H](C(=O)NCc1ccco1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC001257432369 1318997857 /nfs/dbraw/zinc/99/78/57/1318997857.db2.gz RHGBLFQSIYLWOY-CYBMUJFWSA-N 1 1 331.372 2.367 20 5 EEBDMO C[C@H](C(=O)NCc1ccco1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC001257432369 1318997863 /nfs/dbraw/zinc/99/78/63/1318997863.db2.gz RHGBLFQSIYLWOY-CYBMUJFWSA-N 1 1 331.372 2.367 20 5 EEBDMO O=C(NCCC1=CC[N@@H+](CCc2cccs2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160107890 1320071893 /nfs/dbraw/zinc/07/18/93/1320071893.db2.gz XAESWHGQLUKRMU-HZPDHXFCSA-N 1 1 349.456 2.094 20 5 EEBDMO O=C(NCCC1=CC[N@H+](CCc2cccs2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160107890 1320071896 /nfs/dbraw/zinc/07/18/96/1320071896.db2.gz XAESWHGQLUKRMU-HZPDHXFCSA-N 1 1 349.456 2.094 20 5 EEBDMO O=C(NCCC1=CC[N@@H+](CCc2cccs2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160107890 1320071901 /nfs/dbraw/zinc/07/19/01/1320071901.db2.gz XAESWHGQLUKRMU-HZPDHXFCSA-N 1 1 349.456 2.094 20 5 EEBDMO C[C@@]12CSC[C@@H]1C[N@@H+](CC(=O)N1CCc3cc([N+](=O)[O-])ccc31)C2 ZINC001308134808 1331566229 /nfs/dbraw/zinc/56/62/29/1331566229.db2.gz TUYBAQVZEWHUJL-SUMWQHHRSA-N 1 1 347.440 2.169 20 5 EEBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)Nc1c(C)cncc1[N+](=O)[O-] ZINC001310517702 1331694495 /nfs/dbraw/zinc/69/44/95/1331694495.db2.gz ACDXADKSGUMZDJ-AWEZNQCLSA-N 1 1 349.435 2.496 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC001318870743 1332614753 /nfs/dbraw/zinc/61/47/53/1332614753.db2.gz PTTSZUUFFCFJTI-CQSZACIVSA-N 1 1 346.431 2.440 20 5 EEBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[N@H+]1CCCC[C@@H]1C ZINC001609165093 1351871906 /nfs/dbraw/zinc/87/19/06/1351871906.db2.gz DALREVFHDVRJBR-RYUDHWBXSA-N 1 1 345.407 2.450 20 5 EEBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC001339266776 1336983039 /nfs/dbraw/zinc/98/30/39/1336983039.db2.gz WEDUNCJICRNARK-OAHLLOKOSA-N 1 1 346.431 2.409 20 5 EEBDMO CC(C)CO[C@@H]1CC[N@@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])C1 ZINC001589640451 1349014138 /nfs/dbraw/zinc/01/41/38/1349014138.db2.gz NBEMDKOUELZPDA-GFCCVEGCSA-N 1 1 346.391 2.022 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H](CNc2cccc(-c3nn[nH]n3)c2[N+](=O)[O-])C1 ZINC001589714808 1349022974 /nfs/dbraw/zinc/02/29/74/1349022974.db2.gz LRLXHUHGZLCQJJ-LBPRGKRZSA-N 1 1 345.407 2.307 20 5 EEBDMO CC[C@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(-c2nn[nH]n2)c1 ZINC001590512048 1349362271 /nfs/dbraw/zinc/36/22/71/1349362271.db2.gz BZIRGGSCLSEYAV-ZDUSSCGKSA-N 1 1 345.407 2.451 20 5 EEBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H](CO)Cc1ccccc1 ZINC000852288161 1369258363 /nfs/dbraw/zinc/25/83/63/1369258363.db2.gz SFZNHEJBBNOCKP-ZWKOTPCHSA-N 1 1 330.384 2.164 20 5 EEBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)c1cc2n(n1)C[C@H](C)[NH2+]C2 ZINC001578263658 1403729805 /nfs/dbraw/zinc/72/98/05/1403729805.db2.gz RNDKCSJITFEBHG-JTQLQIEISA-N 1 1 329.360 2.098 20 5 EEBDMO C[N@@H+](CCCNC(=O)Cc1ccoc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001751966137 1406153313 /nfs/dbraw/zinc/15/33/13/1406153313.db2.gz BLCNKUVGZBGFBA-UHFFFAOYSA-N 1 1 331.372 2.369 20 5 EEBDMO COc1cccc(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)c1[N+](=O)[O-] ZINC000906453683 783924792 /nfs/dbraw/zinc/92/47/92/783924792.db2.gz KJYCURXTHKNTOS-ZDUSSCGKSA-N 1 1 335.404 2.406 20 5 EEBDMO COc1cccc(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)c1[N+](=O)[O-] ZINC000906453683 783924797 /nfs/dbraw/zinc/92/47/97/783924797.db2.gz KJYCURXTHKNTOS-ZDUSSCGKSA-N 1 1 335.404 2.406 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC[N@@H+](CC3CCCC3)C2)CC1 ZINC001035186910 784063651 /nfs/dbraw/zinc/06/36/51/784063651.db2.gz KZFXSXZODQDORN-HZPDHXFCSA-N 1 1 335.448 2.156 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@H+](CC3CCCC3)C2)CC1 ZINC001035186910 784063658 /nfs/dbraw/zinc/06/36/58/784063658.db2.gz KZFXSXZODQDORN-HZPDHXFCSA-N 1 1 335.448 2.156 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@@H+](CC3CCCC3)C2)CC1 ZINC001035186910 784063666 /nfs/dbraw/zinc/06/36/66/784063666.db2.gz KZFXSXZODQDORN-HZPDHXFCSA-N 1 1 335.448 2.156 20 5 EEBDMO C[C@H]1C[C@H](CO)C[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000817277486 784655672 /nfs/dbraw/zinc/65/56/72/784655672.db2.gz IBTFYKTWAWAXDP-QWRGUYRKSA-N 1 1 341.795 2.137 20 5 EEBDMO C[C@H]1C[C@H](CO)C[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000817277486 784655678 /nfs/dbraw/zinc/65/56/78/784655678.db2.gz IBTFYKTWAWAXDP-QWRGUYRKSA-N 1 1 341.795 2.137 20 5 EEBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000820728708 786439788 /nfs/dbraw/zinc/43/97/88/786439788.db2.gz OUAUOKFLTHYELT-MRVPVSSYSA-N 1 1 344.774 2.136 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000820728708 786439793 /nfs/dbraw/zinc/43/97/93/786439793.db2.gz OUAUOKFLTHYELT-MRVPVSSYSA-N 1 1 344.774 2.136 20 5 EEBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](Cc2ccc3nonc3c2)CC1 ZINC000821349299 786709257 /nfs/dbraw/zinc/70/92/57/786709257.db2.gz VVTQGZXQQCZWAV-UHFFFAOYSA-N 1 1 339.355 2.453 20 5 EEBDMO CC(C)[N@@H+](C)C[C@H](O)CN(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000821390852 786723532 /nfs/dbraw/zinc/72/35/32/786723532.db2.gz FJYYMANKWMJSJU-CQSZACIVSA-N 1 1 329.828 2.381 20 5 EEBDMO CN1C(=O)NCC12CC[NH+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC2 ZINC000822529244 787237143 /nfs/dbraw/zinc/23/71/43/787237143.db2.gz BLVDPPDOTNCKBM-UHFFFAOYSA-N 1 1 338.795 2.238 20 5 EEBDMO Cc1nc(NCCCN(C)C(=O)C[N@@H+](C)C2CCC2)ccc1[N+](=O)[O-] ZINC001109652900 805830285 /nfs/dbraw/zinc/83/02/85/805830285.db2.gz GZGVQSJZHDZYEM-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO CC1(C)CCC[N@@H+](CCNC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000823951565 787986020 /nfs/dbraw/zinc/98/60/20/787986020.db2.gz SSTUSSYMUDBBNX-UHFFFAOYSA-N 1 1 335.408 2.421 20 5 EEBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000055748224 789235599 /nfs/dbraw/zinc/23/55/99/789235599.db2.gz GIWMTPZLUSLSOC-FRRDWIJNSA-N 1 1 334.420 2.273 20 5 EEBDMO C[C@@H]1C[C@H](O)C[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009841 797195349 /nfs/dbraw/zinc/19/53/49/797195349.db2.gz IORXYPBNMSXOLV-MFKMUULPSA-N 1 1 341.358 2.297 20 5 EEBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCOC[C@@](O)(C(F)(F)F)C1 ZINC001173221792 797303416 /nfs/dbraw/zinc/30/34/16/797303416.db2.gz MGRYHORXEBDJMB-SMDDNHRTSA-N 1 1 348.321 2.151 20 5 EEBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC[C@@](O)(C(F)(F)F)C1 ZINC001173221792 797303423 /nfs/dbraw/zinc/30/34/23/797303423.db2.gz MGRYHORXEBDJMB-SMDDNHRTSA-N 1 1 348.321 2.151 20 5 EEBDMO Cn1cc2c(n1)C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C[C@H]2COCC1CC1 ZINC001169025276 803591446 /nfs/dbraw/zinc/59/14/46/803591446.db2.gz YITFROKIBPZILZ-OWCLPIDISA-N 1 1 348.447 2.191 20 5 EEBDMO Cn1cc2c(n1)C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C[C@H]2COCC1CC1 ZINC001169025276 803591449 /nfs/dbraw/zinc/59/14/49/803591449.db2.gz YITFROKIBPZILZ-OWCLPIDISA-N 1 1 348.447 2.191 20 5 EEBDMO O=C(c1ccco1)N1C[C@H]2CCC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)[C@H]2C1 ZINC001169026992 803592205 /nfs/dbraw/zinc/59/22/05/803592205.db2.gz OQSDJDJHXPOKQY-FPCVCCKLSA-N 1 1 347.415 2.261 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](O)[C@H](F)CC2)c([N+](=O)[O-])c1 ZINC001170328389 809892857 /nfs/dbraw/zinc/89/28/57/809892857.db2.gz KHKBWMPLEWUEHD-SGIREYDYSA-N 1 1 326.368 2.329 20 5 EEBDMO COc1ccc(C[C@H](C)[N@@H+]2C[C@H](F)C[C@@H](CO)C2)c([N+](=O)[O-])c1 ZINC001170330138 809894936 /nfs/dbraw/zinc/89/49/36/809894936.db2.gz ZBMMCPFKNHQRER-OUCADQQQSA-N 1 1 326.368 2.187 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2C[C@H](F)C[C@@H](CO)C2)c([N+](=O)[O-])c1 ZINC001170330138 809894940 /nfs/dbraw/zinc/89/49/40/809894940.db2.gz ZBMMCPFKNHQRER-OUCADQQQSA-N 1 1 326.368 2.187 20 5 EEBDMO COc1ccc(C[C@H](C)[NH+]2CCN(CCF)CC2)c([N+](=O)[O-])c1 ZINC001170344635 809916073 /nfs/dbraw/zinc/91/60/73/809916073.db2.gz DNGBAUWTSMLKRM-ZDUSSCGKSA-N 1 1 325.384 2.122 20 5 EEBDMO COc1ccc(OCC[N@@H+](C)CCCn2ccnc2)c([N+](=O)[O-])c1 ZINC000181078572 234080839 /nfs/dbraw/zinc/08/08/39/234080839.db2.gz IIIUEWILLFLPKY-UHFFFAOYSA-N 1 1 334.376 2.201 20 5 EEBDMO COc1cccc(C(=O)NCCCCn2cc[nH+]c2C)c1[N+](=O)[O-] ZINC000192620334 237324226 /nfs/dbraw/zinc/32/42/26/237324226.db2.gz BVJGALLRBABHOP-UHFFFAOYSA-N 1 1 332.360 2.319 20 5 EEBDMO C[C@H](NC[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000423387989 240464875 /nfs/dbraw/zinc/46/48/75/240464875.db2.gz MJSYXCGRPBDRKE-SMDDNHRTSA-N 1 1 346.353 2.082 20 5 EEBDMO CC[C@@]1(CO)CCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000439271257 242076176 /nfs/dbraw/zinc/07/61/76/242076176.db2.gz JCERPWAIHIKZDB-KRWDZBQOSA-N 1 1 349.387 2.130 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCC[C@H]1C[C@@H](C)O ZINC000447839135 242324852 /nfs/dbraw/zinc/32/48/52/242324852.db2.gz HRQLQWKCEHCXQR-KGLIPLIRSA-N 1 1 335.404 2.467 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCCC[C@H]1C[C@@H](C)O ZINC000447839135 242324856 /nfs/dbraw/zinc/32/48/56/242324856.db2.gz HRQLQWKCEHCXQR-KGLIPLIRSA-N 1 1 335.404 2.467 20 5 EEBDMO CCO[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000451552211 243155319 /nfs/dbraw/zinc/15/53/19/243155319.db2.gz YKPULHQATLZVTB-IJEWVQPXSA-N 1 1 338.404 2.081 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@]2(O)CCCC[C@H]2C1 ZINC000246835407 243323997 /nfs/dbraw/zinc/32/39/97/243323997.db2.gz KHIZYZJTAAMQGS-KBXCAEBGSA-N 1 1 347.415 2.469 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@]2(O)CCCC[C@H]2C1 ZINC000246835407 243324003 /nfs/dbraw/zinc/32/40/03/243324003.db2.gz KHIZYZJTAAMQGS-KBXCAEBGSA-N 1 1 347.415 2.469 20 5 EEBDMO C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC[N@H+](C2CC2)C1 ZINC000452172924 243361499 /nfs/dbraw/zinc/36/14/99/243361499.db2.gz LMXAKDIPVWXRFG-LBPRGKRZSA-N 1 1 335.379 2.219 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[NH2+]Cc2cccc(O)c2Br)c1 ZINC000459436106 245120266 /nfs/dbraw/zinc/12/02/66/245120266.db2.gz FAHVSSJCZUUXGL-UHFFFAOYSA-N 1 1 341.165 2.049 20 5 EEBDMO CN(C(=O)C[N@@H+](CCO)C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000111303950 220136024 /nfs/dbraw/zinc/13/60/24/220136024.db2.gz FUCUCKVVPKOLKB-UHFFFAOYSA-N 1 1 335.404 2.185 20 5 EEBDMO C[N@H+](CCn1cccn1)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000111282152 220132899 /nfs/dbraw/zinc/13/28/99/220132899.db2.gz JGIOWISOPCIUET-UHFFFAOYSA-N 1 1 337.767 2.015 20 5 EEBDMO C[N@@H+](CCn1cccn1)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000111282152 220132902 /nfs/dbraw/zinc/13/29/02/220132902.db2.gz JGIOWISOPCIUET-UHFFFAOYSA-N 1 1 337.767 2.015 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(N2CCCC2=O)CC1 ZINC000264145678 246106636 /nfs/dbraw/zinc/10/66/36/246106636.db2.gz CHAPQMBAWWNCED-UHFFFAOYSA-N 1 1 333.388 2.190 20 5 EEBDMO O=C1NC2(CO1)CC[NH+](Cc1c(Cl)cccc1[N+](=O)[O-])CC2 ZINC000495529799 247187319 /nfs/dbraw/zinc/18/73/19/247187319.db2.gz PBFBORPADOAIIS-UHFFFAOYSA-N 1 1 325.752 2.323 20 5 EEBDMO CCO[C@@H]1C[C@@H](O)C12CC[NH+](Cc1csc([N+](=O)[O-])c1)CC2 ZINC000266098342 248095334 /nfs/dbraw/zinc/09/53/34/248095334.db2.gz ZXUFVENIXPPRKI-CHWSQXEVSA-N 1 1 326.418 2.408 20 5 EEBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](CCO[C@@H]2CCCCO2)CC1 ZINC000185175355 285163307 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NOAXERRKHIMMNI-JTQLQIEISA-N 1 1 329.784 2.280 20 5 EEBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1n1ccnc1 ZINC000271216615 256221125 /nfs/dbraw/zinc/22/11/25/256221125.db2.gz IZSJPDVFOPQCQD-COXVUDFISA-N 1 1 330.388 2.408 20 5 EEBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ncc([N+](=O)[O-])cn1 ZINC000273558339 256307006 /nfs/dbraw/zinc/30/70/06/256307006.db2.gz BFZBGMKTZGCTJU-OAHLLOKOSA-N 1 1 327.388 2.343 20 5 EEBDMO CCOC(=O)[C@@H](C)[C@H](C)[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000274016723 256346034 /nfs/dbraw/zinc/34/60/34/256346034.db2.gz MHXGDMMLSWCSCW-QWRGUYRKSA-N 1 1 348.359 2.322 20 5 EEBDMO C[C@@H](NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183362967 533279335 /nfs/dbraw/zinc/27/93/35/533279335.db2.gz SLFSKRVFIWIVQY-NEPJUHHUSA-N 1 1 348.403 2.078 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H]([C@H](C)O)C1 ZINC000248544209 160349591 /nfs/dbraw/zinc/34/95/91/160349591.db2.gz IVSAVWMNFQHNJT-NTZNESFSSA-N 1 1 332.360 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/nfs/dbraw/zinc/27/05/77/463270577.db2.gz KWXAHLYLWXSYSH-UHFFFAOYSA-N 1 1 348.359 2.360 20 5 EEBDMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2cc(C)on2)c([N+](=O)[O-])c1 ZINC000029728405 463270582 /nfs/dbraw/zinc/27/05/82/463270582.db2.gz KWXAHLYLWXSYSH-UHFFFAOYSA-N 1 1 348.359 2.360 20 5 EEBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000151316898 463511838 /nfs/dbraw/zinc/51/18/38/463511838.db2.gz OGBQAKQPANVLMH-UHFFFAOYSA-N 1 1 339.395 2.482 20 5 EEBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)[N@@H+](C)C1CC1 ZINC000057716079 463513441 /nfs/dbraw/zinc/51/34/41/463513441.db2.gz CMJDEWZCHKQAEB-CYBMUJFWSA-N 1 1 346.431 2.408 20 5 EEBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCN([C@@H]2CCC[N@@H+](C)C2)CC1 ZINC000072637079 463527956 /nfs/dbraw/zinc/52/79/56/463527956.db2.gz ZWJADRJWEGKQBB-JKSUJKDBSA-N 1 1 332.448 2.368 20 5 EEBDMO C[C@H](O)[C@@H]1CCCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000106862960 463543391 /nfs/dbraw/zinc/54/33/91/463543391.db2.gz WPPQZVGALGLZJZ-FZMZJTMJSA-N 1 1 332.360 2.380 20 5 EEBDMO C[C@H](O)[C@@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000106862960 463543394 /nfs/dbraw/zinc/54/33/94/463543394.db2.gz WPPQZVGALGLZJZ-FZMZJTMJSA-N 1 1 332.360 2.380 20 5 EEBDMO CCCC[N@@H+](C)CCNC(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000112443852 463702378 /nfs/dbraw/zinc/70/23/78/463702378.db2.gz WCQUXOMVQJOUMV-UHFFFAOYSA-N 1 1 338.408 2.135 20 5 EEBDMO Nc1ccc(NC[C@H]2C[N@H+](Cc3ccccc3)CCO2)c([N+](=O)[O-])c1 ZINC000287085539 463794258 /nfs/dbraw/zinc/79/42/58/463794258.db2.gz ULLSGINKRMGMCJ-INIZCTEOSA-N 1 1 342.399 2.490 20 5 EEBDMO Nc1ccc(NC[C@H]2C[N@@H+](Cc3ccccc3)CCO2)c([N+](=O)[O-])c1 ZINC000287085539 463794265 /nfs/dbraw/zinc/79/42/65/463794265.db2.gz ULLSGINKRMGMCJ-INIZCTEOSA-N 1 1 342.399 2.490 20 5 EEBDMO COC(=O)[C@H]1C[C@@H](C)CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283242650 463816755 /nfs/dbraw/zinc/81/67/55/463816755.db2.gz JKVGUDPGRWQQDC-SWLSCSKDSA-N 1 1 349.387 2.197 20 5 EEBDMO COC(=O)[C@H]1C[C@@H](C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283242650 463816762 /nfs/dbraw/zinc/81/67/62/463816762.db2.gz JKVGUDPGRWQQDC-SWLSCSKDSA-N 1 1 349.387 2.197 20 5 EEBDMO CN(CCC[NH+]1CCN(C)CC1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000287333802 463871510 /nfs/dbraw/zinc/87/15/10/463871510.db2.gz MRNOWYKMWZMYLX-UHFFFAOYSA-N 1 1 326.828 2.322 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000261870005 463883234 /nfs/dbraw/zinc/88/32/34/463883234.db2.gz XHEBEVHIANORDL-INIZCTEOSA-N 1 1 326.356 2.085 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)/C=C/c3ccc(F)cc3[N+](=O)[O-])[C@H]2C1 ZINC000492334541 468383281 /nfs/dbraw/zinc/38/32/81/468383281.db2.gz BVGRETMLZFDSIV-TWPIFRAZSA-N 1 1 333.363 2.300 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@@H](CNc2c3c(ccc2[N+](=O)[O-])NCC3)C1 ZINC000195178950 464011572 /nfs/dbraw/zinc/01/15/72/464011572.db2.gz VFWMEHJGLOOQDB-ZDUSSCGKSA-N 1 1 334.420 2.332 20 5 EEBDMO COc1cc(C(=O)NCC[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000195486046 464059887 /nfs/dbraw/zinc/05/98/87/464059887.db2.gz PEOTZUGUGJMEKJ-UHFFFAOYSA-N 1 1 343.383 2.465 20 5 EEBDMO Cc1ccc([C@H](CNC(=O)c2[nH]nc(C)c2[N+](=O)[O-])[NH+]2CCCC2)o1 ZINC000263681112 464150678 /nfs/dbraw/zinc/15/06/78/464150678.db2.gz KVQQQQWZKZUQCO-LBPRGKRZSA-N 1 1 347.375 2.095 20 5 EEBDMO COc1ccc(C[NH2+]Cc2cc(OC)c(O)cc2[N+](=O)[O-])cc1O ZINC000263685465 464153705 /nfs/dbraw/zinc/15/37/05/464153705.db2.gz NOGSJVKBURWQHB-UHFFFAOYSA-N 1 1 334.328 2.313 20 5 EEBDMO CCCNC(=O)C[NH+]1CCC(Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000263794280 464194180 /nfs/dbraw/zinc/19/41/80/464194180.db2.gz YTHNKRWBYFCPSU-UHFFFAOYSA-N 1 1 334.420 2.306 20 5 EEBDMO O=C1NC[C@@H]2C[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CCN12 ZINC000180479927 464319584 /nfs/dbraw/zinc/31/95/84/464319584.db2.gz ICCBKAAUOAUMNA-CQSZACIVSA-N 1 1 342.355 2.064 20 5 EEBDMO O=C1NC[C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CCN12 ZINC000180479927 464319590 /nfs/dbraw/zinc/31/95/90/464319590.db2.gz ICCBKAAUOAUMNA-CQSZACIVSA-N 1 1 342.355 2.064 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@H](C)[C@@H]1C ZINC000298644165 465458699 /nfs/dbraw/zinc/45/86/99/465458699.db2.gz PWQSHGJYJUPPHE-RYUDHWBXSA-N 1 1 337.376 2.041 20 5 EEBDMO CCOC(=O)[C@@]1(COC)CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000281102380 464333307 /nfs/dbraw/zinc/33/33/07/464333307.db2.gz ANZKYYPFZAFZMX-KRWDZBQOSA-N 1 1 336.388 2.387 20 5 EEBDMO C[N@@H+](CCc1ccncc1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000181480402 464496444 /nfs/dbraw/zinc/49/64/44/464496444.db2.gz XQIVPPTUGSZYSD-KRWDZBQOSA-N 1 1 340.383 2.270 20 5 EEBDMO C[C@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccccn1 ZINC000181790938 464528096 /nfs/dbraw/zinc/52/80/96/464528096.db2.gz OEFZXOAUUXZOPM-LBPRGKRZSA-N 1 1 326.356 2.230 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+](C2CC2)C[C@@H](C)C1 ZINC000294952351 464661015 /nfs/dbraw/zinc/66/10/15/464661015.db2.gz AWYCAKFIFBBWHU-UONOGXRCSA-N 1 1 346.431 2.338 20 5 EEBDMO Cc1nc(N2CC[C@H](C[N@H+](C)Cc3cccnc3)C2)ncc1[N+](=O)[O-] ZINC000294964704 464665067 /nfs/dbraw/zinc/66/50/67/464665067.db2.gz LHPYIASRXRPABZ-OAHLLOKOSA-N 1 1 342.403 2.047 20 5 EEBDMO C[C@@H]1[C@H](C)SCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248465363 464756262 /nfs/dbraw/zinc/75/62/62/464756262.db2.gz RPPGQIFDFAEPST-FRRDWIJNSA-N 1 1 326.418 2.160 20 5 EEBDMO C[C@H](NC(=O)[C@@H]1CCC[N@H+]1C1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000295298934 464780001 /nfs/dbraw/zinc/78/00/01/464780001.db2.gz JCYBRYLGAIDTCT-GUYCJALGSA-N 1 1 347.415 2.415 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)[C@@H](C)C1 ZINC000248664952 464783568 /nfs/dbraw/zinc/78/35/68/464783568.db2.gz KXLBGHYUTHZKCQ-STQMWFEESA-N 1 1 330.388 2.034 20 5 EEBDMO C[N@@H+]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000356724013 465508159 /nfs/dbraw/zinc/50/81/59/465508159.db2.gz FZECSVGYRRZOBZ-SJORKVTESA-N 1 1 341.367 2.128 20 5 EEBDMO C[N@H+]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000356724013 465508165 /nfs/dbraw/zinc/50/81/65/465508165.db2.gz FZECSVGYRRZOBZ-SJORKVTESA-N 1 1 341.367 2.128 20 5 EEBDMO CC(C)[C@@H](CNc1nc2ccccc2cc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000352356243 465518875 /nfs/dbraw/zinc/51/88/75/465518875.db2.gz LEZSXISWQWIQMH-QGZVFWFLSA-N 1 1 344.415 2.912 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)CCc1ccccn1 ZINC000348288749 465533419 /nfs/dbraw/zinc/53/34/19/465533419.db2.gz QNVNVMPPFKWUKE-UHFFFAOYSA-N 1 1 328.372 2.411 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CCc1ccccn1 ZINC000348288749 465533424 /nfs/dbraw/zinc/53/34/24/465533424.db2.gz QNVNVMPPFKWUKE-UHFFFAOYSA-N 1 1 328.372 2.411 20 5 EEBDMO CC(C)[C@@H]1CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)CC[N@H+]1C ZINC000337855201 465630828 /nfs/dbraw/zinc/63/08/28/465630828.db2.gz KWKKQZMTNVIJQT-HNNXBMFYSA-N 1 1 344.419 2.167 20 5 EEBDMO CC(C)[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000299275178 465677406 /nfs/dbraw/zinc/67/74/06/465677406.db2.gz MWUSQVDYXOLEIL-JKIFEVAISA-N 1 1 349.431 2.345 20 5 EEBDMO CC(C)[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000299275178 465677412 /nfs/dbraw/zinc/67/74/12/465677412.db2.gz MWUSQVDYXOLEIL-JKIFEVAISA-N 1 1 349.431 2.345 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+](C)[C@H](C)[C@H]1C ZINC000357018545 465704748 /nfs/dbraw/zinc/70/47/48/465704748.db2.gz ABHHUXKGBNRRRS-ZIAGYGMSSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN(C)[C@H](C)[C@H]1C ZINC000357018545 465704752 /nfs/dbraw/zinc/70/47/52/465704752.db2.gz ABHHUXKGBNRRRS-ZIAGYGMSSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCN(C)[C@H](C)[C@H]1C ZINC000357018545 465704756 /nfs/dbraw/zinc/70/47/56/465704756.db2.gz ABHHUXKGBNRRRS-ZIAGYGMSSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CCN2C[C@@H](C)[N@H+](C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000330597779 465724196 /nfs/dbraw/zinc/72/41/96/465724196.db2.gz SNOIAUKCNWGAGI-CHWSQXEVSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2C[C@@H](C)N(C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000330597779 465724205 /nfs/dbraw/zinc/72/42/05/465724205.db2.gz SNOIAUKCNWGAGI-CHWSQXEVSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@@H](C)N(C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000330597779 465724213 /nfs/dbraw/zinc/72/42/13/465724213.db2.gz SNOIAUKCNWGAGI-CHWSQXEVSA-N 1 1 334.420 2.256 20 5 EEBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C[C@@H]2C)cc1SC ZINC000330675924 465758018 /nfs/dbraw/zinc/75/80/18/465758018.db2.gz SUOONVOQPBVFJM-JTQLQIEISA-N 1 1 339.417 2.101 20 5 EEBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C[C@@H]2C)cc1SC ZINC000330675924 465758025 /nfs/dbraw/zinc/75/80/25/465758025.db2.gz SUOONVOQPBVFJM-JTQLQIEISA-N 1 1 339.417 2.101 20 5 EEBDMO CN(C)C(=O)N1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C(C)(C)C1 ZINC000330700164 465766995 /nfs/dbraw/zinc/76/69/95/465766995.db2.gz MZMXFTYYAFJYOL-UHFFFAOYSA-N 1 1 334.420 2.215 20 5 EEBDMO CN(C)C(=O)N1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C(C)(C)C1 ZINC000330700164 465767005 /nfs/dbraw/zinc/76/70/05/465767005.db2.gz MZMXFTYYAFJYOL-UHFFFAOYSA-N 1 1 334.420 2.215 20 5 EEBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000346176627 465963463 /nfs/dbraw/zinc/96/34/63/465963463.db2.gz KDXZHWCYMHLWEZ-GRDNDAEWSA-N 1 1 347.415 2.162 20 5 EEBDMO CNc1c(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000346216392 465999956 /nfs/dbraw/zinc/99/99/56/465999956.db2.gz INJDWGMKRACHCX-WOSRLPQWSA-N 1 1 346.431 2.439 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)CSc3ccccc3[N+](=O)[O-])C2)C1 ZINC000346264293 466039172 /nfs/dbraw/zinc/03/91/72/466039172.db2.gz CQMIZRAEGJASJU-MRXNPFEDSA-N 1 1 335.429 2.241 20 5 EEBDMO Cn1cc(C[N@H+]2C[C@@H]3CC[C@H](O)[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000346336016 466085752 /nfs/dbraw/zinc/08/57/52/466085752.db2.gz PKEZPCMUBWTZAM-JQFCIGGWSA-N 1 1 342.399 2.198 20 5 EEBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C)C[N@@H+](C)C(C)C ZINC000349785228 466238706 /nfs/dbraw/zinc/23/87/06/466238706.db2.gz SUVRFNXHNHHRAI-GFCCVEGCSA-N 1 1 343.449 2.164 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](n2cccn2)C1 ZINC000338722559 466335494 /nfs/dbraw/zinc/33/54/94/466335494.db2.gz CUNTUZJEIDFLRY-BBRMVZONSA-N 1 1 343.387 2.455 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](n2cccn2)C1 ZINC000338722559 466335500 /nfs/dbraw/zinc/33/55/00/466335500.db2.gz CUNTUZJEIDFLRY-BBRMVZONSA-N 1 1 343.387 2.455 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1CCC(n2cccn2)CC1 ZINC000372604322 466502024 /nfs/dbraw/zinc/50/20/24/466502024.db2.gz JCNMNKZQTFWLJV-UHFFFAOYSA-N 1 1 343.387 2.375 20 5 EEBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)COc1ccccc1[N+](=O)[O-] ZINC000354446060 466573930 /nfs/dbraw/zinc/57/39/30/466573930.db2.gz MZNHXYIKOZCTFN-CQSZACIVSA-N 1 1 335.404 2.354 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@H+]1CCCC(C)(C)C1 ZINC000347428771 466628806 /nfs/dbraw/zinc/62/88/06/466628806.db2.gz JUEVYEBSUSIUEF-UHFFFAOYSA-N 1 1 335.404 2.455 20 5 EEBDMO Cn1ccnc1[C@H](N[C@@H]1CC[C@H](C[NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000423511388 466762569 /nfs/dbraw/zinc/76/25/69/466762569.db2.gz QEKKUWZIQZVBIX-JGGQBBKZSA-N 1 1 329.404 2.135 20 5 EEBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000365315441 466777210 /nfs/dbraw/zinc/77/72/10/466777210.db2.gz JHBOZSNVNUWJRN-UONOGXRCSA-N 1 1 333.388 2.107 20 5 EEBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000373405225 466793023 /nfs/dbraw/zinc/79/30/23/466793023.db2.gz NOKARFFRVFSSDY-OLZOCXBDSA-N 1 1 333.388 2.350 20 5 EEBDMO COC(=O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000411346044 466810409 /nfs/dbraw/zinc/81/04/09/466810409.db2.gz LSEMFEPAMFOHDH-UHFFFAOYSA-N 1 1 349.387 2.341 20 5 EEBDMO CCOC(=O)[C@@H](C)[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000411612579 466855271 /nfs/dbraw/zinc/85/52/71/466855271.db2.gz ACXPALLLXRPTBM-GFCCVEGCSA-N 1 1 349.387 2.339 20 5 EEBDMO CCOC(=O)[C@@H](C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000411612579 466855278 /nfs/dbraw/zinc/85/52/78/466855278.db2.gz ACXPALLLXRPTBM-GFCCVEGCSA-N 1 1 349.387 2.339 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000412065754 466991967 /nfs/dbraw/zinc/99/19/67/466991967.db2.gz KVWDYUKJKCJMLU-MRXNPFEDSA-N 1 1 332.360 2.246 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000412065754 466991971 /nfs/dbraw/zinc/99/19/71/466991971.db2.gz KVWDYUKJKCJMLU-MRXNPFEDSA-N 1 1 332.360 2.246 20 5 EEBDMO CC(C)[C@H]1CN(C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000425488952 467098735 /nfs/dbraw/zinc/09/87/35/467098735.db2.gz XNASANSUUSJCRF-MRXNPFEDSA-N 1 1 334.420 2.195 20 5 EEBDMO CC(C)[C@H]1C[N@H+](C)CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000425488952 467098737 /nfs/dbraw/zinc/09/87/37/467098737.db2.gz XNASANSUUSJCRF-MRXNPFEDSA-N 1 1 334.420 2.195 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C)CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000425488952 467098740 /nfs/dbraw/zinc/09/87/40/467098740.db2.gz XNASANSUUSJCRF-MRXNPFEDSA-N 1 1 334.420 2.195 20 5 EEBDMO CN1CC[NH+](CCCNc2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000413029082 467157734 /nfs/dbraw/zinc/15/77/34/467157734.db2.gz FKDYEXFTULGGLL-UHFFFAOYSA-N 1 1 347.341 2.058 20 5 EEBDMO C[N@@H+](CCCCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C1CC1 ZINC000413350587 467223025 /nfs/dbraw/zinc/22/30/25/467223025.db2.gz XBSGAKVIXVDZAY-UHFFFAOYSA-N 1 1 341.433 2.285 20 5 EEBDMO C[N@H+]1CCC[C@@H](CCNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000413451657 467245424 /nfs/dbraw/zinc/24/54/24/467245424.db2.gz ZYNBGBZNVABTTH-LBPRGKRZSA-N 1 1 341.433 2.142 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)NCCC[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000433861809 467359205 /nfs/dbraw/zinc/35/92/05/467359205.db2.gz FUGQGQIZHDVPFS-GFCCVEGCSA-N 1 1 337.424 2.436 20 5 EEBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](n2cc(C[NH3+])nn2)C1 ZINC000420376159 467384373 /nfs/dbraw/zinc/38/43/73/467384373.db2.gz JQGKKHTWIRWRKD-TZMCWYRMSA-N 1 1 330.392 2.043 20 5 EEBDMO CNc1c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cccc1[N+](=O)[O-] ZINC000434418923 467397871 /nfs/dbraw/zinc/39/78/71/467397871.db2.gz GXHYASLXZMDMOV-CYBMUJFWSA-N 1 1 332.404 2.383 20 5 EEBDMO CN(C)C(=O)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000414502464 467416525 /nfs/dbraw/zinc/41/65/25/467416525.db2.gz UOQMEPFWJIRIIT-SNVBAGLBSA-N 1 1 343.330 2.106 20 5 EEBDMO CN(C)C(=O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000414502464 467416530 /nfs/dbraw/zinc/41/65/30/467416530.db2.gz UOQMEPFWJIRIIT-SNVBAGLBSA-N 1 1 343.330 2.106 20 5 EEBDMO CC(C)[N@@H+](C)C[C@@H](O)COc1ccc(Br)cc1[N+](=O)[O-] ZINC000394283189 467432700 /nfs/dbraw/zinc/43/27/00/467432700.db2.gz HIUNZVWWCSNKFL-LLVKDONJSA-N 1 1 347.209 2.437 20 5 EEBDMO CCCn1cc[nH+]c1CCCN(C)c1c(C(N)=O)cccc1[N+](=O)[O-] ZINC000420611020 467433874 /nfs/dbraw/zinc/43/38/74/467433874.db2.gz MDMVXNIYDRTGOO-UHFFFAOYSA-N 1 1 345.403 2.369 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)C[C@@H](CO)C1 ZINC000420930119 467518509 /nfs/dbraw/zinc/51/85/09/467518509.db2.gz BUXGLCIPOYBMFM-TZMCWYRMSA-N 1 1 335.404 2.182 20 5 EEBDMO Cc1cc(OCC(=O)NCC[C@@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-] ZINC000458214300 467790461 /nfs/dbraw/zinc/79/04/61/467790461.db2.gz MLGCKJIHGRASLN-AWEZNQCLSA-N 1 1 335.404 2.130 20 5 EEBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000450315468 467824599 /nfs/dbraw/zinc/82/45/99/467824599.db2.gz DMNYXQDXRCCZDA-UONOGXRCSA-N 1 1 347.415 2.499 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000450315468 467824605 /nfs/dbraw/zinc/82/46/05/467824605.db2.gz DMNYXQDXRCCZDA-UONOGXRCSA-N 1 1 347.415 2.499 20 5 EEBDMO C[C@@H](C(=O)NCCC[N@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000514642134 467944842 /nfs/dbraw/zinc/94/48/42/467944842.db2.gz MPEKJWJCYIYEGM-LSDHHAIUSA-N 1 1 349.431 2.315 20 5 EEBDMO Cc1[nH+]cn(-c2ccc(NC(=O)c3c[nH]nc3[N+](=O)[O-])cc2)c1C ZINC000515361376 467988410 /nfs/dbraw/zinc/98/84/10/467988410.db2.gz IHQFTUHDQCYVDR-UHFFFAOYSA-N 1 1 326.316 2.373 20 5 EEBDMO CNc1ccc(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000516139217 468014450 /nfs/dbraw/zinc/01/44/50/468014450.db2.gz YMIGORWWVDBAED-CQSZACIVSA-N 1 1 332.404 2.383 20 5 EEBDMO COc1ccc(CC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000531726245 468071757 /nfs/dbraw/zinc/07/17/57/468071757.db2.gz SKBNJXMZGGFXQP-LSDHHAIUSA-N 1 1 347.415 2.089 20 5 EEBDMO CC(C)[C@H](CNC(=O)/C=C\c1cccc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000490607440 468224962 /nfs/dbraw/zinc/22/49/62/468224962.db2.gz SHSLBEYIKVQGCH-TUYSUELWSA-N 1 1 347.415 2.081 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000594418819 468579914 /nfs/dbraw/zinc/57/99/14/468579914.db2.gz LVYALHIIRHEHER-VXGBXAGGSA-N 1 1 335.408 2.188 20 5 EEBDMO C[C@@H]1CC2(C[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CCOCC2 ZINC000592183020 468648214 /nfs/dbraw/zinc/64/82/14/468648214.db2.gz HGSQGMVWZNBZFJ-GFCCVEGCSA-N 1 1 333.388 2.085 20 5 EEBDMO Cc1ccc(S(=O)(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000594801465 468691889 /nfs/dbraw/zinc/69/18/89/468691889.db2.gz OXQCEISWPIJQOZ-LBPRGKRZSA-N 1 1 341.433 2.054 20 5 EEBDMO CN(CCN1CC[NH2+]CC1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000592428408 468695275 /nfs/dbraw/zinc/69/52/75/468695275.db2.gz JAWGSAGUCSMZTL-UHFFFAOYSA-N 1 1 344.415 2.192 20 5 EEBDMO COc1cc(CNCc2ccc(C[NH3+])cc2)c([N+](=O)[O-])cc1OC ZINC000592438858 468698492 /nfs/dbraw/zinc/69/84/92/468698492.db2.gz PVFPMPQKKXYXHF-UHFFFAOYSA-N 1 1 331.372 2.361 20 5 EEBDMO C[C@H]([C@H](C)Nc1ccnc2ccc([N+](=O)[O-])cc21)[NH+]1CCOCC1 ZINC000601113917 468745196 /nfs/dbraw/zinc/74/51/96/468745196.db2.gz JITNXDKERPHEFY-QWHCGFSZSA-N 1 1 330.388 2.086 20 5 EEBDMO COCCn1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cn1 ZINC000595038477 468747276 /nfs/dbraw/zinc/74/72/76/468747276.db2.gz KIMUUOKCMWUZDX-LBPRGKRZSA-N 1 1 334.376 2.297 20 5 EEBDMO Cc1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc(C)n1 ZINC000595374539 468830638 /nfs/dbraw/zinc/83/06/38/468830638.db2.gz FHKGCISNVLVYDK-ZDUSSCGKSA-N 1 1 328.376 2.083 20 5 EEBDMO Cc1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc(C)n1 ZINC000595374539 468830641 /nfs/dbraw/zinc/83/06/41/468830641.db2.gz FHKGCISNVLVYDK-ZDUSSCGKSA-N 1 1 328.376 2.083 20 5 EEBDMO CC(C)O[C@H]1CCC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000593055777 468854587 /nfs/dbraw/zinc/85/45/87/468854587.db2.gz PAWDTHYKQBGQLZ-INIZCTEOSA-N 1 1 347.415 2.373 20 5 EEBDMO CC(C)O[C@H]1CCC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000593055777 468854590 /nfs/dbraw/zinc/85/45/90/468854590.db2.gz PAWDTHYKQBGQLZ-INIZCTEOSA-N 1 1 347.415 2.373 20 5 EEBDMO Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598560974 468913517 /nfs/dbraw/zinc/91/35/17/468913517.db2.gz OWPNFXLQPFZDJO-CYBMUJFWSA-N 1 1 332.404 2.029 20 5 EEBDMO C[C@@H](C(=O)N1CC[N@@H+](CC(C)(C)O)C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000562301311 468933189 /nfs/dbraw/zinc/93/31/89/468933189.db2.gz LINDRQLKJLIFEK-ZIAGYGMSSA-N 1 1 349.431 2.002 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](C)[C@@H](CO)C2)cccc1[N+](=O)[O-] ZINC000598652427 468945824 /nfs/dbraw/zinc/94/58/24/468945824.db2.gz YZPZEHXBXIDGLP-GXTWGEPZSA-N 1 1 335.404 2.182 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@H]1[C@H](C)CO ZINC000595672347 468948425 /nfs/dbraw/zinc/94/84/25/468948425.db2.gz ICBSKGXPPJQNHC-CJNGLKHVSA-N 1 1 335.404 2.325 20 5 EEBDMO C[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C[C@@H]1COCCO1 ZINC000595737541 468980185 /nfs/dbraw/zinc/98/01/85/468980185.db2.gz RVVDDOBTXGMRMY-GFCCVEGCSA-N 1 1 345.193 2.205 20 5 EEBDMO C[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C[C@@H]1COCCO1 ZINC000595737541 468980189 /nfs/dbraw/zinc/98/01/89/468980189.db2.gz RVVDDOBTXGMRMY-GFCCVEGCSA-N 1 1 345.193 2.205 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H](c2nncn2C(C)C)C1 ZINC000602800251 469084575 /nfs/dbraw/zinc/08/45/75/469084575.db2.gz XLCLKCQUCAQDGD-AWEZNQCLSA-N 1 1 347.423 2.152 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000615037256 469127053 /nfs/dbraw/zinc/12/70/53/469127053.db2.gz JQPVPJYWDOLJFL-HNNXBMFYSA-N 1 1 348.403 2.232 20 5 EEBDMO O=c1[nH]ccc(N2CCC[N@@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000596063362 469134906 /nfs/dbraw/zinc/13/49/06/469134906.db2.gz QAOLHONBIDPQCJ-UHFFFAOYSA-N 1 1 328.372 2.408 20 5 EEBDMO C[N@H+]1CCCC[C@H](CNC(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000599161176 469142973 /nfs/dbraw/zinc/14/29/73/469142973.db2.gz URRCSDLZZBMIJE-CQSZACIVSA-N 1 1 349.435 2.038 20 5 EEBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc(N)c([N+](=O)[O-])n2)C1 ZINC000596090501 469150341 /nfs/dbraw/zinc/15/03/41/469150341.db2.gz WKXAAOJGINYJMD-TZMCWYRMSA-N 1 1 327.388 2.819 20 5 EEBDMO COc1ccc(CC(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000573778449 469202504 /nfs/dbraw/zinc/20/25/04/469202504.db2.gz XFVBKNDFWGKQOA-AWEZNQCLSA-N 1 1 335.404 2.087 20 5 EEBDMO CC[C@]1(O)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000602984006 469206410 /nfs/dbraw/zinc/20/64/10/469206410.db2.gz ZJTDAPKWFZWCTO-KRWDZBQOSA-N 1 1 335.404 2.469 20 5 EEBDMO CN(Cc1cc2c(cc1[N+](=O)[O-])OCCO2)CC1CC[NH+](C)CC1 ZINC000611268532 469215181 /nfs/dbraw/zinc/21/51/81/469215181.db2.gz GFOAUNVDENTMGO-UHFFFAOYSA-N 1 1 335.404 2.140 20 5 EEBDMO O=c1[nH]ccc(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)c1[N+](=O)[O-] ZINC000596281033 469231039 /nfs/dbraw/zinc/23/10/39/469231039.db2.gz LQFUCXSEIPGYDN-GOEBONIOSA-N 1 1 340.383 2.406 20 5 EEBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)[N@@H+]1CCc2sccc2C1 ZINC000603569934 469411750 /nfs/dbraw/zinc/41/17/50/469411750.db2.gz HOYKMSBPYKJTOK-NSHDSACASA-N 1 1 348.428 2.171 20 5 EEBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)[N@H+]1CCc2sccc2C1 ZINC000603569934 469411755 /nfs/dbraw/zinc/41/17/55/469411755.db2.gz HOYKMSBPYKJTOK-NSHDSACASA-N 1 1 348.428 2.171 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](n2ccnc2)C1 ZINC000609157349 469897293 /nfs/dbraw/zinc/89/72/93/469897293.db2.gz FKXHEQJSARYTCO-BBRMVZONSA-N 1 1 343.387 2.455 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](n2ccnc2)C1 ZINC000609157349 469897299 /nfs/dbraw/zinc/89/72/99/469897299.db2.gz FKXHEQJSARYTCO-BBRMVZONSA-N 1 1 343.387 2.455 20 5 EEBDMO O=C(C[N@@H+](CCCO)C1CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000609849184 469965444 /nfs/dbraw/zinc/96/54/44/469965444.db2.gz LPYMGVLJZVIEDW-UHFFFAOYSA-N 1 1 327.768 2.034 20 5 EEBDMO O=C(C[N@H+](CCCO)C1CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000609849184 469965447 /nfs/dbraw/zinc/96/54/47/469965447.db2.gz LPYMGVLJZVIEDW-UHFFFAOYSA-N 1 1 327.768 2.034 20 5 EEBDMO CNc1nc(C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000454772407 485483440 /nfs/dbraw/zinc/48/34/40/485483440.db2.gz XSCOJVVOVFQPDR-ZDUSSCGKSA-N 1 1 349.435 2.416 20 5 EEBDMO NC(=O)[C@H]1CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000155075720 534452413 /nfs/dbraw/zinc/45/24/13/534452413.db2.gz SMOQZAGKQTXRAR-LBPRGKRZSA-N 1 1 346.412 2.416 20 5 EEBDMO NC(=O)[C@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000155075720 534452416 /nfs/dbraw/zinc/45/24/16/534452416.db2.gz SMOQZAGKQTXRAR-LBPRGKRZSA-N 1 1 346.412 2.416 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCN(CCO)CC3)s2)cc1 ZINC000154559561 534881022 /nfs/dbraw/zinc/88/10/22/534881022.db2.gz BIFGIGVMWJDJTD-UHFFFAOYSA-N 1 1 347.440 2.433 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000451729077 536141255 /nfs/dbraw/zinc/14/12/55/536141255.db2.gz IXCGEPRJCFKSTQ-AWEZNQCLSA-N 1 1 337.420 2.398 20 5 EEBDMO C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@H](CO)CC(C)(C)C ZINC000451772517 536418840 /nfs/dbraw/zinc/41/88/40/536418840.db2.gz ASZFRKJVZJQUHK-LSDHHAIUSA-N 1 1 340.420 2.063 20 5 EEBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)[C@@H]2C1 ZINC000425061515 536487703 /nfs/dbraw/zinc/48/77/03/536487703.db2.gz ZDZSEQFGCGKFOK-SWLSCSKDSA-N 1 1 337.807 2.343 20 5 EEBDMO CCC[N@H+](CC)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000727822091 576451092 /nfs/dbraw/zinc/45/10/92/576451092.db2.gz VPVGBXNYFVANHA-MRXNPFEDSA-N 1 1 334.376 2.051 20 5 EEBDMO CCC[N@@H+](CC)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000727822091 576451094 /nfs/dbraw/zinc/45/10/94/576451094.db2.gz VPVGBXNYFVANHA-MRXNPFEDSA-N 1 1 334.376 2.051 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CNC(=S)NNc1cccc([N+](=O)[O-])c1C ZINC000727981576 576465439 /nfs/dbraw/zinc/46/54/39/576465439.db2.gz OJZMADKUQKXVPE-LBPRGKRZSA-N 1 1 337.449 2.179 20 5 EEBDMO CCCC(=O)NC[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776580953 577463137 /nfs/dbraw/zinc/46/31/37/577463137.db2.gz APIUVJZKNZAGGD-WMLDXEAASA-N 1 1 349.431 2.257 20 5 EEBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CC[C@H](n4cncn4)C3)c2c1 ZINC000776778555 577468029 /nfs/dbraw/zinc/46/80/29/577468029.db2.gz QBHMLFCFTSZSPF-NSHDSACASA-N 1 1 346.372 2.368 20 5 EEBDMO 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331.420 2.425 20 5 EEBDMO O=C(c1cc[nH]c1)N1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc([N+](=O)[O-])cc1 ZINC001029317695 683972955 /nfs/dbraw/zinc/97/29/55/683972955.db2.gz JVKLLCTUPQSOJM-CALCHBBNSA-N 1 1 340.383 2.412 20 5 EEBDMO O=C(c1cc[nH]c1)N1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc([N+](=O)[O-])cc1 ZINC001029317695 683972957 /nfs/dbraw/zinc/97/29/57/683972957.db2.gz JVKLLCTUPQSOJM-CALCHBBNSA-N 1 1 340.383 2.412 20 5 EEBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@@H](CF)C2)cc1[N+](=O)[O-] ZINC000895544383 684638696 /nfs/dbraw/zinc/63/86/96/684638696.db2.gz LAAYDHVJFPNADT-ZDUSSCGKSA-N 1 1 340.351 2.328 20 5 EEBDMO Cc1ccc(C[N@H+](C)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1C ZINC000985427133 686676304 /nfs/dbraw/zinc/67/63/04/686676304.db2.gz XKPOOCKSALBWAS-QZTJIDSGSA-N 1 1 345.443 2.391 20 5 EEBDMO Cc1ccc(C[N@@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1C ZINC000985427133 686676309 /nfs/dbraw/zinc/67/63/09/686676309.db2.gz XKPOOCKSALBWAS-QZTJIDSGSA-N 1 1 345.443 2.391 20 5 EEBDMO 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ZINC000813173237 1201141897 /nfs/dbraw/zinc/14/18/97/1201141897.db2.gz WCZDMEACUSMOAJ-INIZCTEOSA-N 1 1 327.340 2.421 20 5 EEBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cccnc1 ZINC000813173237 1201141901 /nfs/dbraw/zinc/14/19/01/1201141901.db2.gz WCZDMEACUSMOAJ-INIZCTEOSA-N 1 1 327.340 2.421 20 5 EEBDMO CSc1ccccc1OC[C@H](O)C[N@@H+](CC[N+](=O)[O-])C(C)C ZINC000930720820 1206578257 /nfs/dbraw/zinc/57/82/57/1206578257.db2.gz TYUSVJGHHWWEGR-CYBMUJFWSA-N 1 1 328.434 2.135 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2 ZINC000931725478 1207450279 /nfs/dbraw/zinc/45/02/79/1207450279.db2.gz WOWJDVJXRBGVQN-MJBXVCDLSA-N 1 1 332.404 2.090 20 5 EEBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000935211992 1208115791 /nfs/dbraw/zinc/11/57/91/1208115791.db2.gz FIWCKCQTYORFFM-YUMQZZPRSA-N 1 1 344.774 2.134 20 5 EEBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000935211992 1208115792 /nfs/dbraw/zinc/11/57/92/1208115792.db2.gz FIWCKCQTYORFFM-YUMQZZPRSA-N 1 1 344.774 2.134 20 5 EEBDMO Cc1cccc(C)c1C[N@@H+]1CC=C(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001000669829 1240698122 /nfs/dbraw/zinc/69/81/22/1240698122.db2.gz MIDLMXGTXIMWOR-SJLPKXTDSA-N 1 1 343.427 2.217 20 5 EEBDMO Cc1cccc(C)c1C[N@H+]1CC=C(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001000669829 1240698127 /nfs/dbraw/zinc/69/81/27/1240698127.db2.gz MIDLMXGTXIMWOR-SJLPKXTDSA-N 1 1 343.427 2.217 20 5 EEBDMO Cc1cccc(C)c1C[N@@H+]1CC=C(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001000669829 1240698134 /nfs/dbraw/zinc/69/81/34/1240698134.db2.gz MIDLMXGTXIMWOR-SJLPKXTDSA-N 1 1 343.427 2.217 20 5 EEBDMO Cc1cc(Cl)c(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-] ZINC000827105173 1249941101 /nfs/dbraw/zinc/94/11/01/1249941101.db2.gz HOUYKOTVYSHINE-HZMBPMFUSA-N 1 1 341.795 2.006 20 5 EEBDMO Cc1cc(Cl)c(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-] ZINC000827105173 1249941106 /nfs/dbraw/zinc/94/11/06/1249941106.db2.gz HOUYKOTVYSHINE-HZMBPMFUSA-N 1 1 341.795 2.006 20 5 EEBDMO CC(C)OCC(=O)N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001195071452 1283427808 /nfs/dbraw/zinc/42/78/08/1283427808.db2.gz BNICDDOYKXNOCU-UHFFFAOYSA-N 1 1 335.404 2.054 20 5 EEBDMO CC(C)OCC(=O)N1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001195071452 1283427812 /nfs/dbraw/zinc/42/78/12/1283427812.db2.gz BNICDDOYKXNOCU-UHFFFAOYSA-N 1 1 335.404 2.054 20 5 EEBDMO [NH3+][C@H]1CN(C(F)(F)c2cc([N+](=O)[O-])cnc2Cl)CCC1(F)F ZINC001164319449 1321350851 /nfs/dbraw/zinc/35/08/51/1321350851.db2.gz GWLGOXUPWMCZBP-QMMMGPOBSA-N 1 1 342.680 2.361 20 5 EEBDMO COc1cc(Br)c(O[C@@H]2CC[N@H+](C)C2)c([N+](=O)[O-])c1 ZINC001226283759 1301336069 /nfs/dbraw/zinc/33/60/69/1301336069.db2.gz XQHUKWCMOHPFCP-MRVPVSSYSA-N 1 1 331.166 2.449 20 5 EEBDMO COc1cc(Br)c(O[C@@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])c1 ZINC001226283759 1301336082 /nfs/dbraw/zinc/33/60/82/1301336082.db2.gz XQHUKWCMOHPFCP-MRVPVSSYSA-N 1 1 331.166 2.449 20 5 EEBDMO C[N@H+]1CC[C@@H](Oc2cccc(I)c2[N+](=O)[O-])C1 ZINC001229656371 1302908305 /nfs/dbraw/zinc/90/83/05/1302908305.db2.gz FCJXWBCSZRYXMS-MRVPVSSYSA-N 1 1 348.140 2.282 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCC1(Nc2ncc([N+](=O)[O-])cc2C)CCC1 ZINC001111828254 1303958088 /nfs/dbraw/zinc/95/80/88/1303958088.db2.gz XZERIGIHWBAZHC-UHFFFAOYSA-N 1 1 349.435 2.091 20 5 EEBDMO O=C(NCC1([NH2+]Cc2ccccc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530923 1305286346 /nfs/dbraw/zinc/28/63/46/1305286346.db2.gz ZBDMHNLGNVYPHP-HZPDHXFCSA-N 1 1 331.416 2.261 20 5 EEBDMO C[NH+](C)Cc1nnc(-c2ccc(Br)cc2[N+](=O)[O-])o1 ZINC001117260778 1306015991 /nfs/dbraw/zinc/01/59/91/1306015991.db2.gz VTAMFXDCTMOTAE-UHFFFAOYSA-N 1 1 327.138 2.469 20 5 EEBDMO COc1ccncc1-c1noc([C@H]([NH3+])Cc2cccc([N+](=O)[O-])c2)n1 ZINC001248209594 1310863532 /nfs/dbraw/zinc/86/35/32/1310863532.db2.gz RCTNFOIASQQLRL-CYBMUJFWSA-N 1 1 341.327 2.291 20 5 EEBDMO C[NH2+][C@@H](COC(C)(C)C)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001248221684 1310866755 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YLGHFCKTANRIBZ-GFCCVEGCSA-N 1 1 336.392 2.310 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCC[C@@H](Oc3ncccn3)C1)C2 ZINC001254611320 1318144392 /nfs/dbraw/zinc/14/43/92/1318144392.db2.gz PNRHOCUYABTKQK-DLBZAZTESA-N 1 1 340.383 2.395 20 5 EEBDMO N=C(NCCCC[NH3+])Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC001157101253 1318402911 /nfs/dbraw/zinc/40/29/11/1318402911.db2.gz BZVSUXYCUJJFIT-UHFFFAOYSA-N 1 1 346.366 2.471 20 5 EEBDMO COc1cc(N2CCC([N@@H+]3CCC34COC4)CC2)ccc1[N+](=O)[O-] ZINC001256099860 1318647089 /nfs/dbraw/zinc/64/70/89/1318647089.db2.gz YWIMBRXZTYLEMB-UHFFFAOYSA-N 1 1 333.388 2.047 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CCC34COC4)CC2)ccc1[N+](=O)[O-] ZINC001256099860 1318647096 /nfs/dbraw/zinc/64/70/96/1318647096.db2.gz YWIMBRXZTYLEMB-UHFFFAOYSA-N 1 1 333.388 2.047 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CC[C@]34CCOC4)CC2)ccc1[N+](=O)[O-] ZINC001256102008 1318649053 /nfs/dbraw/zinc/64/90/53/1318649053.db2.gz UDZFQUMWOFMUQX-GOSISDBHSA-N 1 1 347.415 2.437 20 5 EEBDMO CCOc1nc(N[C@@H]2CCC[C@@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC001160726664 1320250001 /nfs/dbraw/zinc/25/00/01/1320250001.db2.gz UFQMPAQEIFJCAB-OLZOCXBDSA-N 1 1 336.392 2.054 20 5 EEBDMO C[NH+](C)/C=C/c1cc(NCc2ccnn2CCF)ncc1[N+](=O)[O-] ZINC001162019408 1320722227 /nfs/dbraw/zinc/72/22/27/1320722227.db2.gz JWMPXRLVSNKTDL-QPJJXVBHSA-N 1 1 334.355 2.300 20 5 EEBDMO CC[N@H+]1CCCN(c2nc(SC)nc(Cl)c2[N+](=O)[O-])CC1 ZINC001163771445 1321213445 /nfs/dbraw/zinc/21/34/45/1321213445.db2.gz WHNNJVKGZZZZMB-UHFFFAOYSA-N 1 1 331.829 2.292 20 5 EEBDMO Nc1nc(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)ccc1[N+](=O)[O-] ZINC001165082025 1321451841 /nfs/dbraw/zinc/45/18/41/1321451841.db2.gz CHYSOKTZJUJWRX-GOEBONIOSA-N 1 1 339.399 2.283 20 5 EEBDMO CC(C)[C@@]1(CO)CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000351932959 1321944189 /nfs/dbraw/zinc/94/41/89/1321944189.db2.gz ADASDAILOCSDEQ-AEFFLSMTSA-N 1 1 347.415 2.041 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCCC2(CC[NH2+]CC2)C1 ZINC001261492491 1322114447 /nfs/dbraw/zinc/11/44/47/1322114447.db2.gz HKODYUGNBOPKDJ-CQSZACIVSA-N 1 1 346.431 2.387 20 5 EEBDMO CC(C)(C)OC(=O)NCc1ccc(C[NH2+]CC[N+](=O)[O-])c(F)c1 ZINC001262575920 1322327354 /nfs/dbraw/zinc/32/73/54/1322327354.db2.gz BTJDHEOUWKBAPH-UHFFFAOYSA-N 1 1 327.356 2.217 20 5 EEBDMO CO[C@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@](C)(CO)C1 ZINC001307996012 1331557935 /nfs/dbraw/zinc/55/79/35/1331557935.db2.gz OLHHKFKJNRWPRC-WBVHZDCISA-N 1 1 347.371 2.222 20 5 EEBDMO CO[C@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@](C)(CO)C1 ZINC001307996012 1331557938 /nfs/dbraw/zinc/55/79/38/1331557938.db2.gz OLHHKFKJNRWPRC-WBVHZDCISA-N 1 1 347.371 2.222 20 5 EEBDMO C[C@@H](NC(=O)N1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1)c1ccccc1[N+](=O)[O-] ZINC001313244984 1331799620 /nfs/dbraw/zinc/79/96/20/1331799620.db2.gz YPTRPSTZDMBODI-XNJGSVPQSA-N 1 1 332.404 2.249 20 5 EEBDMO C[NH+](C)[C@@H]1CCCC[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC001318389970 1332522291 /nfs/dbraw/zinc/52/22/91/1332522291.db2.gz KCICEAARTZLWHD-UONOGXRCSA-N 1 1 331.376 2.074 20 5 EEBDMO COC(=O)CC(C)(C)[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001319619720 1332729778 /nfs/dbraw/zinc/72/97/78/1332729778.db2.gz MRJHHPOARZAFFC-UHFFFAOYSA-N 1 1 337.376 2.115 20 5 EEBDMO C[C@@H]1CN(Cc2cc([N+](=O)[O-])ccc2Br)CC[N@H+]1C ZINC001333874118 1336158911 /nfs/dbraw/zinc/15/89/11/1336158911.db2.gz QFSDFNZVVMVUJE-SNVBAGLBSA-N 1 1 328.210 2.493 20 5 EEBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1C1CCCC1 ZINC001336712658 1336584280 /nfs/dbraw/zinc/58/42/80/1336584280.db2.gz MBOMXYNCZWZSHN-GFCCVEGCSA-N 1 1 332.404 2.147 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC001336804607 1336597705 /nfs/dbraw/zinc/59/77/05/1336597705.db2.gz NJLLYKKYIIIUEJ-CRAIPNDOSA-N 1 1 333.432 2.340 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC001336804607 1336597707 /nfs/dbraw/zinc/59/77/07/1336597707.db2.gz NJLLYKKYIIIUEJ-CRAIPNDOSA-N 1 1 333.432 2.340 20 5 EEBDMO CC[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3C)n2C)C[C@@H]1C ZINC001338152360 1336803806 /nfs/dbraw/zinc/80/38/06/1336803806.db2.gz DSUWMYUKUCMLDD-LBPRGKRZSA-N 1 1 344.419 2.229 20 5 EEBDMO CN(C)c1ncccc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001343238859 1337330893 /nfs/dbraw/zinc/33/08/93/1337330893.db2.gz UEONLFFMJDLXDQ-AWEZNQCLSA-N 1 1 342.403 2.137 20 5 EEBDMO Cc1cc(N(C)CCNC(=O)C[N@H+]2CCC(C)(C)C2)ccc1[N+](=O)[O-] ZINC001100346784 1338289985 /nfs/dbraw/zinc/28/99/85/1338289985.db2.gz FVZLJAHXOZXMRJ-UHFFFAOYSA-N 1 1 348.447 2.188 20 5 EEBDMO CCN(CCNC(=O)CC[N@@H+](C)CC)c1ccc([N+](=O)[O-])c(C)c1 ZINC001100606978 1338541614 /nfs/dbraw/zinc/54/16/14/1338541614.db2.gz FREWDHRBVKMJOI-UHFFFAOYSA-N 1 1 336.436 2.188 20 5 EEBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000848352535 1338691136 /nfs/dbraw/zinc/69/11/36/1338691136.db2.gz QIYWJVDFORJHDO-ZIAGYGMSSA-N 1 1 336.367 2.063 20 5 EEBDMO COCc1cnc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)s1 ZINC001579093545 1344338508 /nfs/dbraw/zinc/33/85/08/1344338508.db2.gz AIEGICAWSRZJJN-AWEZNQCLSA-N 1 1 336.373 2.010 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC001607084781 1351411942 /nfs/dbraw/zinc/41/19/42/1351411942.db2.gz YEKLNLJQPAPBPY-LBPRGKRZSA-N 1 1 343.391 2.204 20 5 EEBDMO CO[C@@]1(C)CCC[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000794653682 1369595985 /nfs/dbraw/zinc/59/59/85/1369595985.db2.gz DXAJCOIVDIMGFF-KRWDZBQOSA-N 1 1 348.403 2.295 20 5 EEBDMO CO[C@@]1(C)CCC[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000794653682 1369595987 /nfs/dbraw/zinc/59/59/87/1369595987.db2.gz DXAJCOIVDIMGFF-KRWDZBQOSA-N 1 1 348.403 2.295 20 5 EEBDMO CCN(CCNC(=O)Cn1c[nH+]cc1C)c1ccc([N+](=O)[O-])c(C)c1 ZINC001100658765 1373107581 /nfs/dbraw/zinc/10/75/81/1373107581.db2.gz HERCLBKHWBJXNM-UHFFFAOYSA-N 1 1 345.403 2.051 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1ncccc1F)Cc1ccc([N+](=O)[O-])cc1 ZINC001753091769 1406678718 /nfs/dbraw/zinc/67/87/18/1406678718.db2.gz JGPQYXQOTYFCMN-UHFFFAOYSA-N 1 1 346.362 2.381 20 5 EEBDMO CC[NH+](CC)CC[C@H](C)NC(=O)[C@](C)(N)c1cccc([N+](=O)[O-])c1 ZINC001577684925 1403668920 /nfs/dbraw/zinc/66/89/20/1403668920.db2.gz PKIDYQYISJWIFY-SUMWQHHRSA-N 1 1 336.436 2.005 20 5 EEBDMO CCN(CCNC(=O)C[N@H+]1CCC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC001100729514 1410703559 /nfs/dbraw/zinc/70/35/59/1410703559.db2.gz WPHHGPIAQOMVDM-UHFFFAOYSA-N 1 1 348.447 2.269 20 5 EEBDMO COc1cc2ncnc(N3C[C@H](C)[N@@H+](C)C[C@@H]3C)c2cc1[N+](=O)[O-] ZINC001164642508 719201729 /nfs/dbraw/zinc/20/17/29/719201729.db2.gz WAZMNJJEVHNCSB-QWRGUYRKSA-N 1 1 331.376 2.075 20 5 EEBDMO O=[N+]([O-])c1c(Cl)nc(C2CC2)nc1NCC[NH+]1CCSCC1 ZINC001167832535 776654216 /nfs/dbraw/zinc/65/42/16/776654216.db2.gz JGGCLOVKOBTAQR-UHFFFAOYSA-N 1 1 343.840 2.376 20 5 EEBDMO Cc1nn(C[N@@H+]2CCC[C@@H](n3ccnn3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000819896732 785705324 /nfs/dbraw/zinc/70/53/24/785705324.db2.gz HLCISJUTVKAPNX-CQSZACIVSA-N 1 1 341.375 2.139 20 5 EEBDMO Cc1nn(C[N@H+]2CCC[C@@H](n3ccnn3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000819896732 785705330 /nfs/dbraw/zinc/70/53/30/785705330.db2.gz HLCISJUTVKAPNX-CQSZACIVSA-N 1 1 341.375 2.139 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)NC/C=C\CNc1ccc([N+](=O)[O-])cc1F ZINC001107425434 787201567 /nfs/dbraw/zinc/20/15/67/787201567.db2.gz XOUZWVHGJSAUON-IHWYPQMZSA-N 1 1 347.350 2.023 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000824003010 787996268 /nfs/dbraw/zinc/99/62/68/787996268.db2.gz LHWPEFIQFRMKHE-RYUDHWBXSA-N 1 1 335.408 2.419 20 5 EEBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc(F)c([N+](=O)[O-])cc2F)[C@@H](C)C[N@H+]1C ZINC000844642513 789287287 /nfs/dbraw/zinc/28/72/87/789287287.db2.gz JIMKULUPNMMKCA-AEJSXWLSSA-N 1 1 327.331 2.426 20 5 EEBDMO CNC(=O)C[NH+]1CCC(Nc2cc(Cl)c(F)cc2[N+](=O)[O-])CC1 ZINC000845465369 789794831 /nfs/dbraw/zinc/79/48/31/789794831.db2.gz NOTYINXJMHCKIP-UHFFFAOYSA-N 1 1 344.774 2.010 20 5 EEBDMO CCC[N@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000171603835 791412371 /nfs/dbraw/zinc/41/23/71/791412371.db2.gz ZEVROZDRZRZSAG-QGZVFWFLSA-N 1 1 346.387 2.194 20 5 EEBDMO CCC[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000171603835 791412377 /nfs/dbraw/zinc/41/23/77/791412377.db2.gz ZEVROZDRZRZSAG-QGZVFWFLSA-N 1 1 346.387 2.194 20 5 EEBDMO O=C1NCC[C@@]12CC[N@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172905758 797132125 /nfs/dbraw/zinc/13/21/25/797132125.db2.gz UCTWQHDQTHLAFI-QAPCUYQASA-N 1 1 329.400 2.054 20 5 EEBDMO CC[N@H+]1C[C@@H]2C[C@H]1CN2[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173194335 797282901 /nfs/dbraw/zinc/28/29/01/797282901.db2.gz SQWVSNRVLDEKIP-AGIUHOORSA-N 1 1 337.395 2.452 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N1CCC(Nc2ccc([N+](=O)[O-])c(C)n2)CC1 ZINC001095233745 797565739 /nfs/dbraw/zinc/56/57/39/797565739.db2.gz OUCDHELZGPDTOQ-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO Cc1nn(CN2CC[N@@H+](C)C[C@H]2c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000917462340 798226172 /nfs/dbraw/zinc/22/61/72/798226172.db2.gz DSXJRHUKMDSIQP-INIZCTEOSA-N 1 1 329.404 2.354 20 5 EEBDMO Cc1nn(CN2CC[N@H+](C)C[C@H]2c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000917462340 798226178 /nfs/dbraw/zinc/22/61/78/798226178.db2.gz DSXJRHUKMDSIQP-INIZCTEOSA-N 1 1 329.404 2.354 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)NCC1(Nc2cc(C)ccc2[N+](=O)[O-])CC1 ZINC001110279463 801118533 /nfs/dbraw/zinc/11/85/33/801118533.db2.gz IOJINHINMPIDOI-UHFFFAOYSA-N 1 1 343.387 2.169 20 5 EEBDMO COc1ccc(CC[N@@H+](C[C@H](C)O)[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001169007233 803568518 /nfs/dbraw/zinc/56/85/18/803568518.db2.gz LZKKPCHJQYVHPJ-USXIJHARSA-N 1 1 336.432 2.366 20 5 EEBDMO CC(C)(C)OC(=O)N[C@H]1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169009692 803570395 /nfs/dbraw/zinc/57/03/95/803570395.db2.gz XHAVJBAEMKLTFD-MELADBBJSA-N 1 1 327.425 2.421 20 5 EEBDMO C[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CCN1C(=O)OC(C)(C)C ZINC001169011794 803571408 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KFWNZFMELOVHLR-RHSMWYFYSA-N 1 1 336.388 2.244 20 5 EEBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1ncc([N+](=O)[O-])cc1F ZINC000413201264 467188762 /nfs/dbraw/zinc/18/87/62/467188762.db2.gz LDGLAIQYDTVJJE-UHFFFAOYSA-N 1 1 333.323 2.413 20 5 EEBDMO CN(C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000433378030 467325077 /nfs/dbraw/zinc/32/50/77/467325077.db2.gz YAIRHZYKMAWVHB-BBRMVZONSA-N 1 1 343.387 2.083 20 5 EEBDMO C[C@@H]1CC[C@@H]([N@@H+](CCO)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000429775574 467369569 /nfs/dbraw/zinc/36/95/69/467369569.db2.gz PZJJNVPIPGHPFO-CZUORRHYSA-N 1 1 335.404 2.041 20 5 EEBDMO CN(C[C@@H]1CCC[N@H+]1C)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000420633513 467438323 /nfs/dbraw/zinc/43/83/23/467438323.db2.gz JIORMGRSDYPOGK-AWEZNQCLSA-N 1 1 332.404 2.017 20 5 EEBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NCC[C@@H]1CCC[N@@H+](C)C1 ZINC000458208060 467790056 /nfs/dbraw/zinc/79/00/56/467790056.db2.gz JUSHMFVUXBHNHJ-ZDUSSCGKSA-N 1 1 335.404 2.455 20 5 EEBDMO 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346.431 2.341 20 5 EEBDMO CC[N@H+](CCSC)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000592201380 468654442 /nfs/dbraw/zinc/65/44/42/468654442.db2.gz SETPKISIEUWRKS-UHFFFAOYSA-N 1 1 327.406 2.227 20 5 EEBDMO CC[N@@H+](CCSC)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000592201380 468654444 /nfs/dbraw/zinc/65/44/44/468654444.db2.gz SETPKISIEUWRKS-UHFFFAOYSA-N 1 1 327.406 2.227 20 5 EEBDMO C[C@@H](C(=O)NCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000583849038 468762948 /nfs/dbraw/zinc/76/29/48/468762948.db2.gz CXFUNVNJJDGSIV-QLFBSQMISA-N 1 1 349.431 2.314 20 5 EEBDMO CCOC(=O)c1ccnc(N2CCC[N@@H+](C)C[C@H]2CC)c1[N+](=O)[O-] ZINC000601190093 468776248 /nfs/dbraw/zinc/77/62/48/468776248.db2.gz ZSSUCNLIKKQZLI-GFCCVEGCSA-N 1 1 336.392 2.087 20 5 EEBDMO CCC[N@H+]1CC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000595353276 468822876 /nfs/dbraw/zinc/82/28/76/468822876.db2.gz DLDHYHVEDZVTRN-JTQLQIEISA-N 1 1 347.824 2.011 20 5 EEBDMO CC(C)(C)OC(=O)C[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000593089999 468866891 /nfs/dbraw/zinc/86/68/91/468866891.db2.gz COQQWYKMOBHZFH-ZDUSSCGKSA-N 1 1 338.408 2.378 20 5 EEBDMO CC(C)n1cc(C2=CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)CC2)nn1 ZINC000595520155 468887004 /nfs/dbraw/zinc/88/70/04/468887004.db2.gz YQRUAGLDOPJRFT-UHFFFAOYSA-N 1 1 345.407 2.143 20 5 EEBDMO CC(C)[N@@H+](C)C[C@@H](O)CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000595521863 468887901 /nfs/dbraw/zinc/88/79/01/468887901.db2.gz FXDSCXQLLXMSFW-FUHWJXTLSA-N 1 1 335.448 2.475 20 5 EEBDMO CC(C)=CCC[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000595544639 468895634 /nfs/dbraw/zinc/89/56/34/468895634.db2.gz BKSYUPDPPKYUAO-UHFFFAOYSA-N 1 1 341.433 2.161 20 5 EEBDMO CC(C)[C@H]1CN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC[NH2+]1 ZINC000598574518 468919243 /nfs/dbraw/zinc/91/92/43/468919243.db2.gz RHESLYBUTROFAE-MRXNPFEDSA-N 1 1 343.387 2.055 20 5 EEBDMO CCOc1cc(N2CCN([C@H]3CCC[N@@H+](C)C3)CC2)ccc1[N+](=O)[O-] ZINC000610515365 468991061 /nfs/dbraw/zinc/99/10/61/468991061.db2.gz OSUIOLDXUBLQHR-INIZCTEOSA-N 1 1 348.447 2.210 20 5 EEBDMO CCOC(=O)c1ccnc(NC[C@H]2CCCC[N@@H+](C)C2)c1[N+](=O)[O-] ZINC000599137665 469132501 /nfs/dbraw/zinc/13/25/01/469132501.db2.gz BGXZDNIDCIQCHT-GFCCVEGCSA-N 1 1 336.392 2.310 20 5 EEBDMO O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+]1C1CCCC1 ZINC000602037418 469156458 /nfs/dbraw/zinc/15/64/58/469156458.db2.gz ANTVMFJIEWNYAF-INIZCTEOSA-N 1 1 332.404 2.140 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@H](c3nccn3C)C2)c([N+](=O)[O-])cc1F ZINC000563350606 469233897 /nfs/dbraw/zinc/23/38/97/469233897.db2.gz PIHFDGBHJRDEIT-NSHDSACASA-N 1 1 334.351 2.466 20 5 EEBDMO C[N@@H+](CCc1ccncc1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000612584791 469501959 /nfs/dbraw/zinc/50/19/59/469501959.db2.gz VQDAHEWGVGNEGE-UHFFFAOYSA-N 1 1 329.356 2.436 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3C[C@@H]4C[C@H](O)CC[C@@H]4C3)o2)cc1 ZINC000595634017 485606774 /nfs/dbraw/zinc/60/67/74/485606774.db2.gz TWUCEGFWANEGOW-VNHYZAJKSA-N 1 1 344.371 2.238 20 5 EEBDMO C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H](CO)CC(C)(C)C ZINC000451788484 536419562 /nfs/dbraw/zinc/41/95/62/536419562.db2.gz KYZIIWNKOAEUPG-ZIAGYGMSSA-N 1 1 340.420 2.063 20 5 EEBDMO CC[N@@H+](CCC(=O)OC)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774636032 577407982 /nfs/dbraw/zinc/40/79/82/577407982.db2.gz IYWJRDQKZWZALN-UHFFFAOYSA-N 1 1 340.767 2.440 20 5 EEBDMO COC(=O)[C@@]1(C)CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765079441 577494328 /nfs/dbraw/zinc/49/43/28/577494328.db2.gz NEOMISSNEZHFHZ-INIZCTEOSA-N 1 1 332.360 2.095 20 5 EEBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@@H]1C ZINC000765930206 577509199 /nfs/dbraw/zinc/50/91/99/577509199.db2.gz PDWVZRNPZCRNTL-WDEREUQCSA-N 1 1 336.348 2.058 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@@H]1C ZINC000765930206 577509200 /nfs/dbraw/zinc/50/92/00/577509200.db2.gz PDWVZRNPZCRNTL-WDEREUQCSA-N 1 1 336.348 2.058 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)C[C@H]1C ZINC000765931980 577509241 /nfs/dbraw/zinc/50/92/41/577509241.db2.gz XCYAZFKZJUUTAK-NEPJUHHUSA-N 1 1 339.367 2.054 20 5 EEBDMO Cc1nn(C[N@@H+](C)CCc2cnccn2)c2ccc([N+](=O)[O-])cc12 ZINC000770664127 577601126 /nfs/dbraw/zinc/60/11/26/577601126.db2.gz UDLCJINMCDTLGH-UHFFFAOYSA-N 1 1 326.360 2.175 20 5 EEBDMO CCOC(=O)CC[N@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000764232894 577733139 /nfs/dbraw/zinc/73/31/39/577733139.db2.gz HULZSLBGJRTXDM-UHFFFAOYSA-N 1 1 343.767 2.072 20 5 EEBDMO CCOC(=O)CC[N@@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000764232894 577733140 /nfs/dbraw/zinc/73/31/40/577733140.db2.gz HULZSLBGJRTXDM-UHFFFAOYSA-N 1 1 343.767 2.072 20 5 EEBDMO COC[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000752324426 577769196 /nfs/dbraw/zinc/76/91/96/577769196.db2.gz DNHJITNAEWFAEN-NSHDSACASA-N 1 1 327.768 2.298 20 5 EEBDMO COC[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000752324426 577769197 /nfs/dbraw/zinc/76/91/97/577769197.db2.gz DNHJITNAEWFAEN-NSHDSACASA-N 1 1 327.768 2.298 20 5 EEBDMO Cn1ccnc1[C@@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000755793357 577831637 /nfs/dbraw/zinc/83/16/37/577831637.db2.gz ZGJSIMFYVHKQBL-CYBMUJFWSA-N 1 1 326.360 2.125 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1N)CCC(F)(F)F ZINC000757614205 577861180 /nfs/dbraw/zinc/86/11/80/577861180.db2.gz NSZIICWZCFFSQS-UHFFFAOYSA-N 1 1 348.325 2.181 20 5 EEBDMO COc1cccc([C@@H](C)[NH+]2CCN(c3c([N+](=O)[O-])cnn3C)CC2)c1 ZINC000892326610 678843818 /nfs/dbraw/zinc/84/38/18/678843818.db2.gz CSSHHKDFICTLJF-CYBMUJFWSA-N 1 1 345.403 2.220 20 5 EEBDMO C[C@@]1(C(N)=O)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000235380947 679798120 /nfs/dbraw/zinc/79/81/20/679798120.db2.gz XNLRBAOPIGHREP-CYBMUJFWSA-N 1 1 342.193 2.055 20 5 EEBDMO C[C@@H]1CCC[N@H+]1CCNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000892713265 682827365 /nfs/dbraw/zinc/82/73/65/682827365.db2.gz DLPPABUQXYYSJR-GFCCVEGCSA-N 1 1 330.388 2.343 20 5 EEBDMO Cc1cc(C)c(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)c1 ZINC000983648937 683051230 /nfs/dbraw/zinc/05/12/30/683051230.db2.gz MWDVKCFHDHFACK-YFHUEUNASA-N 1 1 345.443 2.261 20 5 EEBDMO CCCc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC000983653771 683062155 /nfs/dbraw/zinc/06/21/55/683062155.db2.gz LAKZRRAVILITCG-BRSBDYLESA-N 1 1 345.443 2.289 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000892899034 683177066 /nfs/dbraw/zinc/17/70/66/683177066.db2.gz IJVCLTFXNJTLBW-RISCZKNCSA-N 1 1 342.399 2.341 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21)c1ccccc1 ZINC001025656159 683222335 /nfs/dbraw/zinc/22/23/35/683222335.db2.gz NQIJJXKZGPLUPJ-PIIMJCKOSA-N 1 1 337.379 2.455 20 5 EEBDMO Cc1coc(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4[N+](=O)[O-])C[C@H]32)c1 ZINC001025959963 683688436 /nfs/dbraw/zinc/68/84/36/683688436.db2.gz FLCTXNSGHCILPO-HALDLXJZSA-N 1 1 341.367 2.356 20 5 EEBDMO C[N@@H+]1CC[C@H]1CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000928559992 684154916 /nfs/dbraw/zinc/15/49/16/684154916.db2.gz OAAGHFSVRNRJQG-JTQLQIEISA-N 1 1 329.809 2.161 20 5 EEBDMO C[N@H+]1CC[C@H]1CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000928559992 684154920 /nfs/dbraw/zinc/15/49/20/684154920.db2.gz OAAGHFSVRNRJQG-JTQLQIEISA-N 1 1 329.809 2.161 20 5 EEBDMO C[C@@H](Nc1ccc2ncccc2c1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C ZINC000895246665 684382348 /nfs/dbraw/zinc/38/23/48/684382348.db2.gz OZAGNFKMUOEBIL-MLGOLLRUSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@@H](Nc1ccc2ncccc2c1[N+](=O)[O-])[C@H]1CN(C)CC[N@@H+]1C ZINC000895246665 684382353 /nfs/dbraw/zinc/38/23/53/684382353.db2.gz OZAGNFKMUOEBIL-MLGOLLRUSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@@H](Nc1ccc2ncccc2c1[N+](=O)[O-])[C@H]1CN(C)CC[N@H+]1C ZINC000895246665 684382359 /nfs/dbraw/zinc/38/23/59/684382359.db2.gz OZAGNFKMUOEBIL-MLGOLLRUSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000897298094 686636463 /nfs/dbraw/zinc/63/64/63/686636463.db2.gz WYZJSBSRNQQRCD-NEPJUHHUSA-N 1 1 342.399 2.495 20 5 EEBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)CC[N@@H+]1C ZINC000897298094 686636468 /nfs/dbraw/zinc/63/64/68/686636468.db2.gz WYZJSBSRNQQRCD-NEPJUHHUSA-N 1 1 342.399 2.495 20 5 EEBDMO Cc1cc(C(=O)NCC2C[NH+](Cc3cccc([N+](=O)[O-])c3)C2)ccn1 ZINC001032059004 1191994889 /nfs/dbraw/zinc/99/48/89/1191994889.db2.gz DEBNTPNWKPWHQK-UHFFFAOYSA-N 1 1 340.383 2.160 20 5 EEBDMO Cc1nc(C(=O)NCC2C[NH+](Cc3ccc([N+](=O)[O-])cc3)C2)c(C)o1 ZINC001032065891 1192065430 /nfs/dbraw/zinc/06/54/30/1192065430.db2.gz REKCFNXOCXIAEJ-UHFFFAOYSA-N 1 1 344.371 2.061 20 5 EEBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccc(CF)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643951 1196464842 /nfs/dbraw/zinc/46/48/42/1196464842.db2.gz VRRTVNMHYHQRAC-QBPKDAKJSA-N 1 1 349.406 2.338 20 5 EEBDMO CC(C)(Cn1cc([C@H]([NH3+])c2ccc(Cl)cc2F)nn1)[N+](=O)[O-] ZINC000864642645 1197860473 /nfs/dbraw/zinc/86/04/73/1197860473.db2.gz UFZWFRKGLXXBOR-GFCCVEGCSA-N 1 1 327.747 2.174 20 5 EEBDMO CON(C)C(=O)[C@@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872091122 1198045136 /nfs/dbraw/zinc/04/51/36/1198045136.db2.gz VYEZNNWMJHCDKG-VHSXEESVSA-N 1 1 327.406 2.376 20 5 EEBDMO C[NH+](C)C[C@@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000869735686 1200245456 /nfs/dbraw/zinc/24/54/56/1200245456.db2.gz XIWYWKRYEOUGII-JHJVBQTASA-N 1 1 345.321 2.090 20 5 EEBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CC[C@]3(CCOC3)C2)o1 ZINC000878185257 1200308889 /nfs/dbraw/zinc/30/88/89/1200308889.db2.gz HWMHWFYZGKAWLH-INIZCTEOSA-N 1 1 330.344 2.257 20 5 EEBDMO Cc1nn(C[N@H+]2CCC[C@H](CCC(N)=O)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121162364 1201577388 /nfs/dbraw/zinc/57/73/88/1201577388.db2.gz BFJCOPJNJYRDJE-CYBMUJFWSA-N 1 1 345.403 2.188 20 5 EEBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2cccc(F)c2[N+](=O)[O-])C1 ZINC000866777015 1201603851 /nfs/dbraw/zinc/60/38/51/1201603851.db2.gz NQSDSAJANHJYHN-UKRRQHHQSA-N 1 1 335.379 2.219 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001095423651 1205734842 /nfs/dbraw/zinc/73/48/42/1205734842.db2.gz GRYMENKCVIIPJQ-UHFFFAOYSA-N 1 1 334.420 2.022 20 5 EEBDMO Cc1cccc([C@@H](O)C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)c1 ZINC000930680722 1206575508 /nfs/dbraw/zinc/57/55/08/1206575508.db2.gz MQDBDPIOAKBCKO-KRWDZBQOSA-N 1 1 342.399 2.154 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](N(C)C)[C@@H]1C ZINC000931040958 1206602183 /nfs/dbraw/zinc/60/21/83/1206602183.db2.gz ATLGOPGNANFJHH-XJKSGUPXSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](N(C)C)[C@@H]1C ZINC000931040958 1206602184 /nfs/dbraw/zinc/60/21/84/1206602184.db2.gz ATLGOPGNANFJHH-XJKSGUPXSA-N 1 1 334.420 2.256 20 5 EEBDMO CC[N@@H+](CC(C)C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000193396115 1210827362 /nfs/dbraw/zinc/82/73/62/1210827362.db2.gz KBLUUYVGEFSIBT-KRWDZBQOSA-N 1 1 348.403 2.297 20 5 EEBDMO CC(C)CC[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC000957550161 1215202158 /nfs/dbraw/zinc/20/21/58/1215202158.db2.gz LXGHXXPSQMNKOI-HZPDHXFCSA-N 1 1 337.464 2.402 20 5 EEBDMO CC(C)(C(=O)OCCC[NH+]1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000796440997 1218086702 /nfs/dbraw/zinc/08/67/02/1218086702.db2.gz HMLOAJAUEBBHQI-UHFFFAOYSA-N 1 1 336.388 2.138 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CCc1cccs1 ZINC001039583374 1230702755 /nfs/dbraw/zinc/70/27/55/1230702755.db2.gz NMKSTPMHKGFWDQ-OCVGTWLNSA-N 1 1 349.456 2.021 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@H+]2CCc1cccs1 ZINC001039583374 1230702758 /nfs/dbraw/zinc/70/27/58/1230702758.db2.gz NMKSTPMHKGFWDQ-OCVGTWLNSA-N 1 1 349.456 2.021 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CCc1cccs1 ZINC001039583374 1230702762 /nfs/dbraw/zinc/70/27/62/1230702762.db2.gz NMKSTPMHKGFWDQ-OCVGTWLNSA-N 1 1 349.456 2.021 20 5 EEBDMO 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HXZPDUMYPNXTCL-UHFFFAOYSA-N 1 1 347.415 2.332 20 5 EEBDMO CC1(C)CC[N@@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])CCS1 ZINC001590101115 1349156050 /nfs/dbraw/zinc/15/60/50/1349156050.db2.gz XKRSKJBXMORBDP-UHFFFAOYSA-N 1 1 348.432 2.492 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590258864 1349231922 /nfs/dbraw/zinc/23/19/22/1349231922.db2.gz DBAJFDMOISFYQF-RYUDHWBXSA-N 1 1 345.407 2.307 20 5 EEBDMO O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC001593467368 1349803427 /nfs/dbraw/zinc/80/34/27/1349803427.db2.gz PMBHEPCCACKUNC-CYBMUJFWSA-N 1 1 336.302 2.006 20 5 EEBDMO O=C(OCCn1ccc([N+](=O)[O-])n1)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC000815446428 1367994252 /nfs/dbraw/zinc/99/42/52/1367994252.db2.gz VYBRKXJXIRCCNL-AWEZNQCLSA-N 1 1 336.392 2.132 20 5 EEBDMO O=C(OCCn1cc([N+](=O)[O-])cn1)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC000815445176 1367994276 /nfs/dbraw/zinc/99/42/76/1367994276.db2.gz SZGJECGKFHLXFH-OAHLLOKOSA-N 1 1 336.392 2.132 20 5 EEBDMO 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2.055 20 5 EEBDMO CN1C(=O)NCC12CC[NH+](Cc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC000822529240 787236854 /nfs/dbraw/zinc/23/68/54/787236854.db2.gz BKEADXULQDCYQV-UHFFFAOYSA-N 1 1 338.795 2.238 20 5 EEBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000823132522 787581535 /nfs/dbraw/zinc/58/15/35/787581535.db2.gz GAOOEIOFENZQRQ-QMMMGPOBSA-N 1 1 344.774 2.136 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000823899860 787973148 /nfs/dbraw/zinc/97/31/48/787973148.db2.gz YRWFOFNZFUHKHB-BBRMVZONSA-N 1 1 335.404 2.009 20 5 EEBDMO C[N@@H+]1CCc2c(N[C@H]3NC(=O)c4ccccc43)ccc([N+](=O)[O-])c2C1 ZINC001171129004 789154569 /nfs/dbraw/zinc/15/45/69/789154569.db2.gz HZZISWKMQWYNEK-KRWDZBQOSA-N 1 1 338.367 2.437 20 5 EEBDMO C[N@H+]1CCc2c(N[C@H]3NC(=O)c4ccccc43)ccc([N+](=O)[O-])c2C1 ZINC001171129004 789154573 /nfs/dbraw/zinc/15/45/73/789154573.db2.gz HZZISWKMQWYNEK-KRWDZBQOSA-N 1 1 338.367 2.437 20 5 EEBDMO 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HCCQRZNQAJTGJX-CYBMUJFWSA-N 1 1 341.433 2.056 20 5 EEBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000352592868 162203729 /nfs/dbraw/zinc/20/37/29/162203729.db2.gz KDQWHGYMFNSOLW-CYBMUJFWSA-N 1 1 343.449 2.302 20 5 EEBDMO O=C(CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)N1CCCCC1 ZINC000352621995 162215030 /nfs/dbraw/zinc/21/50/30/162215030.db2.gz WAASQYNXZDBSIB-UHFFFAOYSA-N 1 1 333.388 2.192 20 5 EEBDMO O=C(CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)N1CCCCC1 ZINC000352621995 162215031 /nfs/dbraw/zinc/21/50/31/162215031.db2.gz WAASQYNXZDBSIB-UHFFFAOYSA-N 1 1 333.388 2.192 20 5 EEBDMO COc1c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000354981481 163040172 /nfs/dbraw/zinc/04/01/72/163040172.db2.gz OHXVIBUUCPFECT-OLZOCXBDSA-N 1 1 335.404 2.454 20 5 EEBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000355730795 163284548 /nfs/dbraw/zinc/28/45/48/163284548.db2.gz HCXRXUOLKLFXRE-CQSZACIVSA-N 1 1 334.372 2.379 20 5 EEBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000355730794 163284617 /nfs/dbraw/zinc/28/46/17/163284617.db2.gz HCXRXUOLKLFXRE-AWEZNQCLSA-N 1 1 334.372 2.379 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H](CO)c1ccc(F)cc1 ZINC000359630971 164141148 /nfs/dbraw/zinc/14/11/48/164141148.db2.gz YXIQNZODSXXHPW-CQSZACIVSA-N 1 1 347.346 2.304 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H]([C@H]2CCOC2)C1 ZINC000374408874 167036805 /nfs/dbraw/zinc/03/68/05/167036805.db2.gz AOKUKNPSVSFHHU-KGLIPLIRSA-N 1 1 333.388 2.200 20 5 EEBDMO O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000376622889 167362324 /nfs/dbraw/zinc/36/23/24/167362324.db2.gz YCAHTMZOHRDWIX-ZDUSSCGKSA-N 1 1 333.388 2.107 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C[N@H+]1C1CC1 ZINC000124207899 222392010 /nfs/dbraw/zinc/39/20/10/222392010.db2.gz BYWDXGUHCUHTCC-AAEUAGOBSA-N 1 1 342.399 2.360 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C[C@@H]1CCC[C@H]1O ZINC000270144552 268794796 /nfs/dbraw/zinc/79/47/96/268794796.db2.gz QJHAJVPBOKGFLL-XJKSGUPXSA-N 1 1 335.404 2.325 20 5 EEBDMO COCCC[N@@H+](CCO)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000275508496 269120187 /nfs/dbraw/zinc/12/01/87/269120187.db2.gz SEIVYWFFYLGOCB-UHFFFAOYSA-N 1 1 349.387 2.123 20 5 EEBDMO O=C(CC[N@H+]1CCO[C@@H]2CCC[C@@H]21)Nc1cc([N+](=O)[O-])ccc1F ZINC000275520791 269121020 /nfs/dbraw/zinc/12/10/20/269121020.db2.gz VGEDOYMYWCVEAL-LSDHHAIUSA-N 1 1 337.351 2.316 20 5 EEBDMO CCC(=O)c1ccc(N2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)c([N+](=O)[O-])c1 ZINC000375662443 273600980 /nfs/dbraw/zinc/60/09/80/273600980.db2.gz GJCSLQBWKVMFDW-YJBOKZPZSA-N 1 1 347.415 2.223 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@@H]1C ZINC000105790510 274271307 /nfs/dbraw/zinc/27/13/07/274271307.db2.gz QTBCGCZMFNVABI-QWHCGFSZSA-N 1 1 330.388 2.034 20 5 EEBDMO C[C@@H]1CCCN1C(=O)CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000352620445 274292225 /nfs/dbraw/zinc/29/22/25/274292225.db2.gz DKJMQSXSWXZZEP-CYBMUJFWSA-N 1 1 333.388 2.190 20 5 EEBDMO C[C@@H]1CCCN1C(=O)CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000352620445 274292226 /nfs/dbraw/zinc/29/22/26/274292226.db2.gz DKJMQSXSWXZZEP-CYBMUJFWSA-N 1 1 333.388 2.190 20 5 EEBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000277477158 274296725 /nfs/dbraw/zinc/29/67/25/274296725.db2.gz PIXSHMAKCDGOAK-MRXNPFEDSA-N 1 1 332.404 2.411 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@]3(CCO)CCOC3)cs2)c1 ZINC000278480106 274362863 /nfs/dbraw/zinc/36/28/63/274362863.db2.gz JDNLJXLTBVYHRP-INIZCTEOSA-N 1 1 349.412 2.349 20 5 EEBDMO O=[N+]([O-])c1cc(C[NH2+]C[C@@H](N2CCOCC2)C(F)(F)F)cs1 ZINC000285579592 274756346 /nfs/dbraw/zinc/75/63/46/274756346.db2.gz UZVCKWDPADADJO-SNVBAGLBSA-N 1 1 339.339 2.009 20 5 EEBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000289438921 275115914 /nfs/dbraw/zinc/11/59/14/275115914.db2.gz OFRLXORJPIEWOO-WBVHZDCISA-N 1 1 348.403 2.244 20 5 EEBDMO Cc1cnn([C@@H]2CC[N@@H+]([C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000290051507 275174292 /nfs/dbraw/zinc/17/42/92/275174292.db2.gz XBSWLWJPONYJII-XJKSGUPXSA-N 1 1 343.387 2.374 20 5 EEBDMO Cc1cnn([C@@H]2CC[N@H+]([C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000290051507 275174293 /nfs/dbraw/zinc/17/42/93/275174293.db2.gz XBSWLWJPONYJII-XJKSGUPXSA-N 1 1 343.387 2.374 20 5 EEBDMO COc1ccc(OCC[N@H+]2CC[C@@H](n3cccn3)C2)c([N+](=O)[O-])c1 ZINC000291774933 275339022 /nfs/dbraw/zinc/33/90/22/275339022.db2.gz LWZMTTWUKRJTAX-CYBMUJFWSA-N 1 1 332.360 2.126 20 5 EEBDMO CCOC(=O)c1ccnc(N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-] ZINC000133480121 276300570 /nfs/dbraw/zinc/30/05/70/276300570.db2.gz WDPIDLANVWJHOC-OCCSQVGLSA-N 1 1 348.403 2.087 20 5 EEBDMO CN1CCC[C@@]2(CC[N@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)C1 ZINC000293074117 293118347 /nfs/dbraw/zinc/11/83/47/293118347.db2.gz VROKCBWAJQNYBF-GOSISDBHSA-N 1 1 346.431 2.341 20 5 EEBDMO CN1CCC[C@@]2(CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)C1 ZINC000293074117 293118350 /nfs/dbraw/zinc/11/83/50/293118350.db2.gz VROKCBWAJQNYBF-GOSISDBHSA-N 1 1 346.431 2.341 20 5 EEBDMO C[N@@H+]1CCC[C@@]2(CCN(CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)C1 ZINC000293074117 293118354 /nfs/dbraw/zinc/11/83/54/293118354.db2.gz VROKCBWAJQNYBF-GOSISDBHSA-N 1 1 346.431 2.341 20 5 EEBDMO C[N@H+]1CCC[C@@]2(CCN(CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)C1 ZINC000293074117 293118357 /nfs/dbraw/zinc/11/83/57/293118357.db2.gz VROKCBWAJQNYBF-GOSISDBHSA-N 1 1 346.431 2.341 20 5 EEBDMO C[C@@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H](C)[N@@H+]1C ZINC000293386261 293196179 /nfs/dbraw/zinc/19/61/79/293196179.db2.gz KFJOVBGGOZPBTP-TXEJJXNPSA-N 1 1 331.376 2.169 20 5 EEBDMO COCCCN1CCC([NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000293722179 293278927 /nfs/dbraw/zinc/27/89/27/293278927.db2.gz MNBKAPJDWAFHFP-CYBMUJFWSA-N 1 1 336.436 2.329 20 5 EEBDMO CCN1CCN(C[C@H](C)C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000293748290 293285642 /nfs/dbraw/zinc/28/56/42/293285642.db2.gz NZGFRRQBDCYQFS-HUUCEWRRSA-N 1 1 349.479 2.101 20 5 EEBDMO CSc1cccc(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-] ZINC000346304878 312272380 /nfs/dbraw/zinc/27/23/80/312272380.db2.gz YQGDXFCGLFQDFE-MRXNPFEDSA-N 1 1 335.429 2.485 20 5 EEBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000540908451 318082668 /nfs/dbraw/zinc/08/26/68/318082668.db2.gz UFUOZRNNIJHKMV-SNVBAGLBSA-N 1 1 343.330 2.268 20 5 EEBDMO C[C@H]([NH2+][C@H]1C[C@H](O)C1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000565665693 319203048 /nfs/dbraw/zinc/20/30/48/319203048.db2.gz MQUYHZKVAMAYTD-XDTLVQLUSA-N 1 1 332.360 2.455 20 5 EEBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ccc([N+](=O)[O-])c(N)c1F ZINC000581702051 324304616 /nfs/dbraw/zinc/30/46/16/324304616.db2.gz NOYDWVGWNLVJGW-LLVKDONJSA-N 1 1 338.383 2.006 20 5 EEBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000074325685 462587087 /nfs/dbraw/zinc/58/70/87/462587087.db2.gz XFJOYAQCFHXLGO-OAHLLOKOSA-N 1 1 346.431 2.197 20 5 EEBDMO C[C@@H]1C[N@H+](C[C@H](O)CSCc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000128856783 462676239 /nfs/dbraw/zinc/67/62/39/462676239.db2.gz AWTFAOIMBRUZSG-ZENOOKHLSA-N 1 1 340.445 2.298 20 5 EEBDMO COCC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000046600771 462691390 /nfs/dbraw/zinc/69/13/90/462691390.db2.gz IIRSVTKOAZIAQR-INIZCTEOSA-N 1 1 338.404 2.226 20 5 EEBDMO Cc1[nH]nc(C(=O)N2CCC(C[NH+]3CCCCCC3)CC2)c1[N+](=O)[O-] ZINC000064354761 462698267 /nfs/dbraw/zinc/69/82/67/462698267.db2.gz RFIJUDCUMWUTAS-UHFFFAOYSA-N 1 1 349.435 2.355 20 5 EEBDMO CC(C)(C)[C@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(N)=O ZINC000089913220 462741022 /nfs/dbraw/zinc/74/10/22/462741022.db2.gz KVZJTVYXVICFFU-CYBMUJFWSA-N 1 1 332.360 2.239 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H]([C@@H](C)O)C1 ZINC000089930683 462746273 /nfs/dbraw/zinc/74/62/73/462746273.db2.gz NYDHJRBZCLEPKN-ZIAGYGMSSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000075745818 462755934 /nfs/dbraw/zinc/75/59/34/462755934.db2.gz BAPHQTBYPSUEKM-LXZKKBNFSA-N 1 1 330.388 2.030 20 5 EEBDMO Cc1ccccc1OCC[N@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000090511195 462795260 /nfs/dbraw/zinc/79/52/60/462795260.db2.gz ATKOMRYJSLNWFW-UHFFFAOYSA-N 1 1 331.372 2.076 20 5 EEBDMO COc1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)cc1C ZINC000090525803 462796174 /nfs/dbraw/zinc/79/61/74/462796174.db2.gz LXSLRZOAFXFYML-UHFFFAOYSA-N 1 1 331.372 2.206 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)CC[C@@H]21 ZINC000155761091 462940009 /nfs/dbraw/zinc/94/00/09/462940009.db2.gz OIVCSOYKZCRMDE-ABAIWWIYSA-N 1 1 348.359 2.059 20 5 EEBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000120882589 463049983 /nfs/dbraw/zinc/04/99/83/463049983.db2.gz HSEOUHFRWGDDRM-MRXNPFEDSA-N 1 1 348.447 2.414 20 5 EEBDMO 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KTCHKOHGEFJOSW-HNNXBMFYSA-N 1 1 349.435 2.095 20 5 EEBDMO COc1ccc(CNc2cncc(-n3cc[nH+]c3C)n2)cc1[N+](=O)[O-] ZINC000357266498 465899421 /nfs/dbraw/zinc/89/94/21/465899421.db2.gz IMGMOOWZDLFMEP-UHFFFAOYSA-N 1 1 340.343 2.500 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C)[C@H](C(C)C)C1 ZINC000362717826 465967489 /nfs/dbraw/zinc/96/74/89/465967489.db2.gz TUFATPHRAACXGZ-AWEZNQCLSA-N 1 1 336.392 2.407 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]CCC1CC(O)C1)c1cccc([N+](=O)[O-])c1 ZINC000353605790 466007885 /nfs/dbraw/zinc/00/78/85/466007885.db2.gz LXULOYHKIPEGNK-VDSRIPIWSA-N 1 1 330.388 2.168 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]CCC1CC(O)C1)c1cccc([N+](=O)[O-])c1 ZINC000353605789 466007950 /nfs/dbraw/zinc/00/79/50/466007950.db2.gz LXULOYHKIPEGNK-MOQPWLNLSA-N 1 1 330.388 2.168 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000346238251 466016919 /nfs/dbraw/zinc/01/69/19/466016919.db2.gz OHVSMRRZPMZZBH-WOSRLPQWSA-N 1 1 347.415 2.406 20 5 EEBDMO 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COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@H]1CCC[N@@H+](CCCO)C1 ZINC000595043253 468748275 /nfs/dbraw/zinc/74/82/75/468748275.db2.gz VOQZWXVPPLSEDJ-KGLIPLIRSA-N 1 1 337.420 2.101 20 5 EEBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000571848853 468847093 /nfs/dbraw/zinc/84/70/93/468847093.db2.gz SNOQFQICIAHGGF-CYBMUJFWSA-N 1 1 337.420 2.383 20 5 EEBDMO COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)[NH2+]Cc1onc(C)c1[N+](=O)[O-] ZINC000595476309 468868893 /nfs/dbraw/zinc/86/88/93/468868893.db2.gz NDVQKFICAOOSHH-RISCZKNCSA-N 1 1 347.371 2.401 20 5 EEBDMO O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598562515 468914288 /nfs/dbraw/zinc/91/42/88/468914288.db2.gz VEZHMVHNYKYKSA-MRXNPFEDSA-N 1 1 331.416 2.376 20 5 EEBDMO C[C@@H](CO)[C@H]1CCCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000595671426 468946913 /nfs/dbraw/zinc/94/69/13/468946913.db2.gz GFVIQJAYKXYLJP-XJKSGUPXSA-N 1 1 335.404 2.041 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H]1CCC(=O)N(C)C1 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C[N@H+]1CCCC[C@@H]1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000610305527 470002572 /nfs/dbraw/zinc/00/25/72/470002572.db2.gz YLVSJKGUHRCPLR-QGZVFWFLSA-N 1 1 347.415 2.449 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594204672 485602898 /nfs/dbraw/zinc/60/28/98/485602898.db2.gz WMXKGKQVJHIPQQ-LSDHHAIUSA-N 1 1 333.388 2.350 20 5 EEBDMO C[C@H]1[C@@H](C)[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H]1C ZINC000419394543 485686526 /nfs/dbraw/zinc/68/65/26/485686526.db2.gz PLIQNKFBMQSQCT-GMTAPVOTSA-N 1 1 335.360 2.238 20 5 EEBDMO C[C@@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000181065105 534030272 /nfs/dbraw/zinc/03/02/72/534030272.db2.gz DFGGERNSNGMZMF-ZDUSSCGKSA-N 1 1 342.399 2.427 20 5 EEBDMO CNC(=O)c1ccc(N(C)CC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC000266242424 536429909 /nfs/dbraw/zinc/42/99/09/536429909.db2.gz LOQVYMFMKCQMBL-CQSZACIVSA-N 1 1 334.420 2.265 20 5 EEBDMO CN(C(=O)C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 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334.376 2.051 20 5 EEBDMO CCCC[N@@H+](C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000029889679 793985508 /nfs/dbraw/zinc/98/55/08/793985508.db2.gz WECLQKXEAJVYDH-INIZCTEOSA-N 1 1 334.376 2.051 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1CCC(c2cn[nH]c2)CC1 ZINC000356808931 795412609 /nfs/dbraw/zinc/41/26/09/795412609.db2.gz IGRHWSXBFZPMLZ-UHFFFAOYSA-N 1 1 343.387 2.444 20 5 EEBDMO O=C1NCC[C@]12CCC[N@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172907705 797133290 /nfs/dbraw/zinc/13/32/90/797133290.db2.gz LMVCTBIRMGGHEI-APWZRJJASA-N 1 1 343.427 2.444 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCc3nccn3CC2)c1F ZINC001173195264 797283318 /nfs/dbraw/zinc/28/33/18/797283318.db2.gz DOKYGWARNCUHQQ-LBPRGKRZSA-N 1 1 348.378 2.428 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)N1CCC(Nc2ncccc2[N+](=O)[O-])CC1 ZINC001095241580 797578723 /nfs/dbraw/zinc/57/87/23/797578723.db2.gz LBERMKYCYXOYFA-UHFFFAOYSA-N 1 1 349.435 2.123 20 5 EEBDMO C[N@H+]1CC[C@@H]1CNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000925430281 797752958 /nfs/dbraw/zinc/75/29/58/797752958.db2.gz LITJFMGQWQTGJG-GOEBONIOSA-N 1 1 332.404 2.188 20 5 EEBDMO CC(C)(C)OC(=O)N1C[C@H]2C[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)CC[C@H]21 ZINC001169010097 803570849 /nfs/dbraw/zinc/57/08/49/803570849.db2.gz AXYXMXGLZWWNFQ-KBUPBQIOSA-N 1 1 339.436 2.373 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H](F)[C@](O)(C(F)(F)F)CC2)C1 ZINC001169012874 803571169 /nfs/dbraw/zinc/57/11/69/803571169.db2.gz SKAHKVOUVDSLNC-KXNHARMFSA-N 1 1 328.306 2.159 20 5 EEBDMO CC(C)(C)OC(=O)NC[C@@H]1CC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169034962 803579176 /nfs/dbraw/zinc/57/91/76/803579176.db2.gz IXDYJUXEFPXDQQ-HZSPNIEDSA-N 1 1 327.425 2.278 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCn3cnc(COCC4CC4)c3C2)C1 ZINC001169018409 803587011 /nfs/dbraw/zinc/58/70/11/803587011.db2.gz BDNGUVCZVCIDGD-HUUCEWRRSA-N 1 1 334.420 2.071 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCn3cnc(COCC4CC4)c3C2)C1 ZINC001169018409 803587016 /nfs/dbraw/zinc/58/70/16/803587016.db2.gz BDNGUVCZVCIDGD-HUUCEWRRSA-N 1 1 334.420 2.071 20 5 EEBDMO O=C1[C@H]2C[N@@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@H]2CN1c1ccccc1 ZINC001169019213 803587775 /nfs/dbraw/zinc/58/77/75/803587775.db2.gz FSPVTGBEXZHKGW-OHFALNGGSA-N 1 1 329.400 2.027 20 5 EEBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2cn(CC)nc21 ZINC001169022995 803589235 /nfs/dbraw/zinc/58/92/35/803589235.db2.gz NYXIPSJYDHZOPG-KBMXLJTQSA-N 1 1 336.436 2.284 20 5 EEBDMO COc1ccc(O[C@@H]2CCC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)nc1 ZINC001169050619 803595465 /nfs/dbraw/zinc/59/54/65/803595465.db2.gz BYRBVNDDNZMDKD-OFQRWUPVSA-N 1 1 335.404 2.379 20 5 EEBDMO NC(=O)c1ccc(O[C@@H]2CCC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)cc1 ZINC001169053138 803595648 /nfs/dbraw/zinc/59/56/48/803595648.db2.gz HRCQYQVEMLDVQH-FRFSOERESA-N 1 1 347.415 2.074 20 5 EEBDMO CSc1nc(Cl)c([N+](=O)[O-])c(N2C[C@H]3[C@H](C2)CCC[N@H+]3C)n1 ZINC001157262744 807177024 /nfs/dbraw/zinc/17/70/24/807177024.db2.gz YCCGSDUVJNYWFP-IUCAKERBSA-N 1 1 343.840 2.291 20 5 EEBDMO CC(C)[C@H](C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])[NH+](C)C ZINC000787960961 807317506 /nfs/dbraw/zinc/31/75/06/807317506.db2.gz JIPFQXMEKGUHHA-SMDDNHRTSA-N 1 1 337.376 2.051 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[NH+]1CCC2(CCOCC2)CC1 ZINC000789528974 808046624 /nfs/dbraw/zinc/04/66/24/808046624.db2.gz GXYIDEYSLMQTCL-UHFFFAOYSA-N 1 1 347.371 2.353 20 5 EEBDMO CC[C@@H]1COCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000411268346 529411360 /nfs/dbraw/zinc/41/13/60/529411360.db2.gz FYLRUDCPTQIEDV-GFCCVEGCSA-N 1 1 337.376 2.043 20 5 EEBDMO Cn1cc(C[N@H+]2CCC[C@@](C)(O)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000129407702 223053708 /nfs/dbraw/zinc/05/37/08/223053708.db2.gz ZYYJACROIKAXAO-QGZVFWFLSA-N 1 1 330.388 2.342 20 5 EEBDMO Cc1[nH+]ccn1CCCCNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000130334906 223145083 /nfs/dbraw/zinc/14/50/83/223145083.db2.gz OLKGGWQGLVRTEG-UHFFFAOYSA-N 1 1 346.387 2.465 20 5 EEBDMO C[C@H](c1ccccc1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)C(N)=O ZINC000428854449 241663449 /nfs/dbraw/zinc/66/34/49/241663449.db2.gz ADMZVFWPDLZWCE-BZNIZROVSA-N 1 1 331.347 2.481 20 5 EEBDMO C[N@H+]1CCC[C@@H](CCNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC000459250097 245048296 /nfs/dbraw/zinc/04/82/96/245048296.db2.gz FKHOLLXXYUXHQV-AWEZNQCLSA-N 1 1 346.431 2.394 20 5 EEBDMO CCOC[C@@H]1CCCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000459718335 245222235 /nfs/dbraw/zinc/22/22/35/245222235.db2.gz RGTVGJRNTVPMMG-INIZCTEOSA-N 1 1 335.404 2.449 20 5 EEBDMO CCOC[C@@H]1CCCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000459718335 245222243 /nfs/dbraw/zinc/22/22/43/245222243.db2.gz RGTVGJRNTVPMMG-INIZCTEOSA-N 1 1 335.404 2.449 20 5 EEBDMO CCCc1n[nH]c(C(=O)N2CC[C@@H](C[N@H+](C)CCC)C2)c1[N+](=O)[O-] ZINC000081361280 217387891 /nfs/dbraw/zinc/38/78/91/217387891.db2.gz JTMDBJPBDZQOJT-LBPRGKRZSA-N 1 1 337.424 2.074 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[C@@H](C[N@@H+](C)CCC)C2)c1[N+](=O)[O-] ZINC000081361280 217387892 /nfs/dbraw/zinc/38/78/92/217387892.db2.gz JTMDBJPBDZQOJT-LBPRGKRZSA-N 1 1 337.424 2.074 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[C@@H](C[N@H+](C)CCC)C2)c1[N+](=O)[O-] ZINC000081361280 217387894 /nfs/dbraw/zinc/38/78/94/217387894.db2.gz JTMDBJPBDZQOJT-LBPRGKRZSA-N 1 1 337.424 2.074 20 5 EEBDMO O=C(/C=C\c1ccc(F)cc1[N+](=O)[O-])NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000491574795 246078351 /nfs/dbraw/zinc/07/83/51/246078351.db2.gz FHHQEKWTHOJOQA-DWMUBGRBSA-N 1 1 333.363 2.348 20 5 EEBDMO CN(C)C(=O)OC1CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000496189638 247371518 /nfs/dbraw/zinc/37/15/18/247371518.db2.gz NQCJVZWBFQBPIP-UHFFFAOYSA-N 1 1 347.375 2.065 20 5 EEBDMO Cc1ccccc1[C@H]1CCC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266523250 248344147 /nfs/dbraw/zinc/34/41/47/248344147.db2.gz CWJMEYAYWUOKLO-NVXWUHKLSA-N 1 1 330.388 2.298 20 5 EEBDMO CC[C@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1O ZINC000270999913 256197472 /nfs/dbraw/zinc/19/74/72/256197472.db2.gz YTNATIYQGWSCQK-WFASDCNBSA-N 1 1 331.372 2.495 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(CCCO)CC1 ZINC000272937049 256251000 /nfs/dbraw/zinc/25/10/00/256251000.db2.gz KQBOAYUJSSXOJO-CYBMUJFWSA-N 1 1 335.404 2.406 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1 ZINC000273022566 256258269 /nfs/dbraw/zinc/25/82/69/256258269.db2.gz UDOSGMMALGBFJO-NSHDSACASA-N 1 1 334.376 2.375 20 5 EEBDMO COc1cccc(NC[C@@H](C(C)C)N2CC[NH+](C)CC2)c1[N+](=O)[O-] ZINC000181212679 533619237 /nfs/dbraw/zinc/61/92/37/533619237.db2.gz FKZIGKZZAYDEKQ-HNNXBMFYSA-N 1 1 336.436 2.287 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](C)CN1CCN(C)CC1 ZINC000120924166 292259110 /nfs/dbraw/zinc/25/91/10/292259110.db2.gz ZTIYTQNXSZKDKI-HOCLYGCPSA-N 1 1 334.464 2.437 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[NH2+]Cc2ccccc21 ZINC000261742986 292294109 /nfs/dbraw/zinc/29/41/09/292294109.db2.gz SXSACACCTXRJOV-UHFFFAOYSA-N 1 1 347.396 2.202 20 5 EEBDMO C[N@@H+](CCN1C(=O)c2ccccc2C1=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000126088927 292305149 /nfs/dbraw/zinc/30/51/49/292305149.db2.gz QSKUEDKBWFOSNM-UHFFFAOYSA-N 1 1 339.351 2.323 20 5 EEBDMO Cc1cccc(NCCNC(=O)CCNc2ccccc2[N+](=O)[O-])[nH+]1 ZINC000126312143 292308871 /nfs/dbraw/zinc/30/88/71/292308871.db2.gz KDKQMJWQSCCIHP-UHFFFAOYSA-N 1 1 343.387 2.329 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CCc1ccccn1 ZINC000129938372 292365092 /nfs/dbraw/zinc/36/50/92/292365092.db2.gz VVJYLPAZWLCWBT-CYBMUJFWSA-N 1 1 328.372 2.491 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1ccccn1 ZINC000129938372 292365094 /nfs/dbraw/zinc/36/50/94/292365094.db2.gz VVJYLPAZWLCWBT-CYBMUJFWSA-N 1 1 328.372 2.491 20 5 EEBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000068226834 159017515 /nfs/dbraw/zinc/01/75/15/159017515.db2.gz YGLSHOPTMQXIHY-UONOGXRCSA-N 1 1 334.420 2.243 20 5 EEBDMO C[C@H](CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[N@H+]1CCC[C@@H](C)C1 ZINC000245537113 160240842 /nfs/dbraw/zinc/24/08/42/160240842.db2.gz XYJMZSRAZYRUGV-VXGBXAGGSA-N 1 1 349.387 2.174 20 5 EEBDMO COc1cc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)ccc1[N+](=O)[O-] ZINC000247316048 160319917 /nfs/dbraw/zinc/31/99/17/160319917.db2.gz RSGNAHQXVGSABT-UONOGXRCSA-N 1 1 333.388 2.160 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)CCOc3ccccc3[N+](=O)[O-])CC[C@H]21 ZINC000248202168 160340555 /nfs/dbraw/zinc/34/05/55/160340555.db2.gz ZARRWDMQFQEXIC-HUUCEWRRSA-N 1 1 347.415 2.306 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])n2C)C[N@H+]1Cc1ccccc1 ZINC000342451453 161066444 /nfs/dbraw/zinc/06/64/44/161066444.db2.gz PIYJGCPWDQAUPA-ZFWWWQNUSA-N 1 1 342.399 2.326 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000343266939 161118495 /nfs/dbraw/zinc/11/84/95/161118495.db2.gz MTXWYKCETKMDMG-CHWSQXEVSA-N 1 1 328.372 2.433 20 5 EEBDMO C[C@H]1C[N@@H+](C)CCN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000343787278 161168273 /nfs/dbraw/zinc/16/82/73/161168273.db2.gz LBRHFKQWANWUKE-ZDUSSCGKSA-N 1 1 330.388 2.428 20 5 EEBDMO C[C@H]1CN(C)CC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000343787278 161168274 /nfs/dbraw/zinc/16/82/74/161168274.db2.gz LBRHFKQWANWUKE-ZDUSSCGKSA-N 1 1 330.388 2.428 20 5 EEBDMO C[C@H]1CN(C)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000343787278 161168275 /nfs/dbraw/zinc/16/82/75/161168275.db2.gz LBRHFKQWANWUKE-ZDUSSCGKSA-N 1 1 330.388 2.428 20 5 EEBDMO C[C@@H]1[C@H](NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])CCC[N@H+]1C ZINC000345957861 161345219 /nfs/dbraw/zinc/34/52/19/161345219.db2.gz VXALENRHRQUGIR-UKRRQHHQSA-N 1 1 334.420 2.261 20 5 EEBDMO CCC[N@@H+](CC)CCNS(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000360207696 164258179 /nfs/dbraw/zinc/25/81/79/164258179.db2.gz RNGAIZADBNQDGA-UHFFFAOYSA-N 1 1 343.449 2.222 20 5 EEBDMO CC(C)[C@]1(CO)CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000368073397 166046439 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1 1 345.399 2.389 20 5 EEBDMO O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000272715715 269011808 /nfs/dbraw/zinc/01/18/08/269011808.db2.gz YRQOJWLFRFGECC-SJCJKPOMSA-N 1 1 345.399 2.389 20 5 EEBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000275079848 269093028 /nfs/dbraw/zinc/09/30/28/269093028.db2.gz DBHNRWSJNSTDHQ-JTQLQIEISA-N 1 1 349.284 2.234 20 5 EEBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000277530900 269160623 /nfs/dbraw/zinc/16/06/23/269160623.db2.gz MPBBVBAZXHOAGE-CYBMUJFWSA-N 1 1 348.359 2.250 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCCC[N@H+]2CCCO[C@H](C)C2)c1 ZINC000278406821 269229167 /nfs/dbraw/zinc/22/91/67/269229167.db2.gz FAFIGQKCQLNXIP-CQSZACIVSA-N 1 1 335.404 2.134 20 5 EEBDMO CC1(C)C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@H]1O ZINC000275384478 274243691 /nfs/dbraw/zinc/24/36/91/274243691.db2.gz BQGFDOHESVSPBO-CYBMUJFWSA-N 1 1 332.360 2.238 20 5 EEBDMO CC1(C)C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@H]1O ZINC000275384478 274243693 /nfs/dbraw/zinc/24/36/93/274243693.db2.gz BQGFDOHESVSPBO-CYBMUJFWSA-N 1 1 332.360 2.238 20 5 EEBDMO Nc1ccc([N+](=O)[O-])c(N2CC[NH+](Cc3cccc(O)c3)CC2)c1 ZINC000192787890 274964846 /nfs/dbraw/zinc/96/48/46/274964846.db2.gz QVNNKUTWGGDMAI-UHFFFAOYSA-N 1 1 328.372 2.205 20 5 EEBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3nnc[nH]3)CC2)c([N+](=O)[O-])c1 ZINC000366747893 275035365 /nfs/dbraw/zinc/03/53/65/275035365.db2.gz WEMIOBTTXIADBA-UHFFFAOYSA-N 1 1 332.320 2.001 20 5 EEBDMO O=[N+]([O-])c1ccc2nc(N3CC[NH+]([C@H]4CCOC4)CC3)ccc2c1 ZINC000371110177 275039037 /nfs/dbraw/zinc/03/90/37/275039037.db2.gz XRHCLSNSERGIDR-HNNXBMFYSA-N 1 1 328.372 2.054 20 5 EEBDMO C[C@@H](CS(C)(=O)=O)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290877176 275248330 /nfs/dbraw/zinc/24/83/30/275248330.db2.gz LRZKMBKFVREFQA-ZETCQYMHSA-N 1 1 341.216 2.424 20 5 EEBDMO C[C@@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000290956651 275255470 /nfs/dbraw/zinc/25/54/70/275255470.db2.gz NWLAYJJYYWGEDV-NEPJUHHUSA-N 1 1 347.419 2.154 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](n2cccn2)C1 ZINC000291977715 275359956 /nfs/dbraw/zinc/35/99/56/275359956.db2.gz WBCGIDOMITWYBA-STQMWFEESA-N 1 1 329.360 2.065 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](n2cccn2)C1 ZINC000291977715 275359957 /nfs/dbraw/zinc/35/99/57/275359957.db2.gz WBCGIDOMITWYBA-STQMWFEESA-N 1 1 329.360 2.065 20 5 EEBDMO C[C@@H]1[C@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)CCC[N@H+]1C ZINC000344233932 279121533 /nfs/dbraw/zinc/12/15/33/279121533.db2.gz CXONQUVLIWAMLF-MLGOLLRUSA-N 1 1 332.404 2.145 20 5 EEBDMO C[C@@H](C(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])[NH+]1CCSCC1 ZINC000293871631 293315131 /nfs/dbraw/zinc/31/51/31/293315131.db2.gz DZCUXIGFVCLKHM-LBPRGKRZSA-N 1 1 337.445 2.383 20 5 EEBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+]C[C@@](C)(F)C1 ZINC000295315057 293680658 /nfs/dbraw/zinc/68/06/58/293680658.db2.gz WKAFHGHBTMODGU-IAQYHMDHSA-N 1 1 341.408 2.235 20 5 EEBDMO O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1c1ccncc1 ZINC000423961744 304518736 /nfs/dbraw/zinc/51/87/36/304518736.db2.gz DSGBWSXAABHQKA-OAHLLOKOSA-N 1 1 346.774 2.430 20 5 EEBDMO C[C@@H]1[C@H](C)N(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000332477411 312013533 /nfs/dbraw/zinc/01/35/33/312013533.db2.gz VMMZITMXXYIZSM-KGLIPLIRSA-N 1 1 346.431 2.360 20 5 EEBDMO C[C@@H]1[C@H](C)N(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000332477411 312013534 /nfs/dbraw/zinc/01/35/34/312013534.db2.gz VMMZITMXXYIZSM-KGLIPLIRSA-N 1 1 346.431 2.360 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H](O)[C@@H](CO)C3)o2)c1 ZINC000414559659 313041546 /nfs/dbraw/zinc/04/15/46/313041546.db2.gz PEKHBMUXXYOIIQ-CJNGLKHVSA-N 1 1 332.356 2.030 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(C)C[C@@H]2CCC[N@H+]2C)c1 ZINC000422027675 314171685 /nfs/dbraw/zinc/17/16/85/314171685.db2.gz VSLLHQHIEYHGJD-AWEZNQCLSA-N 1 1 335.404 2.225 20 5 EEBDMO CCC[C@@H]1C[NH2+]CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000440870412 315156572 /nfs/dbraw/zinc/15/65/72/315156572.db2.gz YUOFSBXNOAVCHZ-LLVKDONJSA-N 1 1 347.824 2.011 20 5 EEBDMO Cc1ccccc1C[C@@H]1CCC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000441378019 315184009 /nfs/dbraw/zinc/18/40/09/315184009.db2.gz CPIQTKOCTAWGHF-FUHWJXTLSA-N 1 1 344.415 2.168 20 5 EEBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000445200170 315351882 /nfs/dbraw/zinc/35/18/82/315351882.db2.gz ZUNMPJOAHJNSCX-CYBMUJFWSA-N 1 1 336.392 2.080 20 5 EEBDMO Cc1[nH+]ccn1CCCn1nc(-c2ccccc2[N+](=O)[O-])oc1=O ZINC000580892537 324147847 /nfs/dbraw/zinc/14/78/47/324147847.db2.gz LNSGPOUURVRNKP-UHFFFAOYSA-N 1 1 329.316 2.007 20 5 EEBDMO CC(C)Oc1cccc(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1 ZINC000120572586 463013472 /nfs/dbraw/zinc/01/34/72/463013472.db2.gz GAVRHUKVVCBOJZ-MRXNPFEDSA-N 1 1 348.403 2.071 20 5 EEBDMO COc1cc(CN2CCC[C@@H](C[NH+]3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000337404094 465349619 /nfs/dbraw/zinc/34/96/19/465349619.db2.gz LUVBFSISAUERAH-INIZCTEOSA-N 1 1 349.431 2.148 20 5 EEBDMO CC(C)[NH+]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC1 ZINC000045428220 462585558 /nfs/dbraw/zinc/58/55/58/462585558.db2.gz QAMJUABCMMEBPY-UHFFFAOYSA-N 1 1 346.431 2.361 20 5 EEBDMO CCOc1ccc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc1 ZINC000088523127 462633390 /nfs/dbraw/zinc/63/33/90/462633390.db2.gz HXEJQFJCPGHRGE-AWEZNQCLSA-N 1 1 343.387 2.470 20 5 EEBDMO CCOc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc1 ZINC000088523127 462633397 /nfs/dbraw/zinc/63/33/97/462633397.db2.gz HXEJQFJCPGHRGE-AWEZNQCLSA-N 1 1 343.387 2.470 20 5 EEBDMO CC(C)[N@@H+](CCN1C(=O)NC(C)(C)C1=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350007 462697461 /nfs/dbraw/zinc/69/74/61/462697461.db2.gz YXSGCQVBXHEYPX-UHFFFAOYSA-N 1 1 348.403 2.136 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC2(C1)OCCO2 ZINC000090563971 462798414 /nfs/dbraw/zinc/79/84/14/462798414.db2.gz HFNHNMYOUKSOHW-UHFFFAOYSA-N 1 1 349.387 2.071 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H]2OCCC[C@@H]2C1 ZINC000155569969 462910977 /nfs/dbraw/zinc/91/09/77/462910977.db2.gz TVELTAPKXZCCAZ-IUODEOHRSA-N 1 1 349.387 2.043 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H]2OCCC[C@@H]2C1 ZINC000155569969 462910984 /nfs/dbraw/zinc/91/09/84/462910984.db2.gz TVELTAPKXZCCAZ-IUODEOHRSA-N 1 1 349.387 2.043 20 5 EEBDMO CC(C)[C@H](CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)[NH+]1CCOCC1 ZINC000068123326 463096195 /nfs/dbraw/zinc/09/61/95/463096195.db2.gz SNAWOTNITGRDLB-JZLODUJNSA-N 1 1 347.415 2.081 20 5 EEBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)Cc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000025407518 463122965 /nfs/dbraw/zinc/12/29/65/463122965.db2.gz VRQSPMOSOIOQLB-KBPBESRZSA-N 1 1 349.431 2.141 20 5 EEBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000079718509 463244458 /nfs/dbraw/zinc/24/44/58/463244458.db2.gz VZCVHPMKPHMTJS-LSDHHAIUSA-N 1 1 348.447 2.268 20 5 EEBDMO O=[N+]([O-])c1ccc(NCC[NH+]2CCN(c3ccc(F)cc3)CC2)nc1 ZINC000029618951 463265400 /nfs/dbraw/zinc/26/54/00/463265400.db2.gz RSJVNGSLOXYCCB-UHFFFAOYSA-N 1 1 345.378 2.363 20 5 EEBDMO O=C(/C=C/c1ccc(F)cc1[N+](=O)[O-])N1CC[N@H+]2CCCC[C@H]2C1 ZINC000491323537 468350134 /nfs/dbraw/zinc/35/01/34/468350134.db2.gz ZXZLHGKTZKWVHM-ZKKXHLJNSA-N 1 1 333.363 2.444 20 5 EEBDMO C[NH+](C)[C@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000144264960 463373969 /nfs/dbraw/zinc/37/39/69/463373969.db2.gz OTWBVRVDGWKIJW-KRWDZBQOSA-N 1 1 342.399 2.426 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCc3ccccc3C2)c1 ZINC000032757797 463392580 /nfs/dbraw/zinc/39/25/80/463392580.db2.gz IUMQIRJWBXFHTQ-QGZVFWFLSA-N 1 1 328.368 2.393 20 5 EEBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC1(O)CCCC1 ZINC000152248796 463666043 /nfs/dbraw/zinc/66/60/43/463666043.db2.gz QXPKDKIWFIMRJU-UHFFFAOYSA-N 1 1 332.360 2.382 20 5 EEBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H]1CN1CCOCC1 ZINC000255897263 463752906 /nfs/dbraw/zinc/75/29/06/463752906.db2.gz VNDUMGOMTHETNG-GPCFVJJQSA-N 1 1 331.416 2.405 20 5 EEBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000171167910 463802668 /nfs/dbraw/zinc/80/26/68/463802668.db2.gz KCDVLHOBRVXHSB-ZDUSSCGKSA-N 1 1 345.403 2.278 20 5 EEBDMO CC(C)(C)[NH+]1CCC(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000194284491 463826757 /nfs/dbraw/zinc/82/67/57/463826757.db2.gz YWIHMXXNSBRCFF-UHFFFAOYSA-N 1 1 345.403 2.464 20 5 EEBDMO C[C@@H](CCN1CCN(C)CC1)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000185864447 463894082 /nfs/dbraw/zinc/89/40/82/463894082.db2.gz CIQFLKGRCSGLGC-YERXGYGTSA-N 1 1 332.448 2.224 20 5 EEBDMO Cn1cc([C@@H](CO)[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cn1 ZINC000278996340 464022980 /nfs/dbraw/zinc/02/29/80/464022980.db2.gz FILSLAHPFRJCHI-HZPDHXFCSA-N 1 1 330.388 2.374 20 5 EEBDMO C[NH+](C)[C@H](CNC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccccc1Cl ZINC000179165183 464072647 /nfs/dbraw/zinc/07/26/47/464072647.db2.gz KBKLLRVGAPIZCQ-LLVKDONJSA-N 1 1 337.767 2.004 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@](C)(O)CC1 ZINC000279255086 464080618 /nfs/dbraw/zinc/08/06/18/464080618.db2.gz AJWZUGSNOVGQJK-KRWDZBQOSA-N 1 1 335.404 2.469 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+](C)CC2(O)CCCC2)cccc1[N+](=O)[O-] ZINC000269760967 464084167 /nfs/dbraw/zinc/08/41/67/464084167.db2.gz BGUSPFLCGIRFMN-UHFFFAOYSA-N 1 1 335.404 2.469 20 5 EEBDMO CC(C)O[C@@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000579707606 468399205 /nfs/dbraw/zinc/39/92/05/468399205.db2.gz AOJCPPQUPNQKBC-CQSZACIVSA-N 1 1 349.387 2.392 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000270780996 464267242 /nfs/dbraw/zinc/26/72/42/464267242.db2.gz JMVPKPYPLLABCU-ZBFHGGJFSA-N 1 1 340.383 2.500 20 5 EEBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000264605252 464391280 /nfs/dbraw/zinc/39/12/80/464391280.db2.gz DSZDKSQNKZOOQS-NSHDSACASA-N 1 1 328.372 2.290 20 5 EEBDMO [NH3+]Cc1nc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cs1 ZINC000237927618 464405557 /nfs/dbraw/zinc/40/55/57/464405557.db2.gz PRJMMJRGUMDKNN-UHFFFAOYSA-N 1 1 334.401 2.263 20 5 EEBDMO CCCc1n[nH]c(C(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000264702978 464429566 /nfs/dbraw/zinc/42/95/66/464429566.db2.gz WXLNYKQOUZOCNM-NWDGAFQWSA-N 1 1 337.424 2.121 20 5 EEBDMO C[C@@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000294303312 464459633 /nfs/dbraw/zinc/45/96/33/464459633.db2.gz IWQSAMIQSRXNJF-AWEZNQCLSA-N 1 1 333.432 2.385 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCO[C@@H]2CC[N@H+](C)C[C@@H]21 ZINC000285295355 464513998 /nfs/dbraw/zinc/51/39/98/464513998.db2.gz PCKFBCLHEHXAHP-LSDHHAIUSA-N 1 1 347.415 2.065 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)[C@H]2C1 ZINC000272258087 464539339 /nfs/dbraw/zinc/53/93/39/464539339.db2.gz AIFDWGUXKYNZSR-PXAZEXFGSA-N 1 1 344.415 2.335 20 5 EEBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000265626862 464622771 /nfs/dbraw/zinc/62/27/71/464622771.db2.gz OJNSYZGCVQIUNW-ZDUSSCGKSA-N 1 1 328.372 2.269 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000265626862 464622777 /nfs/dbraw/zinc/62/27/77/464622777.db2.gz OJNSYZGCVQIUNW-ZDUSSCGKSA-N 1 1 328.372 2.269 20 5 EEBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 ZINC000285631598 464635436 /nfs/dbraw/zinc/63/54/36/464635436.db2.gz KUBACLNVYKLQSQ-KBRIMQKVSA-N 1 1 330.388 2.235 20 5 EEBDMO C[C@@H]1CSCC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000190418919 464640189 /nfs/dbraw/zinc/64/01/89/464640189.db2.gz BQKCCGXXAMDJOS-SWLSCSKDSA-N 1 1 335.429 2.385 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+](C2CC2)C[C@H](C)C1 ZINC000294952349 464660869 /nfs/dbraw/zinc/66/08/69/464660869.db2.gz AWYCAKFIFBBWHU-KGLIPLIRSA-N 1 1 346.431 2.338 20 5 EEBDMO CC[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)c1cccc(OC)c1 ZINC000247485152 464684116 /nfs/dbraw/zinc/68/41/16/464684116.db2.gz KMDAJWGFZZEVDY-CJNGLKHVSA-N 1 1 348.403 2.244 20 5 EEBDMO Cn1cc([C@@H]2CSCC[N@@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000191201394 464797096 /nfs/dbraw/zinc/79/70/96/464797096.db2.gz NQAXASXXNAOYJG-HOTGVXAUSA-N 1 1 348.428 2.152 20 5 EEBDMO Cn1cc([C@@H]2CSCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000191201394 464797099 /nfs/dbraw/zinc/79/70/99/464797099.db2.gz NQAXASXXNAOYJG-HOTGVXAUSA-N 1 1 348.428 2.152 20 5 EEBDMO COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)O1 ZINC000282465544 464828810 /nfs/dbraw/zinc/82/88/10/464828810.db2.gz NFBYQMRZAPWDEL-MPESAESLSA-N 1 1 334.372 2.278 20 5 EEBDMO COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)[N@H+]2Cc2ccc([N+](=O)[O-])cc2)O1 ZINC000282465544 464828813 /nfs/dbraw/zinc/82/88/13/464828813.db2.gz NFBYQMRZAPWDEL-MPESAESLSA-N 1 1 334.372 2.278 20 5 EEBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)[C@@H]1CCC[C@H]1O ZINC000286475712 464930488 /nfs/dbraw/zinc/93/04/88/464930488.db2.gz LDHNEJVOEIQANS-CUOATXAZSA-N 1 1 341.795 2.420 20 5 EEBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1 ZINC000192477354 464932810 /nfs/dbraw/zinc/93/28/10/464932810.db2.gz MBMODWSWISQHDU-UPJWGTAASA-N 1 1 335.429 2.095 20 5 EEBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000554600011 468428534 /nfs/dbraw/zinc/42/85/34/468428534.db2.gz QZLFRTQHHPKKRE-GFCCVEGCSA-N 1 1 337.424 2.388 20 5 EEBDMO CCN(C[C@H]1CCC[N@@H+]1CC)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000554600011 468428536 /nfs/dbraw/zinc/42/85/36/468428536.db2.gz QZLFRTQHHPKKRE-GFCCVEGCSA-N 1 1 337.424 2.388 20 5 EEBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000554600011 468428539 /nfs/dbraw/zinc/42/85/39/468428539.db2.gz QZLFRTQHHPKKRE-GFCCVEGCSA-N 1 1 337.424 2.388 20 5 EEBDMO CCC[N@H+]1CC[C@@H](CNc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000359496706 465413506 /nfs/dbraw/zinc/41/35/06/465413506.db2.gz NIDCJERVHDHYRB-LBPRGKRZSA-N 1 1 331.376 2.789 20 5 EEBDMO C[N@@H+](CCNC(=O)COc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000299100603 465602306 /nfs/dbraw/zinc/60/23/06/465602306.db2.gz MNYFUOYNVIHNKS-UHFFFAOYSA-N 1 1 343.383 2.222 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+](C)[C@H](C)[C@@H]1C ZINC000357018538 465705023 /nfs/dbraw/zinc/70/50/23/465705023.db2.gz ABHHUXKGBNRRRS-KGLIPLIRSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN(C)[C@H](C)[C@@H]1C ZINC000357018538 465705029 /nfs/dbraw/zinc/70/50/29/465705029.db2.gz ABHHUXKGBNRRRS-KGLIPLIRSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCN(C)[C@H](C)[C@@H]1C ZINC000357018538 465705034 /nfs/dbraw/zinc/70/50/34/465705034.db2.gz ABHHUXKGBNRRRS-KGLIPLIRSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000330605580 465728093 /nfs/dbraw/zinc/72/80/93/465728093.db2.gz ZHPFEKWSRRETTF-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)N(C)C[C@@H]1C ZINC000330605580 465728100 /nfs/dbraw/zinc/72/81/00/465728100.db2.gz ZHPFEKWSRRETTF-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)N(C)C[C@@H]1C ZINC000330605580 465728107 /nfs/dbraw/zinc/72/81/07/465728107.db2.gz ZHPFEKWSRRETTF-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO CC(C)(C)CC[NH+]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 ZINC000331212881 465980701 /nfs/dbraw/zinc/98/07/01/465980701.db2.gz SRYIYTZJSAYWOW-UHFFFAOYSA-N 1 1 335.404 2.494 20 5 EEBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000346200032 465984123 /nfs/dbraw/zinc/98/41/23/465984123.db2.gz QSGGVHHDXSXLFB-VBQJREDUSA-N 1 1 347.415 2.162 20 5 EEBDMO COc1ccc(NC(=O)C[NH2+][C@H](C)c2ccncc2F)c([N+](=O)[O-])c1 ZINC000338360033 466059314 /nfs/dbraw/zinc/05/93/14/466059314.db2.gz VZJZXHMNLRRDBA-SNVBAGLBSA-N 1 1 348.334 2.427 20 5 EEBDMO C[C@@H]1C[N@H+](CCC2CCN(c3ncc([N+](=O)[O-])cn3)CC2)C[C@H](C)O1 ZINC000302147944 466106414 /nfs/dbraw/zinc/10/64/14/466106414.db2.gz IYDHUMVULJXTOB-OKILXGFUSA-N 1 1 349.435 2.101 20 5 EEBDMO COC(=O)c1cnc(NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000302659472 466163875 /nfs/dbraw/zinc/16/38/75/466163875.db2.gz AVYFQNQEYVMYDK-NEPJUHHUSA-N 1 1 336.392 2.309 20 5 EEBDMO O=C1CCCN1C[C@H]1CCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000362998096 466168782 /nfs/dbraw/zinc/16/87/82/466168782.db2.gz QWCSQJDMNBFKOS-OAHLLOKOSA-N 1 1 347.415 2.451 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](C(=O)N2CCCC2)C1 ZINC000331719421 466215732 /nfs/dbraw/zinc/21/57/32/466215732.db2.gz IIWIGDLNZQCHJI-CQSZACIVSA-N 1 1 347.415 2.438 20 5 EEBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@](O)(C(=O)N2CCCC2)C1 ZINC000331749017 466231158 /nfs/dbraw/zinc/23/11/58/466231158.db2.gz ZSVKDYRNHZRASU-KDOFPFPSSA-N 1 1 347.415 2.105 20 5 EEBDMO Cc1cc(N2CC[NH+](CCO)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000338634139 466276991 /nfs/dbraw/zinc/27/69/91/466276991.db2.gz RXIRZQCHBGCTFL-UHFFFAOYSA-N 1 1 333.310 2.036 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](C)[C@@H]1CO ZINC000305455945 466408712 /nfs/dbraw/zinc/40/87/12/466408712.db2.gz TVVACTIQJMHLRA-LRDDRELGSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1nc([N+](=O)[O-])c(-c2noc([C@H](c3ccccc3)[NH+](C)C)n2)n1C ZINC000347129403 466415710 /nfs/dbraw/zinc/41/57/10/466415710.db2.gz BJBVXLFTDDYDHI-LBPRGKRZSA-N 1 1 342.359 2.338 20 5 EEBDMO CC(C)[C@@H]1CN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C ZINC000332264206 466477359 /nfs/dbraw/zinc/47/73/59/466477359.db2.gz OESNYSGSXZYQMV-KRWDZBQOSA-N 1 1 344.415 2.348 20 5 EEBDMO CN(C)CC[N@@H+](C)CCCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000341047812 466539614 /nfs/dbraw/zinc/53/96/14/466539614.db2.gz MKNCNNCCYQWBTF-UHFFFAOYSA-N 1 1 331.420 2.438 20 5 EEBDMO CN(CCCNc1ccc2ncccc2c1[N+](=O)[O-])CC[NH+](C)C ZINC000341047812 466539630 /nfs/dbraw/zinc/53/96/30/466539630.db2.gz MKNCNNCCYQWBTF-UHFFFAOYSA-N 1 1 331.420 2.438 20 5 EEBDMO Cc1cccc(C(=O)NC2CCN(c3[nH+]ccn3C)CC2)c1[N+](=O)[O-] ZINC000373020793 466666412 /nfs/dbraw/zinc/66/64/12/466666412.db2.gz CADOJKKKMGCNNF-UHFFFAOYSA-N 1 1 343.387 2.036 20 5 EEBDMO NC(=O)c1ccc(C[N@@H+]2C[C@H](O)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000411944315 466942319 /nfs/dbraw/zinc/94/23/19/466942319.db2.gz NFHPFKFVRWCPNH-HZPDHXFCSA-N 1 1 341.367 2.002 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2C[C@H](O)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000411944315 466942323 /nfs/dbraw/zinc/94/23/23/466942323.db2.gz NFHPFKFVRWCPNH-HZPDHXFCSA-N 1 1 341.367 2.002 20 5 EEBDMO C[N@H+]1CC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000412354527 467072827 /nfs/dbraw/zinc/07/28/27/467072827.db2.gz BLILCVDEBONAKL-JZXOWHBKSA-N 1 1 329.400 2.253 20 5 EEBDMO Cc1[nH+]ccn1CCNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000431974411 467206837 /nfs/dbraw/zinc/20/68/37/467206837.db2.gz SRWGVAGRMFNPKD-UHFFFAOYSA-N 1 1 331.376 2.334 20 5 EEBDMO C[C@@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000432180894 467222649 /nfs/dbraw/zinc/22/26/49/467222649.db2.gz XWTMDWLOQXRVIB-CYBMUJFWSA-N 1 1 344.415 2.424 20 5 EEBDMO C[C@H]1C[N@@H+](CCCNCc2ccc([N+](=O)[O-])cc2F)CCCO1 ZINC000432360625 467234251 /nfs/dbraw/zinc/23/42/51/467234251.db2.gz AWNMQLXWOSMYGN-ZDUSSCGKSA-N 1 1 325.384 2.324 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451430551 467256658 /nfs/dbraw/zinc/25/66/58/467256658.db2.gz XZFPTTFOROLVJZ-FMKPAKJESA-N 1 1 347.415 2.467 20 5 EEBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNc1ncnc2cccc([N+](=O)[O-])c21 ZINC000447801535 467588762 /nfs/dbraw/zinc/58/87/62/467588762.db2.gz CTUTZSSYHAOPMJ-CQSZACIVSA-N 1 1 329.404 3.070 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]CCC(C)(C)CO)c1ccc([N+](=O)[O-])cc1 ZINC000449409723 467641360 /nfs/dbraw/zinc/64/13/60/467641360.db2.gz VPBUPFGPDAWYHI-OAHLLOKOSA-N 1 1 332.404 2.416 20 5 EEBDMO CCN1CCN(CC(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000449745046 467704883 /nfs/dbraw/zinc/70/48/83/467704883.db2.gz LEVXGMPZDJUPBO-UHFFFAOYSA-N 1 1 338.427 2.240 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000457933329 467734144 /nfs/dbraw/zinc/73/41/44/467734144.db2.gz DMDNVABQUNTDNP-HNNXBMFYSA-N 1 1 334.420 2.263 20 5 EEBDMO CC(C)[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000487976693 468064551 /nfs/dbraw/zinc/06/45/51/468064551.db2.gz ZWSNPANTYAYMLU-INIZCTEOSA-N 1 1 334.420 2.195 20 5 EEBDMO CC(C)[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C ZINC000487976693 468064554 /nfs/dbraw/zinc/06/45/54/468064554.db2.gz ZWSNPANTYAYMLU-INIZCTEOSA-N 1 1 334.420 2.195 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C ZINC000487976693 468064556 /nfs/dbraw/zinc/06/45/56/468064556.db2.gz ZWSNPANTYAYMLU-INIZCTEOSA-N 1 1 334.420 2.195 20 5 EEBDMO COCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CCC[C@@H]1C ZINC000488036519 468068860 /nfs/dbraw/zinc/06/88/60/468068860.db2.gz RPBNPIIPGMOKHK-WFASDCNBSA-N 1 1 335.404 2.331 20 5 EEBDMO C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000488355972 468082533 /nfs/dbraw/zinc/08/25/33/468082533.db2.gz YJOOERJHWLJVFV-UFBFGSQYSA-N 1 1 342.193 2.494 20 5 EEBDMO CCOC(=O)C[N@H+](CC)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000532483225 468120159 /nfs/dbraw/zinc/12/01/59/468120159.db2.gz BVZWGGJFGIQYSI-UHFFFAOYSA-N 1 1 337.376 2.117 20 5 EEBDMO CCOC(=O)C[N@@H+](CC)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000532483225 468120162 /nfs/dbraw/zinc/12/01/62/468120162.db2.gz BVZWGGJFGIQYSI-UHFFFAOYSA-N 1 1 337.376 2.117 20 5 EEBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000548949976 468162062 /nfs/dbraw/zinc/16/20/62/468162062.db2.gz AIBQMJDDMPLLPO-QWHCGFSZSA-N 1 1 343.387 2.053 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000548949976 468162064 /nfs/dbraw/zinc/16/20/64/468162064.db2.gz AIBQMJDDMPLLPO-QWHCGFSZSA-N 1 1 343.387 2.053 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000594375533 468565601 /nfs/dbraw/zinc/56/56/01/468565601.db2.gz ZWGLYMRWAXTDKW-OKILXGFUSA-N 1 1 347.415 2.499 20 5 EEBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000594375533 468565605 /nfs/dbraw/zinc/56/56/05/468565605.db2.gz ZWGLYMRWAXTDKW-OKILXGFUSA-N 1 1 347.415 2.499 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@H](c3cccnc3)C2)c1 ZINC000592140015 468634174 /nfs/dbraw/zinc/63/41/74/468634174.db2.gz SYENEIWQCWTTSX-WBVHZDCISA-N 1 1 343.383 2.219 20 5 EEBDMO CNc1c(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000597861853 468697134 /nfs/dbraw/zinc/69/71/34/468697134.db2.gz XHTOUBANEJAXEQ-GFCCVEGCSA-N 1 1 334.420 2.487 20 5 EEBDMO C[N@H+]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1(C)C ZINC000559758598 468754311 /nfs/dbraw/zinc/75/43/11/468754311.db2.gz GMTWATDSJNTNSU-UHFFFAOYSA-N 1 1 331.376 2.171 20 5 EEBDMO CCC[N@H+]1CC[C@@H](N[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000595097592 468758130 /nfs/dbraw/zinc/75/81/30/468758130.db2.gz YUCIFEOVTWFSHO-NVXWUHKLSA-N 1 1 343.431 2.492 20 5 EEBDMO O=C1CC[C@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC[C@H]2N1 ZINC000601194859 468777987 /nfs/dbraw/zinc/77/79/87/468777987.db2.gz URGFSILWWCMBFP-SMDDNHRTSA-N 1 1 326.356 2.248 20 5 EEBDMO Cc1ccnc(N2CC[NH+](Cc3ccc(O)cc3)CC2)c1[N+](=O)[O-] ZINC000601258054 468801569 /nfs/dbraw/zinc/80/15/69/468801569.db2.gz UPBMMGLLZRZBCF-UHFFFAOYSA-N 1 1 328.372 2.326 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000595505225 468880109 /nfs/dbraw/zinc/88/01/09/468880109.db2.gz QVTGRHIJCAHYCJ-KSSFIOAISA-N 1 1 346.431 2.340 20 5 EEBDMO CC[C@@H](C)[N@@H+](C)CCNS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1C ZINC000598600353 468928028 /nfs/dbraw/zinc/92/80/28/468928028.db2.gz DAYATUQBBPFQCI-GFCCVEGCSA-N 1 1 343.449 2.220 20 5 EEBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@H]1COCCO1 ZINC000595736607 468977781 /nfs/dbraw/zinc/97/77/81/468977781.db2.gz MWUJZQADAPNZKX-FZMZJTMJSA-N 1 1 348.359 2.053 20 5 EEBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@H]1COCCO1 ZINC000595736607 468977788 /nfs/dbraw/zinc/97/77/88/468977788.db2.gz MWUJZQADAPNZKX-FZMZJTMJSA-N 1 1 348.359 2.053 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[NH+]2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000610604940 469015742 /nfs/dbraw/zinc/01/57/42/469015742.db2.gz RGMIJSDCTMTFSK-RKDXNWHRSA-N 1 1 346.231 2.464 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000602764967 469059479 /nfs/dbraw/zinc/05/94/79/469059479.db2.gz ROOWAJWPMXOSDV-HNNXBMFYSA-N 1 1 334.376 2.374 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000602764967 469059484 /nfs/dbraw/zinc/05/94/84/469059484.db2.gz ROOWAJWPMXOSDV-HNNXBMFYSA-N 1 1 334.376 2.374 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000602779741 469068989 /nfs/dbraw/zinc/06/89/89/469068989.db2.gz NVYDOESDEYWEKM-QGZVFWFLSA-N 1 1 343.431 2.306 20 5 EEBDMO C[C@@H]1C[C@@H](N2CCOCC2)C[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000589187845 469209626 /nfs/dbraw/zinc/20/96/26/469209626.db2.gz ZGXYIIRRDLMVGH-MAJSYBNXSA-N 1 1 331.416 2.403 20 5 EEBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000618980600 469485528 /nfs/dbraw/zinc/48/55/28/469485528.db2.gz FMAZPWZRZQRDKX-UHFFFAOYSA-N 1 1 345.403 2.085 20 5 EEBDMO CN(CC[N@H+]1CCOC(C)(C)C1)c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000618980600 469485534 /nfs/dbraw/zinc/48/55/34/469485534.db2.gz FMAZPWZRZQRDKX-UHFFFAOYSA-N 1 1 345.403 2.085 20 5 EEBDMO CC(C)[C@H]1CN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C ZINC000617101467 469593603 /nfs/dbraw/zinc/59/36/03/469593603.db2.gz BREIYMFULHQQSR-OAHLLOKOSA-N 1 1 335.404 2.138 20 5 EEBDMO C[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)S1 ZINC000610336855 470005077 /nfs/dbraw/zinc/00/50/77/470005077.db2.gz PFFJTTFCNPBZDG-SCRDCRAPSA-N 1 1 326.418 2.160 20 5 EEBDMO C[C@@H](CN1CCN(C)CC1)[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000154907280 533840346 /nfs/dbraw/zinc/84/03/46/533840346.db2.gz OXCHGWZGYXBXBZ-MAUKXSAKSA-N 1 1 346.475 2.141 20 5 EEBDMO CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000191644702 528436574 /nfs/dbraw/zinc/43/65/74/528436574.db2.gz FOQDYEZDMRELDV-QGZVFWFLSA-N 1 1 335.404 2.067 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000111352738 535491542 /nfs/dbraw/zinc/49/15/42/535491542.db2.gz CGGOMDRAPSVDKZ-CYBMUJFWSA-N 1 1 341.433 2.056 20 5 EEBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@H](n4ccnc4)C3)c2c1 ZINC000738160911 578001928 /nfs/dbraw/zinc/00/19/28/578001928.db2.gz ZWWDHBYEIFEYEU-HNNXBMFYSA-N 1 1 326.360 2.436 20 5 EEBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@H](n4ccnc4)C3)c2c1 ZINC000738160911 578001929 /nfs/dbraw/zinc/00/19/29/578001929.db2.gz ZWWDHBYEIFEYEU-HNNXBMFYSA-N 1 1 326.360 2.436 20 5 EEBDMO CCc1[nH]nc(C(=O)N(C)Cc2ccc(C[NH+](C)C)cc2)c1[N+](=O)[O-] ZINC000738515966 578017821 /nfs/dbraw/zinc/01/78/21/578017821.db2.gz GOCKZYLEEVVAKO-UHFFFAOYSA-N 1 1 345.403 2.214 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)NNc1cccc([N+](=O)[O-])c1C ZINC000727981575 576465429 /nfs/dbraw/zinc/46/54/29/576465429.db2.gz OJZMADKUQKXVPE-GFCCVEGCSA-N 1 1 337.449 2.179 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2CCN(c3ccc(O)cc3)CC2)cc1 ZINC000776272663 577456132 /nfs/dbraw/zinc/45/61/32/577456132.db2.gz ZGGPVANZEONXQK-SFHVURJKSA-N 1 1 343.383 2.156 20 5 EEBDMO COc1cc(C[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)ccc1O ZINC000776582184 577463221 /nfs/dbraw/zinc/46/32/21/577463221.db2.gz LOUGNOPPQMKMSV-INIZCTEOSA-N 1 1 332.356 2.474 20 5 EEBDMO CC[C@@H]1CN(C(C)=O)[C@@H](CC)C[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776591264 577463637 /nfs/dbraw/zinc/46/36/37/577463637.db2.gz INNCEOCLHWTCKL-SOLBZPMBSA-N 1 1 349.431 2.350 20 5 EEBDMO C[C@H]1CCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000766145987 577513776 /nfs/dbraw/zinc/51/37/76/577513776.db2.gz DNPQUTZYDNAVHK-LBPRGKRZSA-N 1 1 328.372 2.357 20 5 EEBDMO COc1cc(OCC(=O)OCCCn2cc[nH+]c2C)ccc1[N+](=O)[O-] ZINC000767618328 577541396 /nfs/dbraw/zinc/54/13/96/577541396.db2.gz OPAWJTVSRXJCQC-UHFFFAOYSA-N 1 1 349.343 2.121 20 5 EEBDMO Cc1nn(C[N@@H+]2CCS[C@@H]3COCC[C@H]32)c2ccc([N+](=O)[O-])cc12 ZINC000767781127 577544847 /nfs/dbraw/zinc/54/48/47/577544847.db2.gz IYOJRBVBPBEGOS-HZPDHXFCSA-N 1 1 348.428 2.417 20 5 EEBDMO Cc1nn(C[N@H+]2CCS[C@@H]3COCC[C@H]32)c2ccc([N+](=O)[O-])cc12 ZINC000767781127 577544848 /nfs/dbraw/zinc/54/48/48/577544848.db2.gz IYOJRBVBPBEGOS-HZPDHXFCSA-N 1 1 348.428 2.417 20 5 EEBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000769943347 577587521 /nfs/dbraw/zinc/58/75/21/577587521.db2.gz PKBAJGYUQIFGQU-BBRMVZONSA-N 1 1 348.378 2.413 20 5 EEBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000769943347 577587522 /nfs/dbraw/zinc/58/75/22/577587522.db2.gz PKBAJGYUQIFGQU-BBRMVZONSA-N 1 1 348.378 2.413 20 5 EEBDMO C[C@H](C(=O)OCCC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1F ZINC000755064406 577818989 /nfs/dbraw/zinc/81/89/89/577818989.db2.gz JWCJJLZOZKZLDY-LBPRGKRZSA-N 1 1 340.351 2.103 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C[C@@H]1C ZINC000736568401 578212104 /nfs/dbraw/zinc/21/21/04/578212104.db2.gz BJUASWCYINPYKE-NWDGAFQWSA-N 1 1 345.407 2.084 20 5 EEBDMO CCOC[C@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000177633941 675988613 /nfs/dbraw/zinc/98/86/13/675988613.db2.gz MFFAUSTXKWBZSL-ZDUSSCGKSA-N 1 1 331.376 2.169 20 5 EEBDMO C[C@H](NC(=O)N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000892111542 678013229 /nfs/dbraw/zinc/01/32/29/678013229.db2.gz MLYUAHOWNDDVDV-RVSPLBMKSA-N 1 1 332.404 2.249 20 5 EEBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCN(C(=O)CC(C)(C)O)CC1 ZINC000985402451 686545917 /nfs/dbraw/zinc/54/59/17/686545917.db2.gz QACRRKSMHATPNK-UHFFFAOYSA-N 1 1 349.431 2.179 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000072501002 1192539994 /nfs/dbraw/zinc/53/99/94/1192539994.db2.gz OVUZIMVOIQDWFL-OAHLLOKOSA-N 1 1 346.431 2.409 20 5 EEBDMO Cc1ccc(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001034644187 1196465655 /nfs/dbraw/zinc/46/56/55/1196465655.db2.gz DLTMRFLEESYWAG-BRSBDYLESA-N 1 1 345.443 2.486 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CCN(Cc2cnn(C)c2)CC1 ZINC000876682127 1199720101 /nfs/dbraw/zinc/72/01/01/1199720101.db2.gz FDETXFXKGPHMTC-UHFFFAOYSA-N 1 1 343.431 2.263 20 5 EEBDMO CONC(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000877786480 1200104621 /nfs/dbraw/zinc/10/46/21/1200104621.db2.gz KAJXSBINNLIOAY-UHFFFAOYSA-N 1 1 327.768 2.138 20 5 EEBDMO Cc1cnn([C@H]2CC[N@H+](Cn3ncc4ccc([N+](=O)[O-])cc43)C2)c1 ZINC000811797326 1200312947 /nfs/dbraw/zinc/31/29/47/1200312947.db2.gz CBSBUWQJLRVTHS-HNNXBMFYSA-N 1 1 326.360 2.354 20 5 EEBDMO Cc1cnn([C@H]2CC[N@@H+](Cn3ncc4ccc([N+](=O)[O-])cc43)C2)c1 ZINC000811797326 1200312955 /nfs/dbraw/zinc/31/29/55/1200312955.db2.gz CBSBUWQJLRVTHS-HNNXBMFYSA-N 1 1 326.360 2.354 20 5 EEBDMO Cc1cnn([C@@H]2CC[N@H+](Cn3ncc4cc([N+](=O)[O-])ccc43)C2)c1 ZINC000811800433 1200316614 /nfs/dbraw/zinc/31/66/14/1200316614.db2.gz REKJDCDILGBBBT-OAHLLOKOSA-N 1 1 326.360 2.354 20 5 EEBDMO Cc1cnn([C@@H]2CC[N@@H+](Cn3ncc4cc([N+](=O)[O-])ccc43)C2)c1 ZINC000811800433 1200316621 /nfs/dbraw/zinc/31/66/21/1200316621.db2.gz REKJDCDILGBBBT-OAHLLOKOSA-N 1 1 326.360 2.354 20 5 EEBDMO C[C@H]1CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[N@H+](C2CCC2)C1 ZINC000795118851 1200651219 /nfs/dbraw/zinc/65/12/19/1200651219.db2.gz AMTDJFAXRMDFNE-KSSFIOAISA-N 1 1 333.432 2.434 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1C1OCCO1 ZINC000933904610 1207866643 /nfs/dbraw/zinc/86/66/43/1207866643.db2.gz ZCNKHPNWSYMBLZ-OAHLLOKOSA-N 1 1 349.387 2.069 20 5 EEBDMO COCCO[C@H]1CCC[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000800851066 1234675926 /nfs/dbraw/zinc/67/59/26/1234675926.db2.gz XCTWKVWABRVQIN-HNNXBMFYSA-N 1 1 348.403 2.338 20 5 EEBDMO COCCO[C@H]1CCC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000800851066 1234675929 /nfs/dbraw/zinc/67/59/29/1234675929.db2.gz XCTWKVWABRVQIN-HNNXBMFYSA-N 1 1 348.403 2.338 20 5 EEBDMO Cc1nn(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1[N+](=O)[O-] ZINC000800866298 1234699833 /nfs/dbraw/zinc/69/98/33/1234699833.db2.gz DPEQKGKRDJGBMU-UHFFFAOYSA-N 1 1 333.348 2.448 20 5 EEBDMO Cc1nn(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1[N+](=O)[O-] ZINC000800866298 1234699835 /nfs/dbraw/zinc/69/98/35/1234699835.db2.gz DPEQKGKRDJGBMU-UHFFFAOYSA-N 1 1 333.348 2.448 20 5 EEBDMO Cc1nn(CN2CC[N@H+](C)C[C@@H]2CC(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000902543389 1237844776 /nfs/dbraw/zinc/84/47/76/1237844776.db2.gz SAQTVTZSXCHKLY-HNNXBMFYSA-N 1 1 346.435 2.268 20 5 EEBDMO O=C(NC1(C2CC[NH+](Cc3ccccc3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000154095 1240003481 /nfs/dbraw/zinc/00/34/81/1240003481.db2.gz NWIROQNLIZIMNJ-IAGOWNOFSA-N 1 1 343.427 2.213 20 5 EEBDMO Cc1noc(COC(=O)[C@@H](C(C)C)[NH+]2CCCCC2)c1[N+](=O)[O-] ZINC000853900293 1292516318 /nfs/dbraw/zinc/51/63/18/1292516318.db2.gz WRUQEFZYBHQWSJ-CYBMUJFWSA-N 1 1 325.365 2.445 20 5 EEBDMO COc1cc([N+](=O)[O-])c(C(=O)OCC[NH+]2CCC2)cc1SC ZINC000861386732 1295384710 /nfs/dbraw/zinc/38/47/10/1295384710.db2.gz MPUJDPFFPCDASI-UHFFFAOYSA-N 1 1 326.374 2.188 20 5 EEBDMO CC[NH2+][C@@H](C)c1nc(Cc2cc(OC)cc(OC)c2[N+](=O)[O-])no1 ZINC000863671597 1296379522 /nfs/dbraw/zinc/37/95/22/1296379522.db2.gz DJTWUAASFRLUBE-VIFPVBQESA-N 1 1 336.348 2.256 20 5 EEBDMO CC[N@H+]1CCC[C@H](Oc2ccc3c(c2)oc2cc(=O)ccc-2[n+]3[O-])C1 ZINC001227453637 1301835936 /nfs/dbraw/zinc/83/59/36/1301835936.db2.gz VVUJANUZOYEJRX-HNNXBMFYSA-N 1 1 340.379 2.394 20 5 EEBDMO COC(=O)c1cccc(OC2CC[NH+](CCF)CC2)c1[N+](=O)[O-] ZINC001227891504 1301999850 /nfs/dbraw/zinc/99/98/50/1301999850.db2.gz BBVVCUXBVSTXNF-UHFFFAOYSA-N 1 1 326.324 2.194 20 5 EEBDMO C[C@@H](C[N+](C)(C)C)Oc1nc2cccc(N3CCN(C)CC3)c2o1 ZINC001230104346 1303060764 /nfs/dbraw/zinc/06/07/64/1303060764.db2.gz XRJBPRVHOVFSIX-AWEZNQCLSA-N 1 1 333.456 2.053 20 5 EEBDMO Cc1cnc(NC2(CNC(=O)C[N@H+](C)C(C)C)CCC2)c([N+](=O)[O-])c1 ZINC001111815250 1303932988 /nfs/dbraw/zinc/93/29/88/1303932988.db2.gz AMMRMBYAZXPOIL-UHFFFAOYSA-N 1 1 349.435 2.089 20 5 EEBDMO C[N@@H+](CCCNC(=O)COC1CCCC1)Cc1cccc([N+](=O)[O-])c1 ZINC001234415208 1304914391 /nfs/dbraw/zinc/91/43/91/1304914391.db2.gz VCVGQBSIMMLQFK-UHFFFAOYSA-N 1 1 349.431 2.492 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cc1Cl ZINC000836779174 1315025447 /nfs/dbraw/zinc/02/54/47/1315025447.db2.gz MONQYLKSSLBJSR-YGRLFVJLSA-N 1 1 341.795 2.006 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1Cl ZINC000836779174 1315025450 /nfs/dbraw/zinc/02/54/50/1315025450.db2.gz MONQYLKSSLBJSR-YGRLFVJLSA-N 1 1 341.795 2.006 20 5 EEBDMO C[C@@H]1[C@H](C)C[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)[C@H]1C ZINC000841693841 1315598881 /nfs/dbraw/zinc/59/88/81/1315598881.db2.gz WCNRNQBNAGUTOL-UPJWGTAASA-N 1 1 346.387 2.297 20 5 EEBDMO Cc1n[nH]c(C(=O)N2CCC[C@@H]2CNc2cccc(C)[nH+]2)c1[N+](=O)[O-] ZINC001251968429 1317530765 /nfs/dbraw/zinc/53/07/65/1317530765.db2.gz AJWOIMLUHKOWSA-GFCCVEGCSA-N 1 1 344.375 2.046 20 5 EEBDMO Cc1[nH]nc(C(=O)N2CCC[C@@H]2CNc2cccc(C)[nH+]2)c1[N+](=O)[O-] ZINC001251968429 1317530774 /nfs/dbraw/zinc/53/07/74/1317530774.db2.gz AJWOIMLUHKOWSA-GFCCVEGCSA-N 1 1 344.375 2.046 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(C(=O)c3ccnc4c3ccc3cccnc34)C[C@H]2C1 ZINC001155810062 1317742967 /nfs/dbraw/zinc/74/29/67/1317742967.db2.gz JGUVWRNYNLYWIM-GASCZTMLSA-N 1 1 332.407 2.417 20 5 EEBDMO CCN1CC[C@@]2(C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]2C)C1=O ZINC001254597445 1318138013 /nfs/dbraw/zinc/13/80/13/1318138013.db2.gz SJGQPEBRBMRPKF-IXDGSTSKSA-N 1 1 343.427 2.252 20 5 EEBDMO CCOCC(=O)NCCC1=CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001159143705 1319637034 /nfs/dbraw/zinc/63/70/34/1319637034.db2.gz BAZZBGDRASDMJZ-UHFFFAOYSA-N 1 1 347.415 2.270 20 5 EEBDMO C[NH+](C)/C=C/c1cc(NCCc2cnc(N)s2)ncc1[N+](=O)[O-] ZINC001160379191 1320149372 /nfs/dbraw/zinc/14/93/72/1320149372.db2.gz XGGHEHBPZAHGNR-GQCTYLIASA-N 1 1 334.405 2.215 20 5 EEBDMO Cc1noc(C2(Nc3cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn3)CC2)n1 ZINC001161311733 1320454183 /nfs/dbraw/zinc/45/41/83/1320454183.db2.gz ZGUYBMMWJCJQKC-QPJJXVBHSA-N 1 1 330.348 2.315 20 5 EEBDMO CCOC(=O)c1ccnc(N2CC[N@@H+](C(C)C)[C@H](C)C2)c1[N+](=O)[O-] ZINC001165200295 1321470030 /nfs/dbraw/zinc/47/00/30/1321470030.db2.gz DXXYABMRTOOELN-GFCCVEGCSA-N 1 1 336.392 2.085 20 5 EEBDMO COc1ccc(C[C@H]2CC[N@H+]2CCn2c(C)ncc2[N+](=O)[O-])cc1 ZINC001307526577 1331539554 /nfs/dbraw/zinc/53/95/54/1331539554.db2.gz VQRBOGGPCVHDGT-OAHLLOKOSA-N 1 1 330.388 2.425 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@]12CCC[C@H]1OCC2 ZINC001308168844 1331569155 /nfs/dbraw/zinc/56/91/55/1331569155.db2.gz OUZRVANGNAEBAY-NVXWUHKLSA-N 1 1 333.388 2.424 20 5 EEBDMO C[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC001309924850 1331647677 /nfs/dbraw/zinc/64/76/77/1331647677.db2.gz IMNHRINUQRZDNM-NSHDSACASA-N 1 1 347.824 2.011 20 5 EEBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001322149548 1333218584 /nfs/dbraw/zinc/21/85/84/1333218584.db2.gz YMNIDTUEZAAASH-OAHLLOKOSA-N 1 1 330.388 2.104 20 5 EEBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cn2C)[nH+]1 ZINC001323024291 1333371301 /nfs/dbraw/zinc/37/13/01/1333371301.db2.gz YWRBLSCWYUJVRO-ZDUSSCGKSA-N 1 1 343.387 2.353 20 5 EEBDMO CS[C@@H]1CCCC[N@@H+](Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001609370228 1351948773 /nfs/dbraw/zinc/94/87/73/1351948773.db2.gz YOEOIQGZCJXWIR-CYBMUJFWSA-N 1 1 348.432 2.492 20 5 EEBDMO CCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC001334609671 1336275262 /nfs/dbraw/zinc/27/52/62/1336275262.db2.gz IWDUWUYDBYGWOF-AWEZNQCLSA-N 1 1 346.431 2.409 20 5 EEBDMO C[N@H+]1CCCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1N1CCOC1=O ZINC001339852989 1337084949 /nfs/dbraw/zinc/08/49/49/1337084949.db2.gz FZISAOYITLURGT-CYBMUJFWSA-N 1 1 334.376 2.448 20 5 EEBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] ZINC001591183822 1349444665 /nfs/dbraw/zinc/44/46/65/1349444665.db2.gz ITMXKOPTYFPHFS-CQSZACIVSA-N 1 1 345.407 2.307 20 5 EEBDMO O=C(OCCn1ccc([N+](=O)[O-])n1)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC000815446429 1367994730 /nfs/dbraw/zinc/99/47/30/1367994730.db2.gz VYBRKXJXIRCCNL-CQSZACIVSA-N 1 1 336.392 2.132 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N[C@H]1CC[C@H](Nc2ncccc2[N+](=O)[O-])CC1 ZINC001103644151 1371044055 /nfs/dbraw/zinc/04/40/55/1371044055.db2.gz KLBSKXBFMUYKKL-HDJSIYSDSA-N 1 1 349.435 2.171 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)N1CCC(C)(Nc2ccc([N+](=O)[O-])cn2)CC1 ZINC001112352983 1371409022 /nfs/dbraw/zinc/40/90/22/1371409022.db2.gz LQUCGUKPUKYEAJ-UHFFFAOYSA-N 1 1 349.435 2.123 20 5 EEBDMO C[N@H+](CCNC(=O)/C=C/c1ccc[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC001753047874 1406635029 /nfs/dbraw/zinc/63/50/29/1406635029.db2.gz TWYJCWHYMPHJKO-BQYQJAHWSA-N 1 1 328.372 2.184 20 5 EEBDMO C[N@@H+](CCNC(=O)/C=C/c1ccc[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC001753047874 1406635036 /nfs/dbraw/zinc/63/50/36/1406635036.db2.gz TWYJCWHYMPHJKO-BQYQJAHWSA-N 1 1 328.372 2.184 20 5 EEBDMO CC[N@H+]1CCC[C@@H](CNc2cc(C)c([N+](=O)[O-])c(-c3nn[nH]n3)c2)C1 ZINC001590734126 1403891880 /nfs/dbraw/zinc/89/18/80/1403891880.db2.gz YWMTTYUCPOPSFR-LBPRGKRZSA-N 1 1 345.407 2.227 20 5 EEBDMO O=C(NCC1=CC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1)C(F)F ZINC001755879078 1407932551 /nfs/dbraw/zinc/93/25/51/1407932551.db2.gz ZUDSFYCJDUCSBD-UHFFFAOYSA-N 1 1 325.315 2.108 20 5 EEBDMO O=C(NCC1=CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1)C(F)F ZINC001755879078 1407932553 /nfs/dbraw/zinc/93/25/53/1407932553.db2.gz ZUDSFYCJDUCSBD-UHFFFAOYSA-N 1 1 325.315 2.108 20 5 EEBDMO Cc1nn(CCC(=O)OCC[C@H]2CCCC[N@@H+]2C)c(C)c1[N+](=O)[O-] ZINC000840220821 782430999 /nfs/dbraw/zinc/43/09/99/782430999.db2.gz IWBAJLIMZCLCOX-CQSZACIVSA-N 1 1 338.408 2.216 20 5 EEBDMO Cc1cccnc1C(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001031601216 770056783 /nfs/dbraw/zinc/05/67/83/770056783.db2.gz LDQOAGWZIXFGDR-UHFFFAOYSA-N 1 1 340.383 2.160 20 5 EEBDMO O=C(C[N@H+]1CCCCC[C@H]1CO)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000847014648 790831515 /nfs/dbraw/zinc/83/15/15/790831515.db2.gz OJZIIIRHSGDMCD-LBPRGKRZSA-N 1 1 341.795 2.424 20 5 EEBDMO O=C(C[N@@H+]1CCCCC[C@H]1CO)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000847014648 790831526 /nfs/dbraw/zinc/83/15/26/790831526.db2.gz OJZIIIRHSGDMCD-LBPRGKRZSA-N 1 1 341.795 2.424 20 5 EEBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000817163121 784550020 /nfs/dbraw/zinc/55/00/20/784550020.db2.gz VUJIHFWIUFYHTH-ZDUSSCGKSA-N 1 1 340.811 2.484 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[C@@H](C[NH+]2CCOCC2)C1 ZINC000820289411 785871703 /nfs/dbraw/zinc/87/17/03/785871703.db2.gz PPBIRBVQHMVMFZ-HNNXBMFYSA-N 1 1 347.415 2.006 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000910278289 786609319 /nfs/dbraw/zinc/60/93/19/786609319.db2.gz CWCYIWCCWVXFRO-LBPRGKRZSA-N 1 1 335.404 2.468 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NC/C=C/CNc1cc(C)ccc1[N+](=O)[O-] ZINC001107280801 786701364 /nfs/dbraw/zinc/70/13/64/786701364.db2.gz VDMJWYBZMJWWPV-AATRIKPKSA-N 1 1 334.420 2.329 20 5 EEBDMO CCCN(C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000911513370 787508791 /nfs/dbraw/zinc/50/87/91/787508791.db2.gz ZLGNAHILZXAOQZ-LLVKDONJSA-N 1 1 340.811 2.387 20 5 EEBDMO O=[N+]([O-])c1cccc2c(N[C@@H]3CCC[N@@H+](C4COC4)C3)ccnc21 ZINC001168374911 787635740 /nfs/dbraw/zinc/63/57/40/787635740.db2.gz UQPCRQGYMWFDMP-GFCCVEGCSA-N 1 1 328.372 2.418 20 5 EEBDMO O=[N+]([O-])c1cccc2c(N[C@@H]3CCC[N@H+](C4COC4)C3)ccnc21 ZINC001168374911 787635743 /nfs/dbraw/zinc/63/57/43/787635743.db2.gz UQPCRQGYMWFDMP-GFCCVEGCSA-N 1 1 328.372 2.418 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)C[C@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000844640173 789285995 /nfs/dbraw/zinc/28/59/95/789285995.db2.gz GYCMXWOIRHULER-HBNTYKKESA-N 1 1 336.348 2.056 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000844640173 789286002 /nfs/dbraw/zinc/28/60/02/789286002.db2.gz GYCMXWOIRHULER-HBNTYKKESA-N 1 1 336.348 2.056 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000844642523 789286491 /nfs/dbraw/zinc/28/64/91/789286491.db2.gz JIMKULUPNMMKCA-OPRDCNLKSA-N 1 1 327.331 2.426 20 5 EEBDMO C[C@H]1CCN(Cn2nccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000173532730 791862708 /nfs/dbraw/zinc/86/27/08/791862708.db2.gz JJVMRKWLOOBELP-HNNXBMFYSA-N 1 1 329.404 2.345 20 5 EEBDMO Cc1[nH+]ccn1CCNc1nccc(Br)c1[N+](=O)[O-] ZINC001163928326 795064540 /nfs/dbraw/zinc/06/45/40/795064540.db2.gz GNKNKTPRWKFMNM-UHFFFAOYSA-N 1 1 326.154 2.369 20 5 EEBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CC(N2CCOC(C)(C)C2)C1 ZINC001173234948 797313051 /nfs/dbraw/zinc/31/30/51/797313051.db2.gz VAXHVQXCLWHGJD-AWEZNQCLSA-N 1 1 333.432 2.321 20 5 EEBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@@H]1C[N@@H+]2CCC[C@@H]2CO1 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HVSPURPVJBWONC-UHFFFAOYSA-N 1 1 340.343 2.109 20 5 EEBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)c2ccc([N+](=O)[O-])n2C)c1 ZINC000337440240 274829283 /nfs/dbraw/zinc/82/92/83/274829283.db2.gz CXHLPGRPJMVRHU-UHFFFAOYSA-N 1 1 326.316 2.075 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2C[C@@H]([NH+]3CCCC3)C[C@H]2C)c1[N+](=O)[O-] ZINC000288518498 275066199 /nfs/dbraw/zinc/06/61/99/275066199.db2.gz TVDSSNGQBAMSTJ-NEPJUHHUSA-N 1 1 335.408 2.140 20 5 EEBDMO Cn1cc(C[N@@H+](C)[C@@H]2CCC[C@H]2O)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000289612023 275132426 /nfs/dbraw/zinc/13/24/26/275132426.db2.gz LGMMYFRZWXHDMQ-HZPDHXFCSA-N 1 1 330.388 2.341 20 5 EEBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)C[C@H](C)OC ZINC000291167531 275277552 /nfs/dbraw/zinc/27/75/52/275277552.db2.gz GOUDITOSCIBPSL-LBPRGKRZSA-N 1 1 339.392 2.289 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](n3cccn3)C2)cccc1[N+](=O)[O-] ZINC000291998822 275362370 /nfs/dbraw/zinc/36/23/70/275362370.db2.gz XFKJSOHCRNLHEH-AWEZNQCLSA-N 1 1 343.387 2.375 20 5 EEBDMO C[N@H+]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000371353314 277194153 /nfs/dbraw/zinc/19/41/53/277194153.db2.gz IICUPTKHAKGWFC-IAGOWNOFSA-N 1 1 325.368 2.422 20 5 EEBDMO C[C@@H]1[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CCC[N@H+]1C ZINC000343477498 279125094 /nfs/dbraw/zinc/12/50/94/279125094.db2.gz CRHLFZIMMVWNQW-UKRRQHHQSA-N 1 1 346.431 2.408 20 5 EEBDMO CCc1ccc([C@@H]2CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000293178467 293144696 /nfs/dbraw/zinc/14/46/96/293144696.db2.gz DKYHHRNUFAXCLN-SJLPKXTDSA-N 1 1 344.415 2.204 20 5 EEBDMO C[N@@H+](C[C@H](O)Cc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000293234082 293158283 /nfs/dbraw/zinc/15/82/83/293158283.db2.gz HIRKKMSLKNNDDP-MSOLQXFVSA-N 1 1 330.384 2.164 20 5 EEBDMO C[C@@H]1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+](C2CCC2)C1 ZINC000293643567 293259684 /nfs/dbraw/zinc/25/96/84/293259684.db2.gz HQIARCYQXKOPRW-AWEZNQCLSA-N 1 1 347.415 2.306 20 5 EEBDMO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C(N)=O)c1ccccn1 ZINC000295033803 311538327 /nfs/dbraw/zinc/53/83/27/311538327.db2.gz DMARKBAUUXXEKO-BLLLJJGKSA-N 1 1 328.372 2.127 20 5 EEBDMO COc1c(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000332514801 312018331 /nfs/dbraw/zinc/01/83/31/312018331.db2.gz JMOJYLIIZOWRLB-TZMCWYRMSA-N 1 1 333.388 2.160 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCO)[C@H]1CCCSC1 ZINC000439006778 315063101 /nfs/dbraw/zinc/06/31/01/315063101.db2.gz HGZQWYFLOOERKS-AWEZNQCLSA-N 1 1 326.418 2.293 20 5 EEBDMO CC[C@H](c1ccccc1OC)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000347552907 465089567 /nfs/dbraw/zinc/08/95/67/465089567.db2.gz DESAHUGJFAXUCJ-GOEBONIOSA-N 1 1 348.403 2.244 20 5 EEBDMO Cc1nc(NCc2ccccc2C[NH+]2CCOCC2)ncc1[N+](=O)[O-] ZINC000296510143 465218578 /nfs/dbraw/zinc/21/85/78/465218578.db2.gz LZBSNSTUXHYKDQ-UHFFFAOYSA-N 1 1 343.387 2.138 20 5 EEBDMO C[NH+](C)CCC1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000112925292 462554515 /nfs/dbraw/zinc/55/45/15/462554515.db2.gz JNLJLHBIQYTWJZ-UHFFFAOYSA-N 1 1 345.403 2.275 20 5 EEBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC(C)(CO)CO ZINC000128056374 462606656 /nfs/dbraw/zinc/60/66/56/462606656.db2.gz BIMPAEXHABBVNH-UHFFFAOYSA-N 1 1 334.372 2.278 20 5 EEBDMO C[C@H](CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)[N@H+]1CCCC[C@@H]1C ZINC000521386371 468308003 /nfs/dbraw/zinc/30/80/03/468308003.db2.gz RTJZVIXLSVPOSR-NWDGAFQWSA-N 1 1 349.387 2.316 20 5 EEBDMO CN(c1ncc([N+](=O)[O-])c(N)n1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000074775146 462633392 /nfs/dbraw/zinc/63/33/92/462633392.db2.gz AAZNCIIZUFVBPV-AWEZNQCLSA-N 1 1 342.403 2.068 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000116277935 462752230 /nfs/dbraw/zinc/75/22/30/462752230.db2.gz DVBKSCMJPIZBFK-VXGBXAGGSA-N 1 1 327.812 2.135 20 5 EEBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000130548087 462764064 /nfs/dbraw/zinc/76/40/64/462764064.db2.gz GSDVTDFJCWNXMX-AWEZNQCLSA-N 1 1 343.387 2.371 20 5 EEBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000130548087 462764070 /nfs/dbraw/zinc/76/40/70/462764070.db2.gz GSDVTDFJCWNXMX-AWEZNQCLSA-N 1 1 343.387 2.371 20 5 EEBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000117796507 462812700 /nfs/dbraw/zinc/81/27/00/462812700.db2.gz GVSWOBHCQZVSAT-ZDUSSCGKSA-N 1 1 337.807 2.391 20 5 EEBDMO CCOCC[N@@H+](CC)CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000157526896 463140596 /nfs/dbraw/zinc/14/05/96/463140596.db2.gz WCDMGGWWHSLCRX-UHFFFAOYSA-N 1 1 339.392 2.290 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CCc1ccncc1 ZINC000121491167 463144297 /nfs/dbraw/zinc/14/42/97/463144297.db2.gz GWVGRCKNIVXZFZ-CYBMUJFWSA-N 1 1 328.372 2.491 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1ccncc1 ZINC000121491167 463144303 /nfs/dbraw/zinc/14/43/03/463144303.db2.gz GWVGRCKNIVXZFZ-CYBMUJFWSA-N 1 1 328.372 2.491 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+](C)Cc2cnn(C)c2)cccc1[N+](=O)[O-] ZINC000026256900 463156450 /nfs/dbraw/zinc/15/64/50/463156450.db2.gz WBYVLJJEIQXZGU-UHFFFAOYSA-N 1 1 331.376 2.097 20 5 EEBDMO COCC[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)CC(C)C ZINC000073617034 463631351 /nfs/dbraw/zinc/63/13/51/463631351.db2.gz OOJGMOUYZVRPIL-UHFFFAOYSA-N 1 1 335.404 2.088 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1(O)CCCC1 ZINC000152061089 463638247 /nfs/dbraw/zinc/63/82/47/463638247.db2.gz KEWOGENINDDEMO-UHFFFAOYSA-N 1 1 341.795 2.424 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](N(C)C)C1 ZINC000109809625 463651001 /nfs/dbraw/zinc/65/10/01/463651001.db2.gz QWIXMRXLCYXRRU-HNNXBMFYSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](N(C)C)C1 ZINC000109809625 463651003 /nfs/dbraw/zinc/65/10/03/463651003.db2.gz QWIXMRXLCYXRRU-HNNXBMFYSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000073949682 463673651 /nfs/dbraw/zinc/67/36/51/463673651.db2.gz ZMFLLAMAOCIWDU-ZDUSSCGKSA-N 1 1 345.403 2.278 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@H]1C ZINC000112080307 463689704 /nfs/dbraw/zinc/68/97/04/463689704.db2.gz VXSKOHCKWFVCQT-CHWSQXEVSA-N 1 1 330.388 2.034 20 5 EEBDMO C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCN(C)CC1 ZINC000127348608 463697400 /nfs/dbraw/zinc/69/74/00/463697400.db2.gz GCDYKCDHUNIFHK-MAUKXSAKSA-N 1 1 346.475 2.141 20 5 EEBDMO CC(C)[NH+]1CC(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000590910359 468371026 /nfs/dbraw/zinc/37/10/26/468371026.db2.gz OMPZCDGUJWFXJX-JTQLQIEISA-N 1 1 341.795 2.224 20 5 EEBDMO C[C@H](C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000184924833 463719749 /nfs/dbraw/zinc/71/97/49/463719749.db2.gz QJWLFMXNGFVJGQ-RYUDHWBXSA-N 1 1 335.379 2.438 20 5 EEBDMO Nc1ccc(NCc2ccccc2C[N@H+]2CC[C@H](O)C2)c([N+](=O)[O-])c1 ZINC000286872571 463729681 /nfs/dbraw/zinc/72/96/81/463729681.db2.gz NOXAKXUKYXQVMB-INIZCTEOSA-N 1 1 342.399 2.356 20 5 EEBDMO Cc1sc(C(=O)N2CC[NH2+]C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000261628541 463807243 /nfs/dbraw/zinc/80/72/43/463807243.db2.gz ATNAESHHRJKLKL-CYBMUJFWSA-N 1 1 332.385 2.146 20 5 EEBDMO COc1ccc(C[N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000194364021 463846380 /nfs/dbraw/zinc/84/63/80/463846380.db2.gz HBCGYVDRVQYIQC-HNNXBMFYSA-N 1 1 346.383 2.475 20 5 EEBDMO O=C([C@@H]1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1)N1CCCC1 ZINC000287508320 463909472 /nfs/dbraw/zinc/90/94/72/463909472.db2.gz UJDMQHVDCCHSKI-OAHLLOKOSA-N 1 1 347.415 2.308 20 5 EEBDMO O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000261981386 463916519 /nfs/dbraw/zinc/91/65/19/463916519.db2.gz OCPZLHSHIKMGDN-QGZVFWFLSA-N 1 1 340.383 2.096 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000279125860 464040623 /nfs/dbraw/zinc/04/06/23/464040623.db2.gz BBBCTVJHGRPSDV-NSHDSACASA-N 1 1 338.383 2.166 20 5 EEBDMO CCCC(=O)NC[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000269643068 464044421 /nfs/dbraw/zinc/04/44/21/464044421.db2.gz JTPHYUHAOMIKIN-YOEHRIQHSA-N 1 1 349.431 2.257 20 5 EEBDMO CC(C)(C)[C@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1 ZINC000279740414 464138579 /nfs/dbraw/zinc/13/85/79/464138579.db2.gz KLDNQCQJSORNMF-XJKSGUPXSA-N 1 1 338.404 2.081 20 5 EEBDMO CC(C)(C)[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1 ZINC000279740414 464138580 /nfs/dbraw/zinc/13/85/80/464138580.db2.gz KLDNQCQJSORNMF-XJKSGUPXSA-N 1 1 338.404 2.081 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000172804392 464146628 /nfs/dbraw/zinc/14/66/28/464146628.db2.gz ACASPIGHRVNSFW-XJKSGUPXSA-N 1 1 332.404 2.092 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCO[C@@H]2CC[N@@H+](C)C[C@H]21 ZINC000284810240 464349787 /nfs/dbraw/zinc/34/97/87/464349787.db2.gz KRMRGJSNLQPFSR-SJLPKXTDSA-N 1 1 349.431 2.287 20 5 EEBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@H]2[C@@H](O)C(F)(F)F)cc1 ZINC000264577413 464381580 /nfs/dbraw/zinc/38/15/80/464381580.db2.gz BCMYFBLBQMZOBB-CHWSQXEVSA-N 1 1 334.294 2.361 20 5 EEBDMO COc1ccc(C[N@@H+]2CCC[C@H]2[C@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000264583223 464382299 /nfs/dbraw/zinc/38/22/99/464382299.db2.gz DEXIEAZYSSQFGA-GWCFXTLKSA-N 1 1 334.294 2.491 20 5 EEBDMO COc1ccc(C[N@H+]2CCC[C@H]2[C@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000264583223 464382307 /nfs/dbraw/zinc/38/23/07/464382307.db2.gz DEXIEAZYSSQFGA-GWCFXTLKSA-N 1 1 334.294 2.491 20 5 EEBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)[N@@H+](C)C1CC1 ZINC000181466128 464494796 /nfs/dbraw/zinc/49/47/96/464494796.db2.gz HJSKQIQLSNOQIO-VIFPVBQESA-N 1 1 343.330 2.409 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000281927223 464637158 /nfs/dbraw/zinc/63/71/58/464637158.db2.gz DAEBKCBNOHHTTA-NWDGAFQWSA-N 1 1 327.812 2.135 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCSC[C@@H](C)C1 ZINC000190475174 464654376 /nfs/dbraw/zinc/65/43/76/464654376.db2.gz LMLLVXVHEHSWSU-NSHDSACASA-N 1 1 339.417 2.227 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCSC[C@@H](C)C1 ZINC000190475174 464654383 /nfs/dbraw/zinc/65/43/83/464654383.db2.gz LMLLVXVHEHSWSU-NSHDSACASA-N 1 1 339.417 2.227 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)[C@@H]2C1 ZINC000272570045 464662821 /nfs/dbraw/zinc/66/28/21/464662821.db2.gz FQXWBRYQDUVPQP-MEDUHNTESA-N 1 1 328.372 2.242 20 5 EEBDMO C[C@@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1CC(C)(C)O ZINC000295021353 464680754 /nfs/dbraw/zinc/68/07/54/464680754.db2.gz MEGDXGFMMHZRDN-CYBMUJFWSA-N 1 1 344.415 2.424 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000265934590 464739465 /nfs/dbraw/zinc/73/94/65/464739465.db2.gz FQFUPVAQKJTCPF-CJNGLKHVSA-N 1 1 344.415 2.348 20 5 EEBDMO C[C@@H]1C[NH+](C[C@@H]2CCCN2c2ncc([N+](=O)[O-])cc2F)C[C@@H](C)O1 ZINC000591157130 468418121 /nfs/dbraw/zinc/41/81/21/468418121.db2.gz QWSWBAFXMLPRCZ-UPJWGTAASA-N 1 1 338.383 2.207 20 5 EEBDMO CC(C)N1C(=O)N[C@@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000285997900 464768731 /nfs/dbraw/zinc/76/87/31/464768731.db2.gz POYYAGSTQJYQQU-CVEARBPZSA-N 1 1 332.404 2.014 20 5 EEBDMO CN(C(=O)COc1cccc([N+](=O)[O-])c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286147076 464819450 /nfs/dbraw/zinc/81/94/50/464819450.db2.gz IIBBYQXLGXQXPB-NNQSOWQGSA-N 1 1 333.388 2.057 20 5 EEBDMO CC[N@H+]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000286174620 464828427 /nfs/dbraw/zinc/82/84/27/464828427.db2.gz ABZCYQFCGGTKQL-ZDUSSCGKSA-N 1 1 334.420 2.263 20 5 EEBDMO C[C@H](CNc1nccc2cc([N+](=O)[O-])ccc21)[NH+]1CCN(C)CC1 ZINC000295446784 464839381 /nfs/dbraw/zinc/83/93/81/464839381.db2.gz GWILHALECPJQDH-CYBMUJFWSA-N 1 1 329.404 2.191 20 5 EEBDMO COc1ccccc1O[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC000286486813 464935485 /nfs/dbraw/zinc/93/54/85/464935485.db2.gz OSVQWABJMPUVRC-AWEZNQCLSA-N 1 1 346.387 2.343 20 5 EEBDMO COCCOC[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000177160985 464946012 /nfs/dbraw/zinc/94/60/12/464946012.db2.gz GAGGLZGONRGKSJ-LBPRGKRZSA-N 1 1 335.360 2.221 20 5 EEBDMO CN1CCN(CCC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192618953 464959081 /nfs/dbraw/zinc/95/90/81/464959081.db2.gz PIIDOKAEOFYFOA-SFHVURJKSA-N 1 1 332.448 2.199 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[NH2+]Cc2c(F)cccc2Br)c1 ZINC000192629918 464962877 /nfs/dbraw/zinc/96/28/77/464962877.db2.gz NUOCWVZJZKHMSG-UHFFFAOYSA-N 1 1 343.156 2.483 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000177332589 464989443 /nfs/dbraw/zinc/98/94/43/464989443.db2.gz AUHYJWAMUNENLW-KGLIPLIRSA-N 1 1 332.404 2.092 20 5 EEBDMO C[C@H]1CN(c2nc3ccccc3cc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000276624848 465005631 /nfs/dbraw/zinc/00/56/31/465005631.db2.gz NHHRYSNIQSVKNJ-ZDUSSCGKSA-N 1 1 344.415 2.424 20 5 EEBDMO C[N@@H+]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000356724012 465508113 /nfs/dbraw/zinc/50/81/13/465508113.db2.gz FZECSVGYRRZOBZ-IRXDYDNUSA-N 1 1 341.367 2.128 20 5 EEBDMO C[N@H+]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000356724012 465508120 /nfs/dbraw/zinc/50/81/20/465508120.db2.gz FZECSVGYRRZOBZ-IRXDYDNUSA-N 1 1 341.367 2.128 20 5 EEBDMO Cn1nccc1[C@H]1OCC[C@H]1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000343579306 465530957 /nfs/dbraw/zinc/53/09/57/465530957.db2.gz KFZNTNJAJMZVSB-KSSFIOAISA-N 1 1 342.399 2.464 20 5 EEBDMO COc1ccc(CNC(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000298912387 465540164 /nfs/dbraw/zinc/54/01/64/465540164.db2.gz DSQMMNSQQJRKEB-ZIAGYGMSSA-N 1 1 348.403 2.029 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1ccnn1C ZINC000348411879 465590969 /nfs/dbraw/zinc/59/09/69/465590969.db2.gz UHWMIRLNCVRFLN-UHFFFAOYSA-N 1 1 331.376 2.097 20 5 EEBDMO COc1ccc(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000299106610 465605312 /nfs/dbraw/zinc/60/53/12/465605312.db2.gz WCILHPNGHZGDGN-OLZOCXBDSA-N 1 1 335.404 2.454 20 5 EEBDMO C[C@@H](Cc1[nH]cc[nH+]1)OCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000360950223 465657807 /nfs/dbraw/zinc/65/78/07/465657807.db2.gz ZUPOLKWHRAZRBT-NSHDSACASA-N 1 1 346.343 2.264 20 5 EEBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccnn3CC3CC3)nc2c1 ZINC000597115006 468448205 /nfs/dbraw/zinc/44/82/05/468448205.db2.gz GSLHNEHFXSVUON-UHFFFAOYSA-N 1 1 326.360 2.367 20 5 EEBDMO COC(=O)COc1ccc(C[NH2+][C@@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000353183363 465700331 /nfs/dbraw/zinc/70/03/31/465700331.db2.gz QAEOBOUABVOAJX-LBPRGKRZSA-N 1 1 345.355 2.392 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-] ZINC000344617627 465726038 /nfs/dbraw/zinc/72/60/38/465726038.db2.gz OFPYUDRABSTBJH-NSHDSACASA-N 1 1 337.424 2.292 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000330919150 465860560 /nfs/dbraw/zinc/86/05/60/465860560.db2.gz YCRXKKKRJIVVQG-ZYHUDNBSSA-N 1 1 325.796 2.390 20 5 EEBDMO CC[N@H+]1CCC[C@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000301073251 465895849 /nfs/dbraw/zinc/89/58/49/465895849.db2.gz FXSQJWDEHFYGNV-GFCCVEGCSA-N 1 1 341.433 2.142 20 5 EEBDMO O=C(C[N@H+]1CCCCC[C@@H]1CO)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000594017030 468460690 /nfs/dbraw/zinc/46/06/90/468460690.db2.gz PECDHDQDIXHCMK-GFCCVEGCSA-N 1 1 341.795 2.424 20 5 EEBDMO O=C(C[N@@H+]1CCCCC[C@@H]1CO)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000594017030 468460695 /nfs/dbraw/zinc/46/06/95/468460695.db2.gz PECDHDQDIXHCMK-GFCCVEGCSA-N 1 1 341.795 2.424 20 5 EEBDMO C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000371709127 465954677 /nfs/dbraw/zinc/95/46/77/465954677.db2.gz NDCKLNVDPORDIF-MWQQHZPXSA-N 1 1 331.416 2.163 20 5 EEBDMO C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000371709127 465954683 /nfs/dbraw/zinc/95/46/83/465954683.db2.gz NDCKLNVDPORDIF-MWQQHZPXSA-N 1 1 331.416 2.163 20 5 EEBDMO C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000371709127 465954689 /nfs/dbraw/zinc/95/46/89/465954689.db2.gz NDCKLNVDPORDIF-MWQQHZPXSA-N 1 1 331.416 2.163 20 5 EEBDMO C[C@@H](C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C[C@H](C)O ZINC000353530335 465956504 /nfs/dbraw/zinc/95/65/04/465956504.db2.gz SCSBFLOMNXKRBL-WWGRRREGSA-N 1 1 332.404 2.414 20 5 EEBDMO NC(=O)c1ccc(C[N@@H+]2CCC[C@H](OC3CCC3)C2)c([N+](=O)[O-])c1 ZINC000594026773 468466471 /nfs/dbraw/zinc/46/64/71/468466471.db2.gz PAOJHHKRGBWYIF-HNNXBMFYSA-N 1 1 333.388 2.227 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H](OC3CCC3)C2)c([N+](=O)[O-])c1 ZINC000594026773 468466475 /nfs/dbraw/zinc/46/64/75/468466475.db2.gz PAOJHHKRGBWYIF-HNNXBMFYSA-N 1 1 333.388 2.227 20 5 EEBDMO C[C@H](CO)[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CC1CCC1 ZINC000361496182 466046164 /nfs/dbraw/zinc/04/61/64/466046164.db2.gz JPYUMPBYKREKJX-CYBMUJFWSA-N 1 1 335.404 2.041 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC000301941555 466065945 /nfs/dbraw/zinc/06/59/45/466065945.db2.gz UXHUFIVXALTBTC-BETUJISGSA-N 1 1 332.408 2.417 20 5 EEBDMO C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000362843915 466066817 /nfs/dbraw/zinc/06/68/17/466066817.db2.gz SJPIIVWFBNCZCG-DJSGYFEHSA-N 1 1 335.429 2.367 20 5 EEBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)[C@@H](C(N)=O)c1ccc(F)cc1 ZINC000338370685 466067810 /nfs/dbraw/zinc/06/78/10/466067810.db2.gz BJLVLKXMHHAXTJ-MRXNPFEDSA-N 1 1 331.347 2.435 20 5 EEBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@@H](C(N)=O)c1ccc(F)cc1 ZINC000338370685 466067816 /nfs/dbraw/zinc/06/78/16/466067816.db2.gz BJLVLKXMHHAXTJ-MRXNPFEDSA-N 1 1 331.347 2.435 20 5 EEBDMO Cc1cc(N2CC[N@H+](C[C@H](C)O)[C@H](C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000302019735 466079837 /nfs/dbraw/zinc/07/98/37/466079837.db2.gz NGZXOBHGDCLBHT-KGLIPLIRSA-N 1 1 344.415 2.343 20 5 EEBDMO NC(=O)[C@H]1CCC[N@@H+](CCCNc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000302788349 466185477 /nfs/dbraw/zinc/18/54/77/466185477.db2.gz XINLNNQRUMIFPP-NSHDSACASA-N 1 1 340.811 2.248 20 5 EEBDMO Cc1ccc([C@@H]2CCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000363049629 466195128 /nfs/dbraw/zinc/19/51/28/466195128.db2.gz OCWZDUDPFRXXPW-SJORKVTESA-N 1 1 330.388 2.298 20 5 EEBDMO Cc1[nH]nc(C(=O)N2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1[N+](=O)[O-] ZINC000331711971 466211303 /nfs/dbraw/zinc/21/13/03/466211303.db2.gz FYUPRYREAOMNQU-AWEZNQCLSA-N 1 1 349.435 2.210 20 5 EEBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000367272584 466230812 /nfs/dbraw/zinc/23/08/12/466230812.db2.gz VJVMTXNSWISQFC-HZPDHXFCSA-N 1 1 346.431 2.406 20 5 EEBDMO CC[C@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000304287224 466275999 /nfs/dbraw/zinc/27/59/99/466275999.db2.gz BCFFCHQPGMGCGK-HOTGVXAUSA-N 1 1 335.404 2.467 20 5 EEBDMO CC[C@H](O)[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000304287224 466276006 /nfs/dbraw/zinc/27/60/06/466276006.db2.gz BCFFCHQPGMGCGK-HOTGVXAUSA-N 1 1 335.404 2.467 20 5 EEBDMO C[N@@H+](C[C@@H]1CCCC[C@H]1O)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000305786446 466464170 /nfs/dbraw/zinc/46/41/70/466464170.db2.gz BCTLVVMEWNKJCU-RRQGHBQHSA-N 1 1 347.415 2.183 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000332356051 466525237 /nfs/dbraw/zinc/52/52/37/466525237.db2.gz ZMTMEKAXXAHROH-HIFRSBDPSA-N 1 1 346.431 2.408 20 5 EEBDMO Cc1c(C(=O)N2CC[NH2+]C[C@@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000423967835 466931572 /nfs/dbraw/zinc/93/15/72/466931572.db2.gz JOSPEGRKPXXWJV-MRXNPFEDSA-N 1 1 326.356 2.085 20 5 EEBDMO C[N@@H+]1CCN(c2ncc([N+](=O)[O-])cc2F)C[C@@H]1Cc1ccccc1 ZINC000413303119 467211644 /nfs/dbraw/zinc/21/16/44/467211644.db2.gz XVBJSGMTVOVRMF-HNNXBMFYSA-N 1 1 330.363 2.492 20 5 EEBDMO C[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2F)C[C@@H]1Cc1ccccc1 ZINC000413303119 467211646 /nfs/dbraw/zinc/21/16/46/467211646.db2.gz XVBJSGMTVOVRMF-HNNXBMFYSA-N 1 1 330.363 2.492 20 5 EEBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCC[N@H+]1CCCC1(C)C ZINC000452093107 467319834 /nfs/dbraw/zinc/31/98/34/467319834.db2.gz VRUINOFGRQVAEG-UHFFFAOYSA-N 1 1 341.433 2.056 20 5 EEBDMO COC(=O)c1cnc(NC[C@@H]2CCCC[N@H+]2C2CC2)c([N+](=O)[O-])c1 ZINC000433808499 467354213 /nfs/dbraw/zinc/35/42/13/467354213.db2.gz CWACYXXIEOIWOV-ZDUSSCGKSA-N 1 1 334.376 2.205 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](C)C[C@@H]1CN ZINC000420325885 467357676 /nfs/dbraw/zinc/35/76/76/467357676.db2.gz BZWGGTDHPJEKDO-IUODEOHRSA-N 1 1 334.420 2.291 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](C)C[C@@H]1CN ZINC000420325885 467357679 /nfs/dbraw/zinc/35/76/79/467357679.db2.gz BZWGGTDHPJEKDO-IUODEOHRSA-N 1 1 334.420 2.291 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420332475 467362085 /nfs/dbraw/zinc/36/20/85/467362085.db2.gz CZUDLHPXJSXLDR-LSDHHAIUSA-N 1 1 346.431 2.163 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CN1CCC([C@@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420383977 467388382 /nfs/dbraw/zinc/38/83/82/467388382.db2.gz QZLMPTPTOCAHTA-AEFFLSMTSA-N 1 1 349.431 2.322 20 5 EEBDMO CC[N@@H+]1C[C@H](C)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000450315466 467824368 /nfs/dbraw/zinc/82/43/68/467824368.db2.gz DMNYXQDXRCCZDA-KGLIPLIRSA-N 1 1 347.415 2.499 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000450315466 467824374 /nfs/dbraw/zinc/82/43/74/467824374.db2.gz DMNYXQDXRCCZDA-KGLIPLIRSA-N 1 1 347.415 2.499 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](CC2CC(F)(F)C2)CC1 ZINC000450573293 467872516 /nfs/dbraw/zinc/87/25/16/467872516.db2.gz WYCYUKGSCMYOCK-UHFFFAOYSA-N 1 1 339.342 2.398 20 5 EEBDMO C[C@H]1C[N@@H+](C)C[C@H]1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000487519588 468042977 /nfs/dbraw/zinc/04/29/77/468042977.db2.gz RULKJQSNUPYOMX-TVQRCGJNSA-N 1 1 345.321 2.428 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1 ZINC000531959507 468087013 /nfs/dbraw/zinc/08/70/13/468087013.db2.gz LCUQYVNHHFWHPM-LSDHHAIUSA-N 1 1 348.447 2.141 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1CN1CCC([N@H+]2CCOC[C@H]2C)CC1 ZINC000518394777 468114368 /nfs/dbraw/zinc/11/43/68/468114368.db2.gz YUSZITYAUBCLRF-CQSZACIVSA-N 1 1 349.431 2.289 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1[C@@H]2CC[C@H]1CC(=O)C2 ZINC000589260833 468137994 /nfs/dbraw/zinc/13/79/94/468137994.db2.gz OUVSAIVWYBXJDU-TXEJJXNPSA-N 1 1 345.355 2.089 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)CC(C)(C)OC ZINC000533020084 468162707 /nfs/dbraw/zinc/16/27/07/468162707.db2.gz CAMCQIBZLGTGDI-NSHDSACASA-N 1 1 339.392 2.287 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](c2nccn2C)C1 ZINC000533865454 468226712 /nfs/dbraw/zinc/22/67/12/468226712.db2.gz NSUJCNMBQLOQIS-STQMWFEESA-N 1 1 343.387 2.145 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](c2nccn2C)C1 ZINC000533865454 468226715 /nfs/dbraw/zinc/22/67/15/468226715.db2.gz NSUJCNMBQLOQIS-STQMWFEESA-N 1 1 343.387 2.145 20 5 EEBDMO COc1cc(C(=O)NC[C@H]2CCCC[N@@H+](C)C2)c([N+](=O)[O-])cc1F ZINC000600312326 468529470 /nfs/dbraw/zinc/52/94/70/468529470.db2.gz FEEPDNUSRAHKJF-LLVKDONJSA-N 1 1 339.367 2.204 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-] ZINC000594418816 468579581 /nfs/dbraw/zinc/57/95/81/468579581.db2.gz LVYALHIIRHEHER-NEPJUHHUSA-N 1 1 335.408 2.188 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCNC[C@@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000600716213 468630953 /nfs/dbraw/zinc/63/09/53/468630953.db2.gz XIOOEOPNVIWANC-MRXNPFEDSA-N 1 1 334.420 2.162 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCNC[C@@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000600716213 468630957 /nfs/dbraw/zinc/63/09/57/468630957.db2.gz XIOOEOPNVIWANC-MRXNPFEDSA-N 1 1 334.420 2.162 20 5 EEBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)CCOc1ccccc1[N+](=O)[O-])C2 ZINC000597713683 468648069 /nfs/dbraw/zinc/64/80/69/468648069.db2.gz FOTBYFRKQMBKSC-GOSISDBHSA-N 1 1 347.415 2.308 20 5 EEBDMO O=C(CN1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000592493550 468710323 /nfs/dbraw/zinc/71/03/23/468710323.db2.gz VFJVPSVDXPHQQX-CABCVRRESA-N 1 1 346.431 2.245 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000597925005 468712706 /nfs/dbraw/zinc/71/27/06/468712706.db2.gz MDKVGEGPXWPMKB-CYBMUJFWSA-N 1 1 335.404 2.353 20 5 EEBDMO O=C(NCC1CC1)[C@@H]1CCC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595289536 468801216 /nfs/dbraw/zinc/80/12/16/468801216.db2.gz DWIZPRGCIIUZRS-CQSZACIVSA-N 1 1 335.379 2.472 20 5 EEBDMO Cc1cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc(C)n1 ZINC000595374538 468830291 /nfs/dbraw/zinc/83/02/91/468830291.db2.gz FHKGCISNVLVYDK-CYBMUJFWSA-N 1 1 328.376 2.083 20 5 EEBDMO Cc1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc(C)n1 ZINC000595374538 468830295 /nfs/dbraw/zinc/83/02/95/468830295.db2.gz FHKGCISNVLVYDK-CYBMUJFWSA-N 1 1 328.376 2.083 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000593187949 468898564 /nfs/dbraw/zinc/89/85/64/468898564.db2.gz WKIQPOPTRRMZFG-MGPQQGTHSA-N 1 1 335.404 2.303 20 5 EEBDMO 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CC[C@@H](C)[C@H](C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)OC ZINC000602674918 469005008 /nfs/dbraw/zinc/00/50/08/469005008.db2.gz FYIOPDLILHTEFB-PBHICJAKSA-N 1 1 349.431 2.414 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCN(Cc2cccc(F)c2)CC1 ZINC000602785868 469072515 /nfs/dbraw/zinc/07/25/15/469072515.db2.gz LDBJQJPTILEVLR-UHFFFAOYSA-N 1 1 347.394 2.057 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000602834141 469106596 /nfs/dbraw/zinc/10/65/96/469106596.db2.gz QXWINWXJGRBZNI-INIZCTEOSA-N 1 1 341.415 2.237 20 5 EEBDMO Cn1cc(C[N@@H+](CCCO)C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000611271623 469215598 /nfs/dbraw/zinc/21/55/98/469215598.db2.gz VPVXSLFAWRQDHR-UHFFFAOYSA-N 1 1 330.388 2.342 20 5 EEBDMO C[C@@H]1C[N@H+](CCNc2ccc3cc([N+](=O)[O-])ccc3n2)[C@@H](C)CO1 ZINC000596427948 469262182 /nfs/dbraw/zinc/26/21/82/469262182.db2.gz GEMQJNTYXDQWLX-QWHCGFSZSA-N 1 1 330.388 2.664 20 5 EEBDMO C[C@@H]1C[N@@H+](CCNc2ccc3cc([N+](=O)[O-])ccc3n2)[C@@H](C)CO1 ZINC000596427948 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337.395 2.421 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H](CCO)C3)n2)c1 ZINC000609204598 469902023 /nfs/dbraw/zinc/90/20/23/469902023.db2.gz YMFFCMFAWBUGAD-GFCCVEGCSA-N 1 1 332.360 2.239 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H](CCO)C3)n2)c1 ZINC000609204598 469902028 /nfs/dbraw/zinc/90/20/28/469902028.db2.gz YMFFCMFAWBUGAD-GFCCVEGCSA-N 1 1 332.360 2.239 20 5 EEBDMO C[C@](CO)([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000609483853 469931190 /nfs/dbraw/zinc/93/11/90/469931190.db2.gz LNHITYKIYDCWNJ-GOSISDBHSA-N 1 1 344.367 2.459 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](CCO)C2)cccc1[N+](=O)[O-] ZINC000610213605 469988463 /nfs/dbraw/zinc/98/84/63/469988463.db2.gz ITXZBUPWTQBDRL-KGLIPLIRSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](CCO)C2)cccc1[N+](=O)[O-] ZINC000610213605 469988465 /nfs/dbraw/zinc/98/84/65/469988465.db2.gz ITXZBUPWTQBDRL-KGLIPLIRSA-N 1 1 335.404 2.325 20 5 EEBDMO COc1cc(C[N@@H+]2CCC[C@H](C3OCCO3)C2)c([N+](=O)[O-])cc1F ZINC000184198185 533807610 /nfs/dbraw/zinc/80/76/10/533807610.db2.gz BHLIDPXZVYSHJM-NSHDSACASA-N 1 1 340.351 2.327 20 5 EEBDMO COc1cc(C[N@H+]2CCC[C@H](C3OCCO3)C2)c([N+](=O)[O-])cc1F ZINC000184198185 533807613 /nfs/dbraw/zinc/80/76/13/533807613.db2.gz BHLIDPXZVYSHJM-NSHDSACASA-N 1 1 340.351 2.327 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)n1 ZINC000178167853 534328578 /nfs/dbraw/zinc/32/85/78/534328578.db2.gz SLKFSIKMDWUFAV-MRXNPFEDSA-N 1 1 342.399 2.129 20 5 EEBDMO CC(C)[C@@H]1CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000451166560 535255989 /nfs/dbraw/zinc/25/59/89/535255989.db2.gz XMCHBFFAAYFTQO-INIZCTEOSA-N 1 1 347.415 2.356 20 5 EEBDMO CC(C)[C@@H]1CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000451166560 535255992 /nfs/dbraw/zinc/25/59/92/535255992.db2.gz XMCHBFFAAYFTQO-INIZCTEOSA-N 1 1 347.415 2.356 20 5 EEBDMO CC[C@H]1[C@@H](C)CC[N@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O 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COC(=O)CC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C(C)C ZINC000742148697 578127972 /nfs/dbraw/zinc/12/79/72/578127972.db2.gz BSINZPQRDLDCMQ-UHFFFAOYSA-N 1 1 347.375 2.084 20 5 EEBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccc(-c3nn[nH]n3)c2)c(F)c1 ZINC000826498451 609338011 /nfs/dbraw/zinc/33/80/11/609338011.db2.gz VIWUBHVEKDIGAV-UHFFFAOYSA-N 1 1 328.307 2.204 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](N(C)c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C1 ZINC000894131179 681623975 /nfs/dbraw/zinc/62/39/75/681623975.db2.gz OWNVZWDRXUEZIG-ZDUSSCGKSA-N 1 1 344.415 2.366 20 5 EEBDMO C[C@H](CNC(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000892820662 683102183 /nfs/dbraw/zinc/10/21/83/683102183.db2.gz REHLMJQLHZDMCU-CHWSQXEVSA-N 1 1 334.420 2.480 20 5 EEBDMO CC[N@@H+]1CCN(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)[C@H](C)C1 ZINC000897734194 691773751 /nfs/dbraw/zinc/77/37/51/691773751.db2.gz IASUIVMDYJFKCR-GFCCVEGCSA-N 1 1 342.399 2.496 20 5 EEBDMO CC[N@H+]1CCN(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)[C@H](C)C1 ZINC000897734194 691773753 /nfs/dbraw/zinc/77/37/53/691773753.db2.gz IASUIVMDYJFKCR-GFCCVEGCSA-N 1 1 342.399 2.496 20 5 EEBDMO O=C(NCC[NH2+]C1c2ccccc2-c2ccccc21)[C@@H]1CC1[N+](=O)[O-] ZINC001126936484 1189063451 /nfs/dbraw/zinc/06/34/51/1189063451.db2.gz KPNQABZLSFNMSF-IAGOWNOFSA-N 1 1 337.379 2.127 20 5 EEBDMO Cc1cc(F)ccc1C[NH+]1CCC(N(C)C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001005381488 1195313820 /nfs/dbraw/zinc/31/38/20/1195313820.db2.gz LNAUDNGQNSUNNW-IAGOWNOFSA-N 1 1 349.406 2.222 20 5 EEBDMO CCOC(=O)Cc1ccc(N2CC[N@@H+](CC)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000825873210 1199611622 /nfs/dbraw/zinc/61/16/22/1199611622.db2.gz SLINKRAJDTYLJM-CYBMUJFWSA-N 1 1 335.404 2.231 20 5 EEBDMO C[C@@H]1CC(F)(F)CCN1C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000877044615 1199853378 /nfs/dbraw/zinc/85/33/78/1199853378.db2.gz YQUVOHLDJGDONL-YGRLFVJLSA-N 1 1 327.331 2.415 20 5 EEBDMO Cn1ccc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000813170435 1201140803 /nfs/dbraw/zinc/14/08/03/1201140803.db2.gz FKZSPVFJZFMQIH-INIZCTEOSA-N 1 1 329.356 2.365 20 5 EEBDMO Cn1ccc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000813170435 1201140804 /nfs/dbraw/zinc/14/08/04/1201140804.db2.gz FKZSPVFJZFMQIH-INIZCTEOSA-N 1 1 329.356 2.365 20 5 EEBDMO CC(=O)c1ccc(N2CCC([NH+]3CCN(C)CC3)CC2)c([N+](=O)[O-])c1 ZINC000866212727 1201466749 /nfs/dbraw/zinc/46/67/49/1201466749.db2.gz NQCKHFMWAVCYOD-UHFFFAOYSA-N 1 1 346.431 2.014 20 5 EEBDMO COc1ccc(C[N@@H+](CCO)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000880572417 1201526732 /nfs/dbraw/zinc/52/67/32/1201526732.db2.gz QZFIFDAZGLDFAM-GOSISDBHSA-N 1 1 346.383 2.131 20 5 EEBDMO C[C@@]([NH3+])(C(=O)N1CCc2cc(F)ccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000867977422 1201718320 /nfs/dbraw/zinc/71/83/20/1201718320.db2.gz GYNJPWBFSXAENU-SFHVURJKSA-N 1 1 343.358 2.493 20 5 EEBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCC(C)(C)C1 ZINC000890082381 1204780439 /nfs/dbraw/zinc/78/04/39/1204780439.db2.gz VCBUKEFPTFLKBM-UHFFFAOYSA-N 1 1 334.420 2.123 20 5 EEBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCn2cc[nH+]c21 ZINC000931523762 1207405272 /nfs/dbraw/zinc/40/52/72/1207405272.db2.gz JJRZRECCCCNHFH-VIFPVBQESA-N 1 1 335.751 2.292 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C1 ZINC000778249778 1207977011 /nfs/dbraw/zinc/97/70/11/1207977011.db2.gz CHTORUHYDFPKPC-SNVBAGLBSA-N 1 1 349.416 2.060 20 5 EEBDMO CCN(CCCNC(=O)CC[N@@H+](C)CC)c1ccc([N+](=O)[O-])cc1 ZINC001095911774 1213914602 /nfs/dbraw/zinc/91/46/02/1213914602.db2.gz QDDIPQOFYGEDFS-UHFFFAOYSA-N 1 1 336.436 2.269 20 5 EEBDMO Cc1cc(C[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1 ZINC001045437150 1233744722 /nfs/dbraw/zinc/74/47/22/1233744722.db2.gz GCILUOVTFWBCAD-ZIAGYGMSSA-N 1 1 337.445 2.192 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H](F)C2)c([N+](=O)[O-])c1 ZINC000902995770 1239292176 /nfs/dbraw/zinc/29/21/76/1239292176.db2.gz FGFGRODIQVLXGJ-LLVKDONJSA-N 1 1 325.340 2.366 20 5 EEBDMO O=C(NCC1CC[NH+](C/C=C/c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001001396887 1242191719 /nfs/dbraw/zinc/19/17/19/1242191719.db2.gz UEVSITWNBKIXKV-DSCOKBBTSA-N 1 1 343.427 2.193 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[NH+](CC1=CCCCC1)CC2 ZINC001050517503 1243768946 /nfs/dbraw/zinc/76/89/46/1243768946.db2.gz VJMAVPZOQJSEGU-HZPDHXFCSA-N 1 1 333.432 2.076 20 5 EEBDMO C[N@@H+](CC(=O)N1CCC(Nc2ccccc2[N+](=O)[O-])CC1)C1CCC1 ZINC001057446233 1243801022 /nfs/dbraw/zinc/80/10/22/1243801022.db2.gz FXXKGHBKZOEWJR-UHFFFAOYSA-N 1 1 346.431 2.482 20 5 EEBDMO COCC(C)(C)C(=O)N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001196516234 1284105266 /nfs/dbraw/zinc/10/52/66/1284105266.db2.gz VKLRTTACRFXVQD-UHFFFAOYSA-N 1 1 349.431 2.302 20 5 EEBDMO COCC(C)(C)C(=O)N1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001196516234 1284105275 /nfs/dbraw/zinc/10/52/75/1284105275.db2.gz VKLRTTACRFXVQD-UHFFFAOYSA-N 1 1 349.431 2.302 20 5 EEBDMO [NH3+][C@@H](Cc1c[nH]cn1)C(=O)Nc1cc2cccnc2c2ncccc12 ZINC001218979034 1297889800 /nfs/dbraw/zinc/88/98/00/1297889800.db2.gz GZWAWKVOKAECPV-AWEZNQCLSA-N 1 1 332.367 2.015 20 5 EEBDMO Cc1noc(C)c1C(=O)NCCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001233812398 1304601194 /nfs/dbraw/zinc/60/11/94/1304601194.db2.gz LVWRVVBKJIOHLX-UHFFFAOYSA-N 1 1 346.387 2.452 20 5 EEBDMO Nc1cc(NCc2ccc(C[NH+]3CCOCC3)cc2)ncc1[N+](=O)[O-] ZINC001156391938 1317993399 /nfs/dbraw/zinc/99/33/99/1317993399.db2.gz DXEMBFCAFWZQJP-UHFFFAOYSA-N 1 1 343.387 2.016 20 5 EEBDMO CC(C)Oc1ccnc(C[NH2+][C@H]2Cc3ccc([N+](=O)[O-])cc3C2)n1 ZINC001254598500 1318138916 /nfs/dbraw/zinc/13/89/16/1318138916.db2.gz KGQJFXHLGWTBRP-AWEZNQCLSA-N 1 1 328.372 2.429 20 5 EEBDMO Cc1nccnc1O[C@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254612046 1318145227 /nfs/dbraw/zinc/14/52/27/1318145227.db2.gz URGCXCQMYJXVTM-SJORKVTESA-N 1 1 340.383 2.314 20 5 EEBDMO COc1cc(N2CCC([N@H+]3C[C@H](O)C[C@H]3C)CC2)ccc1[N+](=O)[O-] ZINC001256092889 1318645437 /nfs/dbraw/zinc/64/54/37/1318645437.db2.gz AKJAOPATTSTVDW-IUODEOHRSA-N 1 1 335.404 2.027 20 5 EEBDMO O=C(NCCC[NH2+]CCc1ccc2ccccc2c1)[C@@H]1CC1[N+](=O)[O-] ZINC001157775350 1318852984 /nfs/dbraw/zinc/85/29/84/1318852984.db2.gz PKKNRVFRFBIKDM-QZTJIDSGSA-N 1 1 341.411 2.143 20 5 EEBDMO Nc1cc(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001165084521 1321452051 /nfs/dbraw/zinc/45/20/51/1321452051.db2.gz LEOHZXRQSOUXPM-RHSMWYFYSA-N 1 1 339.399 2.283 20 5 EEBDMO COc1ccc2ncc([N+](=O)[O-])c(NCC[N@H+]3CCC[C@H]3C)c2c1 ZINC001306982509 1331505500 /nfs/dbraw/zinc/50/55/00/1331505500.db2.gz GHFJUFGKYHIREW-GFCCVEGCSA-N 1 1 330.388 2.470 20 5 EEBDMO CC[N@@H+](CC[N+](=O)[O-])C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC001307530542 1331539694 /nfs/dbraw/zinc/53/96/94/1331539694.db2.gz ZBMWXQAODCNCOE-UHFFFAOYSA-N 1 1 335.452 2.476 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001318890084 1332618952 /nfs/dbraw/zinc/61/89/52/1332618952.db2.gz PSHMFPISUXFBAZ-INIZCTEOSA-N 1 1 332.404 2.494 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)nc1-c1ccncc1 ZINC001319328678 1332685291 /nfs/dbraw/zinc/68/52/91/1332685291.db2.gz PJOCVTRKAYKLIJ-GOEBONIOSA-N 1 1 343.387 2.312 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)nc1-c1ccncc1 ZINC001319328678 1332685295 /nfs/dbraw/zinc/68/52/95/1332685295.db2.gz PJOCVTRKAYKLIJ-GOEBONIOSA-N 1 1 343.387 2.312 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCCn1cc[nH+]c1C ZINC001319995061 1332807394 /nfs/dbraw/zinc/80/73/94/1332807394.db2.gz HDOSNPTUCWPLQC-UHFFFAOYSA-N 1 1 331.376 2.304 20 5 EEBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[N@H+]1CCCC[C@H]1C ZINC001609165094 1351871950 /nfs/dbraw/zinc/87/19/50/1351871950.db2.gz DALREVFHDVRJBR-VXGBXAGGSA-N 1 1 345.407 2.450 20 5 EEBDMO COC(=O)CC(C)(C)[N@@H+](C)CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC001335183058 1336345809 /nfs/dbraw/zinc/34/58/09/1336345809.db2.gz QIWRBXHGVXRBOO-UHFFFAOYSA-N 1 1 340.376 2.256 20 5 EEBDMO CONC(=O)C1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC001336846141 1336604175 /nfs/dbraw/zinc/60/41/75/1336604175.db2.gz OJGSIODOKOTEIH-UHFFFAOYSA-N 1 1 327.768 2.138 20 5 EEBDMO C[C@@]([NH3+])(C(=O)Nc1nc(C2(C)CC2)ns1)c1cccc([N+](=O)[O-])c1 ZINC001576553387 1344031219 /nfs/dbraw/zinc/03/12/19/1344031219.db2.gz LAFFHMMQEOKZJY-HNNXBMFYSA-N 1 1 347.400 2.310 20 5 EEBDMO CC[C@@H]1CCCC[N@H+]1CCNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] ZINC001590513155 1349361763 /nfs/dbraw/zinc/36/17/63/1349361763.db2.gz ONKAZCFDVSLKFM-CYBMUJFWSA-N 1 1 345.407 2.451 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](Nc2cc(-c3nn[nH]n3)ccc2[N+](=O)[O-])C1 ZINC001603077601 1350634189 /nfs/dbraw/zinc/63/41/89/1350634189.db2.gz FPJYMLGBLIHVMF-NSHDSACASA-N 1 1 331.380 2.060 20 5 EEBDMO COC[C@H]1CCC[N@@H+](Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CC1 ZINC001605073283 1351073158 /nfs/dbraw/zinc/07/31/58/1351073158.db2.gz XKPMDXABNPGQAC-LBPRGKRZSA-N 1 1 346.391 2.023 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000823921053 1368096237 /nfs/dbraw/zinc/09/62/37/1368096237.db2.gz MUYLEVAJYUTWNM-NSHDSACASA-N 1 1 335.408 2.419 20 5 EEBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H](CO)Cc1ccccc1 ZINC000852288160 1369258904 /nfs/dbraw/zinc/25/89/04/1369258904.db2.gz SFZNHEJBBNOCKP-ROUUACIJSA-N 1 1 330.384 2.164 20 5 EEBDMO CC(C)(C[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1)C(N)=O ZINC000830562883 1372336199 /nfs/dbraw/zinc/33/61/99/1372336199.db2.gz ATPZBUGDOBAOTR-CZUORRHYSA-N 1 1 349.431 2.242 20 5 EEBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839536236 1372908520 /nfs/dbraw/zinc/90/85/20/1372908520.db2.gz LRSALAOXGUTPQY-WDEREUQCSA-N 1 1 340.811 2.211 20 5 EEBDMO O=[N+]([O-])c1ccnc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164725217 720333150 /nfs/dbraw/zinc/33/31/50/720333150.db2.gz MRDCRFZJXFWONI-CVEARBPZSA-N 1 1 325.372 2.238 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N(C)CCCNc1ccc(F)cc1[N+](=O)[O-] ZINC001109520282 805596323 /nfs/dbraw/zinc/59/63/23/805596323.db2.gz CIVWWTIPTNILFB-UHFFFAOYSA-N 1 1 340.399 2.336 20 5 EEBDMO CN(c1c2ccccc2n(C)c(=O)c1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000892471837 761377067 /nfs/dbraw/zinc/37/70/67/761377067.db2.gz QXOCCUATSLSVBG-ZDUSSCGKSA-N 1 1 342.399 2.120 20 5 EEBDMO O=C(NCC1C[NH+](Cc2ccc(C3CCC3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001031662913 770736471 /nfs/dbraw/zinc/73/64/71/770736471.db2.gz ORXGQZUQTAPYCJ-QZTJIDSGSA-N 1 1 343.427 2.167 20 5 EEBDMO O=C(C1CCOCC1)N1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000980613420 774998112 /nfs/dbraw/zinc/99/81/12/774998112.db2.gz YNZDNFBPQYKSHE-UHFFFAOYSA-N 1 1 347.415 2.056 20 5 EEBDMO O=C(C1CCOCC1)N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000980613420 774998115 /nfs/dbraw/zinc/99/81/15/774998115.db2.gz YNZDNFBPQYKSHE-UHFFFAOYSA-N 1 1 347.415 2.056 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001091477845 790954627 /nfs/dbraw/zinc/95/46/27/790954627.db2.gz HVIZHSDXKGLEOK-CTYIDZIISA-N 1 1 334.420 2.243 20 5 EEBDMO C[C@H](OC(=O)C(C)(C)[NH+]1CCCC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000805614756 783913526 /nfs/dbraw/zinc/91/35/26/783913526.db2.gz LQWPIMUQXYUBBX-LBPRGKRZSA-N 1 1 349.387 2.339 20 5 EEBDMO COc1cccc(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)c1[N+](=O)[O-] ZINC000906453682 783924697 /nfs/dbraw/zinc/92/46/97/783924697.db2.gz KJYCURXTHKNTOS-CYBMUJFWSA-N 1 1 335.404 2.406 20 5 EEBDMO COc1cccc(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)c1[N+](=O)[O-] ZINC000906453682 783924703 /nfs/dbraw/zinc/92/47/03/783924703.db2.gz KJYCURXTHKNTOS-CYBMUJFWSA-N 1 1 335.404 2.406 20 5 EEBDMO C[N@@H+]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC12CCCCC2 ZINC000908572740 785538251 /nfs/dbraw/zinc/53/82/51/785538251.db2.gz HRUQIPHADYNJHA-UHFFFAOYSA-N 1 1 333.388 2.391 20 5 EEBDMO C[N@H+]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC12CCCCC2 ZINC000908572740 785538257 /nfs/dbraw/zinc/53/82/57/785538257.db2.gz HRUQIPHADYNJHA-UHFFFAOYSA-N 1 1 333.388 2.391 20 5 EEBDMO CCCN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000843993347 788772638 /nfs/dbraw/zinc/77/26/38/788772638.db2.gz 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COc1ccccc1C1([NH3+])CCN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168994589 803561089 /nfs/dbraw/zinc/56/10/89/803561089.db2.gz QEKYAHZLPWZAEN-LSDHHAIUSA-N 1 1 333.432 2.390 20 5 EEBDMO CC(C)(C)OC(=O)N1CC2(CC[N@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169012501 803571134 /nfs/dbraw/zinc/57/11/34/803571134.db2.gz QPKNABSYNRUDJP-QWHCGFSZSA-N 1 1 325.409 2.127 20 5 EEBDMO O=C(c1ccccc1)N1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169045568 803579134 /nfs/dbraw/zinc/57/91/34/803579134.db2.gz JLMWXFPRMRTXEI-WBVHZDCISA-N 1 1 331.416 2.280 20 5 EEBDMO O=C(Cc1ccccc1)N1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169047031 803592973 /nfs/dbraw/zinc/59/29/73/803592973.db2.gz QAELIGPWQJWEEH-ROUUACIJSA-N 1 1 345.443 2.209 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)N(C)CCCNc1ccc([N+](=O)[O-])cc1F ZINC001109463706 805504753 /nfs/dbraw/zinc/50/47/53/805504753.db2.gz UHGPRMUPBBDFPZ-UHFFFAOYSA-N 1 1 340.399 2.335 20 5 EEBDMO CC(C)[C@@H](C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])[NH+](C)C 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YSLGWUCHYQYXJQ-INIZCTEOSA-N 1 1 330.340 2.228 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCOc3cc(O)ccc3C2)cc1 ZINC000796467501 1218480726 /nfs/dbraw/zinc/48/07/26/1218480726.db2.gz YSLGWUCHYQYXJQ-INIZCTEOSA-N 1 1 330.340 2.228 20 5 EEBDMO Cc1cc(F)ccc1C[NH+]1CCC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001001399251 1242195566 /nfs/dbraw/zinc/19/55/66/1242195566.db2.gz LAPMIJJPGUUJFH-IAGOWNOFSA-N 1 1 349.406 2.128 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[NH+](CC1CC3(CCC3)C1)CC2 ZINC001050516967 1243769559 /nfs/dbraw/zinc/76/95/59/1243769559.db2.gz LGGQQHJPJDKUSZ-HZPDHXFCSA-N 1 1 347.459 2.156 20 5 EEBDMO Cc1ccc(N[C@H]2C[C@@H](NC(=O)C[N@H+](C)C(C)C)C2)c([N+](=O)[O-])c1 ZINC001097191450 1243805246 /nfs/dbraw/zinc/80/52/46/1243805246.db2.gz LJAACCJNLOIWPG-OKILXGFUSA-N 1 1 334.420 2.303 20 5 EEBDMO Cc1[nH+]ccn1CCCC(=O)N(C)CCNc1ccc([N+](=O)[O-])cc1 ZINC001101685243 1246121104 /nfs/dbraw/zinc/12/11/04/1246121104.db2.gz VHRZEQMZTGWJOE-UHFFFAOYSA-N 1 1 345.403 2.450 20 5 EEBDMO Cc1noc(C[N@@H+]2CCC[C@H](C(=O)Nc3ccccn3)C2)c1[N+](=O)[O-] ZINC000851825644 1291865541 /nfs/dbraw/zinc/86/55/41/1291865541.db2.gz NQDUPIKJYRTCHD-LBPRGKRZSA-N 1 1 345.359 2.137 20 5 EEBDMO Cc1noc(C[N@H+]2CCC[C@H](C(=O)Nc3ccccn3)C2)c1[N+](=O)[O-] ZINC000851825644 1291865547 /nfs/dbraw/zinc/86/55/47/1291865547.db2.gz NQDUPIKJYRTCHD-LBPRGKRZSA-N 1 1 345.359 2.137 20 5 EEBDMO C[C@H]1C[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@]1(C)CO ZINC000852701813 1292168954 /nfs/dbraw/zinc/16/89/54/1292168954.db2.gz UUNXCPMFXOWGCO-BONVTDFDSA-N 1 1 341.795 2.137 20 5 EEBDMO C[C@H]1C[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@]1(C)CO ZINC000852701813 1292168957 /nfs/dbraw/zinc/16/89/57/1292168957.db2.gz UUNXCPMFXOWGCO-BONVTDFDSA-N 1 1 341.795 2.137 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CCCC1CCCC1)C2 ZINC001072725155 1296057205 /nfs/dbraw/zinc/05/72/05/1296057205.db2.gz JNZWJZOYQLYOFZ-HZPDHXFCSA-N 1 1 335.448 2.156 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](CCCC1CCCC1)C2 ZINC001072725155 1296057213 /nfs/dbraw/zinc/05/72/13/1296057213.db2.gz JNZWJZOYQLYOFZ-HZPDHXFCSA-N 1 1 335.448 2.156 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CCCC1CCCC1)C2 ZINC001072725155 1296057227 /nfs/dbraw/zinc/05/72/27/1296057227.db2.gz JNZWJZOYQLYOFZ-HZPDHXFCSA-N 1 1 335.448 2.156 20 5 EEBDMO O=[N+]([O-])c1cc(F)ccc1CN1CC[NH+](CCc2ccncc2)CC1 ZINC000931340827 1297147966 /nfs/dbraw/zinc/14/79/66/1297147966.db2.gz PIADIJSAKUPKND-UHFFFAOYSA-N 1 1 344.390 2.489 20 5 EEBDMO CC(C)(C)CCC[NH+]1CCC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001223114162 1299982936 /nfs/dbraw/zinc/98/29/36/1299982936.db2.gz JMRLLVCNDRUCLC-HUUCEWRRSA-N 1 1 325.453 2.306 20 5 EEBDMO CN(CCNc1ccc(F)cc1[N+](=O)[O-])C(=O)C[N@@H+](C)C1CCC1 ZINC001102017429 1300147146 /nfs/dbraw/zinc/14/71/46/1300147146.db2.gz YOCPKGJMVJNBRN-UHFFFAOYSA-N 1 1 338.383 2.089 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N1C[C@H]2CC[C@@H](C1)N2c1ccccc1[N+](=O)[O-] ZINC001102199203 1300551105 /nfs/dbraw/zinc/55/11/05/1300551105.db2.gz YOHGLZVRXOQHHN-GASCZTMLSA-N 1 1 346.431 2.116 20 5 EEBDMO CC[NH+](CC)CC(=O)NC1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001229679248 1302914069 /nfs/dbraw/zinc/91/40/69/1302914069.db2.gz UVDPRGLEZLCXIQ-UHFFFAOYSA-N 1 1 348.447 2.017 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NC1(CNc2ncccc2[N+](=O)[O-])CCCC1 ZINC001103434451 1302956801 /nfs/dbraw/zinc/95/68/01/1302956801.db2.gz FSSFSLSWYLJXMY-UHFFFAOYSA-N 1 1 349.435 2.173 20 5 EEBDMO C[C@@H]1[C@H](CO)CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000839676218 1315230906 /nfs/dbraw/zinc/23/09/06/1315230906.db2.gz WJBDUEVJVMMCPO-NEPJUHHUSA-N 1 1 339.367 2.155 20 5 EEBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC000839693945 1315234815 /nfs/dbraw/zinc/23/48/15/1315234815.db2.gz HUHJHTUSLSQSFG-GVDBMIGSSA-N 1 1 331.416 2.022 20 5 EEBDMO CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC000839693945 1315234816 /nfs/dbraw/zinc/23/48/16/1315234816.db2.gz HUHJHTUSLSQSFG-GVDBMIGSSA-N 1 1 331.416 2.022 20 5 EEBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC000839693945 1315234818 /nfs/dbraw/zinc/23/48/18/1315234818.db2.gz HUHJHTUSLSQSFG-GVDBMIGSSA-N 1 1 331.416 2.022 20 5 EEBDMO Cc1nn(CN2CC[C@@]3(C2)CCC[N@H+](C)C3)c2ncc([N+](=O)[O-])cc12 ZINC000840085725 1315289927 /nfs/dbraw/zinc/28/99/27/1315289927.db2.gz GSVJZSLPHNQJGG-KRWDZBQOSA-N 1 1 344.419 2.023 20 5 EEBDMO CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCC([NH3+])CC1 ZINC000843355001 1315898225 /nfs/dbraw/zinc/89/82/25/1315898225.db2.gz IKOOIKWMHOQPIB-UHFFFAOYSA-N 1 1 331.376 2.347 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CCC([N@@H+]3Cc4cncnc4C3)CC2)cc1 ZINC001254476971 1318082641 /nfs/dbraw/zinc/08/26/41/1318082641.db2.gz YAOVWMAVYSTTIC-UHFFFAOYSA-N 1 1 325.372 2.369 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3Cc4cncnc4C3)CC2)cc1 ZINC001254476971 1318082654 /nfs/dbraw/zinc/08/26/54/1318082654.db2.gz YAOVWMAVYSTTIC-UHFFFAOYSA-N 1 1 325.372 2.369 20 5 EEBDMO COc1cc(N2CCC([NH2+]Cc3nnc(C)o3)CC2)ccc1[N+](=O)[O-] ZINC001256089216 1318645356 /nfs/dbraw/zinc/64/53/56/1318645356.db2.gz RWXQUODHCFFASE-UHFFFAOYSA-N 1 1 347.375 2.053 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CCC[C@H](O)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256093747 1318646223 /nfs/dbraw/zinc/64/62/23/1318646223.db2.gz PUGFPRBWJZXJRT-INIZCTEOSA-N 1 1 349.431 2.419 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CC[C@@H](O)C[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC001256100993 1318647623 /nfs/dbraw/zinc/64/76/23/1318647623.db2.gz XNKFBJSGVFNZLU-XJKSGUPXSA-N 1 1 349.431 2.417 20 5 EEBDMO O=[N+]([O-])c1cccc2nc(NCC3([NH+]4CCCC4)COC3)ccc21 ZINC001157655792 1318775174 /nfs/dbraw/zinc/77/51/74/1318775174.db2.gz RLWFVHMHYNTBMS-UHFFFAOYSA-N 1 1 328.372 2.420 20 5 EEBDMO N[C@@H]1CC[N@@H+](C2CCN(c3nccc4cc([N+](=O)[O-])ccc43)CC2)C1 ZINC001158267168 1319127334 /nfs/dbraw/zinc/12/73/34/1319127334.db2.gz PYAUSSWDQKPYJN-CQSZACIVSA-N 1 1 341.415 2.145 20 5 EEBDMO N[C@@H]1CC[N@H+](C2CCN(c3nccc4cc([N+](=O)[O-])ccc43)CC2)C1 ZINC001158267168 1319127336 /nfs/dbraw/zinc/12/73/36/1319127336.db2.gz PYAUSSWDQKPYJN-CQSZACIVSA-N 1 1 341.415 2.145 20 5 EEBDMO CCOC(=O)c1cnc(NCC[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1 ZINC001165260562 1321485478 /nfs/dbraw/zinc/48/54/78/1321485478.db2.gz IIVRQAHFIRNTGS-GFCCVEGCSA-N 1 1 336.392 2.310 20 5 EEBDMO CC(C)[C@]1(CO)CC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000351950724 1321971919 /nfs/dbraw/zinc/97/19/19/1321971919.db2.gz WUTRJUGBJLAWBA-SUMWQHHRSA-N 1 1 335.404 2.262 20 5 EEBDMO Cc1[nH+]ccn1CCNc1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-] ZINC001307196319 1331515921 /nfs/dbraw/zinc/51/59/21/1331515921.db2.gz QPDNBEUDAQOZCW-UHFFFAOYSA-N 1 1 342.315 2.090 20 5 EEBDMO Cn1cc([N+](=O)[O-])c(Nc2ccc(N3CC[N@H+]4CCC[C@H]4C3)cc2)n1 ZINC001307198962 1331516587 /nfs/dbraw/zinc/51/65/87/1331516587.db2.gz URDGPZFQCPXKSL-HNNXBMFYSA-N 1 1 342.403 2.356 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(c3ncnc4c(Cl)cc([N+](=O)[O-])cc43)C[C@H]2C1 ZINC001330666988 1334884586 /nfs/dbraw/zinc/88/45/86/1334884586.db2.gz UQXYGNYHQMPMNQ-AOOOYVTPSA-N 1 1 333.779 2.189 20 5 EEBDMO Cc1nc(N2CC[C@@H]([N@@H+](C)CCc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC001330692393 1334887718 /nfs/dbraw/zinc/88/77/18/1334887718.db2.gz MENMDWXIEIONMF-MRXNPFEDSA-N 1 1 341.415 2.446 20 5 EEBDMO Cn1c2ccccc2c(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1=O ZINC001333630854 1336091260 /nfs/dbraw/zinc/09/12/60/1336091260.db2.gz XEFFXTOEDMHQPL-CHWSQXEVSA-N 1 1 342.399 2.485 20 5 EEBDMO C[N@H+]1CCCC[C@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC001336747033 1336589388 /nfs/dbraw/zinc/58/93/88/1336589388.db2.gz ZNRURHZGBMLVPB-ZDUSSCGKSA-N 1 1 325.796 2.391 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCN1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848491635 1338709031 /nfs/dbraw/zinc/70/90/31/1338709031.db2.gz XKFBNAGYAGOCPQ-HNNXBMFYSA-N 1 1 329.404 2.442 20 5 EEBDMO CO[C@H]1CC[N@@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])CC1(C)C ZINC001591357906 1349471679 /nfs/dbraw/zinc/47/16/79/1349471679.db2.gz KWCKTELZWYRRPB-AWEZNQCLSA-N 1 1 346.391 2.022 20 5 EEBDMO CC[N@H+](Cc1ccncc1)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001604324771 1350915293 /nfs/dbraw/zinc/91/52/93/1350915293.db2.gz KIQVAXBUXLBZTB-UHFFFAOYSA-N 1 1 339.359 2.192 20 5 EEBDMO CC[N@@H+](Cc1ccncc1)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001604324771 1350915294 /nfs/dbraw/zinc/91/52/94/1350915294.db2.gz KIQVAXBUXLBZTB-UHFFFAOYSA-N 1 1 339.359 2.192 20 5 EEBDMO COCCOC1CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000116868818 1369440088 /nfs/dbraw/zinc/44/00/88/1369440088.db2.gz HGHCKWACHXKDIO-UHFFFAOYSA-N 1 1 334.376 2.029 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N(C)CCCNc1ccc([N+](=O)[O-])cc1F ZINC001109521081 805598519 /nfs/dbraw/zinc/59/85/19/805598519.db2.gz YSGGVZWZKBFNPR-UHFFFAOYSA-N 1 1 340.399 2.336 20 5 EEBDMO Cc1ccn(C)c1C(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001031632164 770484756 /nfs/dbraw/zinc/48/47/56/770484756.db2.gz NINNMGKBSWPURA-UHFFFAOYSA-N 1 1 342.399 2.104 20 5 EEBDMO O=C(Cc1ccoc1)N1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000981028667 776360323 /nfs/dbraw/zinc/36/03/23/776360323.db2.gz LZXOWNQOMGEWLA-UHFFFAOYSA-N 1 1 343.383 2.465 20 5 EEBDMO O=C(Cc1ccoc1)N1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000981028667 776360327 /nfs/dbraw/zinc/36/03/27/776360327.db2.gz LZXOWNQOMGEWLA-UHFFFAOYSA-N 1 1 343.383 2.465 20 5 EEBDMO O=C(NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1)c1ccc(Cl)[nH]1 ZINC001031957633 780665150 /nfs/dbraw/zinc/66/51/50/780665150.db2.gz BJYDJRSVIRYWES-UHFFFAOYSA-N 1 1 348.790 2.438 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NC[C@H]1C[C@H](Nc2ccccc2[N+](=O)[O-])C1 ZINC001091462542 790902611 /nfs/dbraw/zinc/90/26/11/790902611.db2.gz REILMVJZOVYLIC-HDJSIYSDSA-N 1 1 334.420 2.242 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(C(=O)C(C)(C)c3ccccc3[N+](=O)[O-])C[C@@H]2C1 ZINC000816777959 784257099 /nfs/dbraw/zinc/25/70/99/784257099.db2.gz NLFXCCXLDDTGGR-KGLIPLIRSA-N 1 1 331.416 2.283 20 5 EEBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000823981387 788007439 /nfs/dbraw/zinc/00/74/39/788007439.db2.gz XBNNEJNEKWHISO-GFCCVEGCSA-N 1 1 335.408 2.276 20 5 EEBDMO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCN(Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 ZINC000846225937 790093888 /nfs/dbraw/zinc/09/38/88/790093888.db2.gz ROKHKFKVZWXJQC-VMGRFDJRSA-N 1 1 337.395 2.452 20 5 EEBDMO C[N@@H+](C[C@@H]1CCCOC1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172902798 791790797 /nfs/dbraw/zinc/79/07/97/791790797.db2.gz BYCVMWICBLBSHC-ZDUSSCGKSA-N 1 1 331.376 2.169 20 5 EEBDMO Cc1c(NCC2([NH+]3CCCC3)COC2)ccc([N+](=O)[O-])c1[N+](=O)[O-] ZINC001168451071 795097112 /nfs/dbraw/zinc/09/71/12/795097112.db2.gz FUZOQXFXOUVJBM-UHFFFAOYSA-N 1 1 336.348 2.088 20 5 EEBDMO CC(C)c1[nH+]ccn1CC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC001094157949 795971628 /nfs/dbraw/zinc/97/16/28/795971628.db2.gz SMWJVUUDAXLHPC-UHFFFAOYSA-N 1 1 331.376 2.143 20 5 EEBDMO O=C1NCC[C@@]12CCC[N@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172907710 797133479 /nfs/dbraw/zinc/13/34/79/797133479.db2.gz LMVCTBIRMGGHEI-QFBILLFUSA-N 1 1 343.427 2.444 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCC[N@@H+](C)CC2)c1F ZINC001173182623 797280642 /nfs/dbraw/zinc/28/06/42/797280642.db2.gz IFKWUWWOQRWSPQ-GFCCVEGCSA-N 1 1 325.384 2.311 20 5 EEBDMO O=C(NC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1)c1ccccn1 ZINC001002234704 797731220 /nfs/dbraw/zinc/73/12/20/797731220.db2.gz IKTBAZICIWLYSB-UHFFFAOYSA-N 1 1 340.383 2.384 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NCC1(Nc2nccc(C)c2[N+](=O)[O-])CC1 ZINC001110266004 801086127 /nfs/dbraw/zinc/08/61/27/801086127.db2.gz HXGXEIFDSBWGKX-UHFFFAOYSA-N 1 1 349.435 2.089 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(c3nc(Cl)nc(Cl)c3[N+](=O)[O-])C[C@H]21 ZINC001157265580 807196929 /nfs/dbraw/zinc/19/69/29/807196929.db2.gz JPVQEFLKCPAQLX-HTQZYQBOSA-N 1 1 332.191 2.222 20 5 EEBDMO Cc1c(C[NH2+]C2CC[NH+](CCCC(=O)[O-])CC2)cccc1[N+](=O)[O-] ZINC000902342622 980842020 /nfs/dbraw/zinc/84/20/20/980842020.db2.gz KIJCHDVUICUKCC-UHFFFAOYSA-N 1 1 335.404 2.322 20 5 EEBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@@H](CO)C(C)(C)C ZINC000181771963 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348.403 2.010 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCSC[C@H]2C2CC2)c1 ZINC000451650525 243189666 /nfs/dbraw/zinc/18/96/66/243189666.db2.gz UTBDCOIDUULUNA-ZBFHGGJFSA-N 1 1 338.429 2.162 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](CCCO)C2)cccc1[N+](=O)[O-] ZINC000452134800 243351594 /nfs/dbraw/zinc/35/15/94/243351594.db2.gz VCHYXEJIJGBGTH-ZIAGYGMSSA-N 1 1 335.404 2.325 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000110992712 220088254 /nfs/dbraw/zinc/08/82/54/220088254.db2.gz CHQDLLCUZRNXQV-LBPRGKRZSA-N 1 1 339.367 2.103 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000264156892 246119934 /nfs/dbraw/zinc/11/99/34/246119934.db2.gz XJJHFDLZTRTQRP-NSHDSACASA-N 1 1 329.422 2.141 20 5 EEBDMO CC[C@H]1C(=O)N(CC)CC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000495231827 247093919 /nfs/dbraw/zinc/09/39/19/247093919.db2.gz WFLGJHLHFHKSCA-INIZCTEOSA-N 1 1 335.404 2.306 20 5 EEBDMO CC[C@H]1C(=O)N(CC)CC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000495231827 247093924 /nfs/dbraw/zinc/09/39/24/247093924.db2.gz WFLGJHLHFHKSCA-INIZCTEOSA-N 1 1 335.404 2.306 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000266364525 248266107 /nfs/dbraw/zinc/26/61/07/248266107.db2.gz FQNJEYQFGNNQBT-LBPRGKRZSA-N 1 1 330.388 2.490 20 5 EEBDMO COc1cccc(C(=O)NC[C@@H](C)Cn2cc[nH+]c2C)c1[N+](=O)[O-] ZINC000195437684 256011612 /nfs/dbraw/zinc/01/16/12/256011612.db2.gz XRPKCDBEZZNIAE-LLVKDONJSA-N 1 1 332.360 2.174 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C[N@H+]1Cc1ccccc1 ZINC000268126613 256115951 /nfs/dbraw/zinc/11/59/51/256115951.db2.gz DABPIYCOYSCYAO-TZMCWYRMSA-N 1 1 328.372 2.316 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000270524870 256144175 /nfs/dbraw/zinc/14/41/75/256144175.db2.gz NJPIZXMBKQFJSK-INIZCTEOSA-N 1 1 332.404 2.017 20 5 EEBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000276044758 256398017 /nfs/dbraw/zinc/39/80/17/256398017.db2.gz HERMRKKOEVQFNN-TZMCWYRMSA-N 1 1 339.417 2.037 20 5 EEBDMO C[N@@H+](CC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCSC1 ZINC000126012364 292304134 /nfs/dbraw/zinc/30/41/34/292304134.db2.gz MDEDTTRSVCMNOF-CQSZACIVSA-N 1 1 337.445 2.383 20 5 EEBDMO CC(C)[N@H+](CC(=O)NC[C@H]1CCCO1)Cc1ccc([N+](=O)[O-])cc1 ZINC000067458415 159012045 /nfs/dbraw/zinc/01/20/45/159012045.db2.gz PNOBXKUEDKPEQA-MRXNPFEDSA-N 1 1 335.404 2.100 20 5 EEBDMO CC(C)[N@@H+](CC(=O)NC[C@H]1CCCO1)Cc1ccc([N+](=O)[O-])cc1 ZINC000067458415 159012046 /nfs/dbraw/zinc/01/20/46/159012046.db2.gz PNOBXKUEDKPEQA-MRXNPFEDSA-N 1 1 335.404 2.100 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)cc1[N+](=O)[O-] ZINC000069534441 159029136 /nfs/dbraw/zinc/02/91/36/159029136.db2.gz ZFIYMJSQGBBJED-SECBINFHSA-N 1 1 336.348 2.024 20 5 EEBDMO CN(C)c1noc([C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000194939578 160203328 /nfs/dbraw/zinc/20/33/28/160203328.db2.gz UHOZRBJXEUECPN-ZDUSSCGKSA-N 1 1 331.376 2.423 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(CCn2cc([N+](=O)[O-])cn2)C1 ZINC000245411736 160233426 /nfs/dbraw/zinc/23/34/26/160233426.db2.gz YFKFNUYMWVZWCP-CVEARBPZSA-N 1 1 335.452 2.378 20 5 EEBDMO CNC(=O)[C@H](C)C[N@@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000246234418 160269565 /nfs/dbraw/zinc/26/95/65/160269565.db2.gz QQIDIFDZFZOUME-GHMZBOCLSA-N 1 1 347.375 2.020 20 5 EEBDMO CC(C)C[C@@H]1COCC[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248439852 160346431 /nfs/dbraw/zinc/34/64/31/160346431.db2.gz CQTFOGYXUBHBMR-HUUCEWRRSA-N 1 1 338.404 2.081 20 5 EEBDMO CC(C)C[C@@H]1COCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248439852 160346433 /nfs/dbraw/zinc/34/64/33/160346433.db2.gz CQTFOGYXUBHBMR-HUUCEWRRSA-N 1 1 338.404 2.081 20 5 EEBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000342419969 161063802 /nfs/dbraw/zinc/06/38/02/161063802.db2.gz RXWFQGLNMBOVGB-CYBMUJFWSA-N 1 1 330.388 2.184 20 5 EEBDMO C[C@@H]1C[C@H](CO)CC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000344170838 161204398 /nfs/dbraw/zinc/20/43/98/161204398.db2.gz OMEWTSYKWIAYQH-VXGBXAGGSA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@@H]1C[C@H](CO)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000344170838 161204399 /nfs/dbraw/zinc/20/43/99/161204399.db2.gz OMEWTSYKWIAYQH-VXGBXAGGSA-N 1 1 332.360 2.238 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H]1CCCCS1(=O)=O ZINC000344323154 161217491 /nfs/dbraw/zinc/21/74/91/161217491.db2.gz HXSZDCMNFHGBRU-CQSZACIVSA-N 1 1 342.417 2.050 20 5 EEBDMO COC(=O)[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]1C ZINC000346642531 161388221 /nfs/dbraw/zinc/38/82/21/161388221.db2.gz MLIUKZAOCHAVTQ-MFKMUULPSA-N 1 1 346.343 2.028 20 5 EEBDMO COC(=O)[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]1C ZINC000346642531 161388222 /nfs/dbraw/zinc/38/82/22/161388222.db2.gz MLIUKZAOCHAVTQ-MFKMUULPSA-N 1 1 346.343 2.028 20 5 EEBDMO O=C(NC[C@@H]1CCc2[nH+]ccn2C1)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000347257662 161438264 /nfs/dbraw/zinc/43/82/64/161438264.db2.gz JXDKUFGGVLGRKN-JTQLQIEISA-N 1 1 333.323 2.315 20 5 EEBDMO COc1c(C(=O)NCC[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000355031409 163057717 /nfs/dbraw/zinc/05/77/17/163057717.db2.gz ACZAVUHVOLVYDP-UHFFFAOYSA-N 1 1 343.383 2.465 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000355656237 163261121 /nfs/dbraw/zinc/26/11/21/163261121.db2.gz UXHLWYIITJYPCT-INIZCTEOSA-N 1 1 347.346 2.472 20 5 EEBDMO Cc1cc(NCCC[N@H+]2CCC[C@@H](C(N)=O)C2)c(F)cc1[N+](=O)[O-] ZINC000359892782 164192131 /nfs/dbraw/zinc/19/21/31/164192131.db2.gz BCQZJJGUPBDCRS-GFCCVEGCSA-N 1 1 338.383 2.042 20 5 EEBDMO CC(=O)N[C@@H](C)C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000360319400 164283151 /nfs/dbraw/zinc/28/31/51/164283151.db2.gz VTCLVAQYBHTEII-NSHDSACASA-N 1 1 346.387 2.473 20 5 EEBDMO Cc1c(CNC(=O)c2cc(C[NH+]3CCCC3)on2)cccc1[N+](=O)[O-] ZINC000360474069 164317836 /nfs/dbraw/zinc/31/78/36/164317836.db2.gz NAETWLANBSSHNZ-UHFFFAOYSA-N 1 1 344.371 2.417 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000364091258 165020030 /nfs/dbraw/zinc/02/00/30/165020030.db2.gz RIGIMQHSWUSMTR-UONOGXRCSA-N 1 1 348.403 2.196 20 5 EEBDMO C[C@H]1OCC[C@]12C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C[C@@H](C)O2 ZINC000369407344 166254309 /nfs/dbraw/zinc/25/43/09/166254309.db2.gz GQKONDNUNAEAQO-CPUCHLNUSA-N 1 1 336.388 2.242 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH2+][C@@H]3CCO[C@@H]3C3CC3)n2)c1 ZINC000372802647 166787764 /nfs/dbraw/zinc/78/77/64/166787764.db2.gz KKANWDNMGWRKMO-UKRRQHHQSA-N 1 1 330.344 2.302 20 5 EEBDMO CCC(=O)c1ccc(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)c([N+](=O)[O-])c1 ZINC000375652468 167175204 /nfs/dbraw/zinc/17/52/04/167175204.db2.gz BTPSBBLXFSPZTF-KGLIPLIRSA-N 1 1 333.388 2.463 20 5 EEBDMO Cc1cc(C(=O)NCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000122423853 222084191 /nfs/dbraw/zinc/08/41/91/222084191.db2.gz DJHUJYFSWRVQHB-OKILXGFUSA-N 1 1 335.404 2.132 20 5 EEBDMO C[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C1=CC[N@@H+](C)CC1 ZINC000272643901 269003120 /nfs/dbraw/zinc/00/31/20/269003120.db2.gz CYKPRFZWVNBKNW-GFCCVEGCSA-N 1 1 342.399 2.385 20 5 EEBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c3cnccc32)CC[N@H+]1CC(C)(C)O ZINC000275454154 269116996 /nfs/dbraw/zinc/11/69/96/269116996.db2.gz HATJHVKLNTWJQL-CYBMUJFWSA-N 1 1 344.415 2.424 20 5 EEBDMO CCCN(CC[NH+](CC)CC)C(=O)c1n[nH]c(CC)c1[N+](=O)[O-] ZINC000277938725 269199330 /nfs/dbraw/zinc/19/93/30/269199330.db2.gz KMDIKJFZUXYYSL-UHFFFAOYSA-N 1 1 325.413 2.074 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1C[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC000278691333 269240394 /nfs/dbraw/zinc/24/03/94/269240394.db2.gz ZKIQSGVSUIRJDD-KRWDZBQOSA-N 1 1 343.383 2.048 20 5 EEBDMO Cn1ccnc1[C@@H](NCC[N@H+]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000279806380 269307146 /nfs/dbraw/zinc/30/71/46/269307146.db2.gz OCFBAXFHSKFQAI-KRWDZBQOSA-N 1 1 341.415 2.269 20 5 EEBDMO Cn1ccnc1[C@@H](NCC[N@@H+]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000279806380 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EEBDMO CCCC[C@@H](C(=O)OC)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072665178 463532565 /nfs/dbraw/zinc/53/25/65/463532565.db2.gz DYBHBPKWPGYSLU-JSGCOSHPSA-N 1 1 336.392 2.208 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](CO)c1cccc(F)c1 ZINC000359520493 465428566 /nfs/dbraw/zinc/42/85/66/465428566.db2.gz KWTHAISJBCBWGG-INIZCTEOSA-N 1 1 347.346 2.304 20 5 EEBDMO CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@H]1CCC[N@@H+](C)C1 ZINC000112657746 463705588 /nfs/dbraw/zinc/70/55/88/463705588.db2.gz KIVBJBXHZDZLLF-ZDUSSCGKSA-N 1 1 345.403 2.418 20 5 EEBDMO O=C(C[N@H+](CCO)CCc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000112698575 463705928 /nfs/dbraw/zinc/70/59/28/463705928.db2.gz TUDAHTBBGDFLAH-UHFFFAOYSA-N 1 1 343.383 2.070 20 5 EEBDMO O=C(C[N@@H+](CCO)CCc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000112698575 463705929 /nfs/dbraw/zinc/70/59/29/463705929.db2.gz TUDAHTBBGDFLAH-UHFFFAOYSA-N 1 1 343.383 2.070 20 5 EEBDMO CC[C@H]1[C@H](C)CC[N@@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000185622043 463851082 /nfs/dbraw/zinc/85/10/82/463851082.db2.gz OYWKRSAZUCFJLL-DOMZBBRYSA-N 1 1 326.418 2.489 20 5 EEBDMO CC[C@H]1[C@H](C)CC[N@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000185622043 463851088 /nfs/dbraw/zinc/85/10/88/463851088.db2.gz OYWKRSAZUCFJLL-DOMZBBRYSA-N 1 1 326.418 2.489 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000287310091 463865390 /nfs/dbraw/zinc/86/53/90/463865390.db2.gz NEIJSYGVRDOCSH-ZDUSSCGKSA-N 1 1 335.404 2.468 20 5 EEBDMO Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCC[C@H]1CCC[N@H+]1C ZINC000185730792 463870383 /nfs/dbraw/zinc/87/03/83/463870383.db2.gz XBXLQABBMIUTFW-LLVKDONJSA-N 1 1 348.428 2.418 20 5 EEBDMO Cc1cc(C(=O)N2CC[NH2+]C[C@H]2c2cccnc2)cc([N+](=O)[O-])c1 ZINC000262005779 463923211 /nfs/dbraw/zinc/92/32/11/463923211.db2.gz QJANCISLZJTRGO-INIZCTEOSA-N 1 1 326.356 2.085 20 5 EEBDMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000269332203 463954842 /nfs/dbraw/zinc/95/48/42/463954842.db2.gz APQUSHQFYSYDIN-VXGBXAGGSA-N 1 1 335.408 2.140 20 5 EEBDMO CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000269332203 463954843 /nfs/dbraw/zinc/95/48/43/463954843.db2.gz APQUSHQFYSYDIN-VXGBXAGGSA-N 1 1 335.408 2.140 20 5 EEBDMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000269332203 463954851 /nfs/dbraw/zinc/95/48/51/463954851.db2.gz APQUSHQFYSYDIN-VXGBXAGGSA-N 1 1 335.408 2.140 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000283828728 464023773 /nfs/dbraw/zinc/02/37/73/464023773.db2.gz GDGUWYXNGGJKMU-CYBMUJFWSA-N 1 1 335.404 2.407 20 5 EEBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000269771091 464088333 /nfs/dbraw/zinc/08/83/33/464088333.db2.gz BAFNBXHMBKCXOF-FZMZJTMJSA-N 1 1 332.360 2.380 20 5 EEBDMO C[C@H]1CCSCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000279347155 464091057 /nfs/dbraw/zinc/09/10/57/464091057.db2.gz VFRRTVCWBHNIFE-STQMWFEESA-N 1 1 326.418 2.162 20 5 EEBDMO COc1cc(C[N@@H+]2C[C@@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000279690759 464128176 /nfs/dbraw/zinc/12/81/76/464128176.db2.gz GCHCZTWMCPOLRW-CYBMUJFWSA-N 1 1 346.330 2.408 20 5 EEBDMO COc1cc(C[N@H+]2C[C@@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000279690759 464128181 /nfs/dbraw/zinc/12/81/81/464128181.db2.gz GCHCZTWMCPOLRW-CYBMUJFWSA-N 1 1 346.330 2.408 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C(N)=O)[C@H](C)c1ccccc1 ZINC000292394718 464218326 /nfs/dbraw/zinc/21/83/26/464218326.db2.gz ZYBVPQZGURDQRA-PXAZEXFGSA-N 1 1 343.383 2.351 20 5 EEBDMO O=C1N[C@H]2CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C[C@@H]2CO1 ZINC000281150339 464351545 /nfs/dbraw/zinc/35/15/45/464351545.db2.gz FLFCXWXWKWXRLE-PWSUYJOCSA-N 1 1 325.752 2.179 20 5 EEBDMO O=C1N[C@H]2CC[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C[C@@H]2CO1 ZINC000281150339 464351551 /nfs/dbraw/zinc/35/15/51/464351551.db2.gz FLFCXWXWKWXRLE-PWSUYJOCSA-N 1 1 325.752 2.179 20 5 EEBDMO CCCC[N@@H+](CCOC)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000264553384 464370689 /nfs/dbraw/zinc/37/06/89/464370689.db2.gz KAHHSSGSNGQRHO-OAHLLOKOSA-N 1 1 326.393 2.083 20 5 EEBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCCO1 ZINC000188936874 464401634 /nfs/dbraw/zinc/40/16/34/464401634.db2.gz AJTGMVPVYVMENV-NSHDSACASA-N 1 1 325.340 2.173 20 5 EEBDMO Cc1n[nH]c(C(=O)NCc2cccc(C[N@H+](C)C(C)C)c2)c1[N+](=O)[O-] ZINC000264753076 464450835 /nfs/dbraw/zinc/45/08/35/464450835.db2.gz LUPZLAPZBDXGAY-UHFFFAOYSA-N 1 1 345.403 2.397 20 5 EEBDMO CCOC(=O)c1cc(N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000272138108 464493141 /nfs/dbraw/zinc/49/31/41/464493141.db2.gz ASKSJZQOHGQPCN-BLLLJJGKSA-N 1 1 333.388 2.302 20 5 EEBDMO CCOC(=O)[C@H](C)[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000281885521 464621104 /nfs/dbraw/zinc/62/11/04/464621104.db2.gz ANQSFHHFSOJKDO-LBPRGKRZSA-N 1 1 349.387 2.339 20 5 EEBDMO CCOC(=O)[C@H](C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000281885521 464621110 /nfs/dbraw/zinc/62/11/10/464621110.db2.gz ANQSFHHFSOJKDO-LBPRGKRZSA-N 1 1 349.387 2.339 20 5 EEBDMO COc1ccc(NC(=O)C[N@@H+]2CCSC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000190425337 464642238 /nfs/dbraw/zinc/64/22/38/464642238.db2.gz RAHHJKOTJOQWHN-NSHDSACASA-N 1 1 339.417 2.227 20 5 EEBDMO COc1ccc(NC(=O)C[N@H+]2CCSC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000190425337 464642242 /nfs/dbraw/zinc/64/22/42/464642242.db2.gz RAHHJKOTJOQWHN-NSHDSACASA-N 1 1 339.417 2.227 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)[C@H]2C1 ZINC000272570050 464662469 /nfs/dbraw/zinc/66/24/69/464662469.db2.gz FQXWBRYQDUVPQP-ZBEGNZNMSA-N 1 1 328.372 2.242 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@H]1CCCOC1)c1ccc([N+](=O)[O-])cc1 ZINC000272584431 464668271 /nfs/dbraw/zinc/66/82/71/464668271.db2.gz YWGDELYRIBVXJR-BBRMVZONSA-N 1 1 330.388 2.434 20 5 EEBDMO CCOc1ccc(NC(=O)C[N@@H+](C)[C@@H](C)C(C)(C)O)c([N+](=O)[O-])c1 ZINC000295054779 464690443 /nfs/dbraw/zinc/69/04/43/464690443.db2.gz BKCDUBZYUIPATP-NSHDSACASA-N 1 1 339.392 2.023 20 5 EEBDMO Cc1c(CC(=O)N2CC[N@H+](C3CC3)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000295301242 464780799 /nfs/dbraw/zinc/78/07/99/464780799.db2.gz JJTHHXWTBDDHKR-ZDUSSCGKSA-N 1 1 331.416 2.388 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@@H]([C@@H](C)O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000183151801 464809412 /nfs/dbraw/zinc/80/94/12/464809412.db2.gz TXSFXQRRNITQFZ-NXEZZACHSA-N 1 1 346.330 2.408 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000276258346 464867158 /nfs/dbraw/zinc/86/71/58/464867158.db2.gz ARUFRDFXKZWKKZ-RYUDHWBXSA-N 1 1 327.812 2.135 20 5 EEBDMO CCC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)OCC ZINC000282615776 464885810 /nfs/dbraw/zinc/88/58/10/464885810.db2.gz IOPHVSRARKHBHI-UHFFFAOYSA-N 1 1 337.376 2.199 20 5 EEBDMO CCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)OCC ZINC000282615776 464885812 /nfs/dbraw/zinc/88/58/12/464885812.db2.gz IOPHVSRARKHBHI-UHFFFAOYSA-N 1 1 337.376 2.199 20 5 EEBDMO CN(CC[NH+]1CCN(c2ccccc2)CC1)c1ncc([N+](=O)[O-])s1 ZINC000192460645 464929639 /nfs/dbraw/zinc/92/96/39/464929639.db2.gz DMYXDQPISYLLMV-UHFFFAOYSA-N 1 1 347.444 2.310 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(N2CCC[N@H+](CC(=O)N3CCCC3)CC2)c1 ZINC000268188703 464963987 /nfs/dbraw/zinc/96/39/87/464963987.db2.gz XHVJBTCZIMWRMW-UHFFFAOYSA-N 1 1 346.431 2.038 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(N2CCC[N@@H+](CC(=O)N3CCCC3)CC2)c1 ZINC000268188703 464963993 /nfs/dbraw/zinc/96/39/93/464963993.db2.gz XHVJBTCZIMWRMW-UHFFFAOYSA-N 1 1 346.431 2.038 20 5 EEBDMO C[C@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)CN1CCN(C)CC1 ZINC000192822946 465005867 /nfs/dbraw/zinc/00/58/67/465005867.db2.gz DFJHAMCPXBVOSF-BEFAXECRSA-N 1 1 346.475 2.445 20 5 EEBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000554600360 468429167 /nfs/dbraw/zinc/42/91/67/468429167.db2.gz QMBYLGIMXLBPSV-ZDUSSCGKSA-N 1 1 349.387 2.270 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)c1 ZINC000356344272 465325696 /nfs/dbraw/zinc/32/56/96/465325696.db2.gz LKUYQDBXTHJYDP-LEAZNMPDSA-N 1 1 342.399 2.330 20 5 EEBDMO Cc1c(NC(=O)CC[NH+]2C[C@H](C)N(C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000339627247 465399417 /nfs/dbraw/zinc/39/94/17/465399417.db2.gz IPVCJVSFYXAIDU-STQMWFEESA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H](CO)c1cccc(F)c1 ZINC000359546319 465447014 /nfs/dbraw/zinc/44/70/14/465447014.db2.gz ZVAIVWPBHNNEFC-CQSZACIVSA-N 1 1 347.346 2.304 20 5 EEBDMO Cc1[nH+]cn(-c2ccc(NC(=O)Cn3ccc([N+](=O)[O-])n3)cc2)c1C ZINC000360929393 465638713 /nfs/dbraw/zinc/63/87/13/465638713.db2.gz DGOQQPXOHFZISC-UHFFFAOYSA-N 1 1 340.343 2.233 20 5 EEBDMO C[C@@H]1C[NH+](C[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000299190919 465643610 /nfs/dbraw/zinc/64/36/10/465643610.db2.gz HDNBFYIDXUUPBJ-CKEIUWERSA-N 1 1 347.415 2.309 20 5 EEBDMO CC[N@H+]1CC[C@H](CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000299361453 465716758 /nfs/dbraw/zinc/71/67/58/465716758.db2.gz YWNAANIXTGHIJV-CYBMUJFWSA-N 1 1 330.388 2.008 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@@H]1C ZINC000330588523 465718190 /nfs/dbraw/zinc/71/81/90/465718190.db2.gz UJIAVYUGCGFBEY-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO Cn1cc([C@H](O)C[C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)cn1 ZINC000371335465 465723262 /nfs/dbraw/zinc/72/32/62/465723262.db2.gz LFBSKENRBRUMOE-NVXWUHKLSA-N 1 1 330.388 2.416 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000338176913 465877479 /nfs/dbraw/zinc/87/74/79/465877479.db2.gz GOFZNCIPZKJPGI-UHFFFAOYSA-N 1 1 339.355 2.468 20 5 EEBDMO COc1cc(C[N@H+](C)C2CC(O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000353480545 465917848 /nfs/dbraw/zinc/91/78/48/465917848.db2.gz IQABOLBIQFPUIR-UHFFFAOYSA-N 1 1 346.330 2.202 20 5 EEBDMO COc1cc(C[N@@H+](C)C2CC(O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000353480545 465917853 /nfs/dbraw/zinc/91/78/53/465917853.db2.gz IQABOLBIQFPUIR-UHFFFAOYSA-N 1 1 346.330 2.202 20 5 EEBDMO Cn1ccnc1[C@@H](NC[C@H]1CCC[N@H+]1C)c1cccc([N+](=O)[O-])c1 ZINC000353498942 465933957 /nfs/dbraw/zinc/93/39/57/465933957.db2.gz SFWXOHVHJUUGHX-CVEARBPZSA-N 1 1 329.404 2.102 20 5 EEBDMO COc1ccc(CN2CCC(OCC[NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000353517541 465948434 /nfs/dbraw/zinc/94/84/34/465948434.db2.gz JAGYSJLSNGCUPK-UHFFFAOYSA-N 1 1 337.420 2.146 20 5 EEBDMO CC(C)[N@@H+](C)C[C@H](C)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000357563335 466135190 /nfs/dbraw/zinc/13/51/90/466135190.db2.gz HOGRZLVZAFBHQD-NSHDSACASA-N 1 1 329.422 2.139 20 5 EEBDMO CN(C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ncccc1[N+](=O)[O-] ZINC000302468947 466143610 /nfs/dbraw/zinc/14/36/10/466143610.db2.gz TWFYNDSTHIFBPH-GOSISDBHSA-N 1 1 342.399 2.063 20 5 EEBDMO Cc1c(Cc2noc(CCc3c[nH+]cn3C)n2)cccc1[N+](=O)[O-] ZINC000346860893 466205297 /nfs/dbraw/zinc/20/52/97/466205297.db2.gz CTQZTLUOWDBZJE-UHFFFAOYSA-N 1 1 327.344 2.396 20 5 EEBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000361784341 466286676 /nfs/dbraw/zinc/28/66/76/466286676.db2.gz DADCHYUNKQIMPV-OAHLLOKOSA-N 1 1 348.447 2.412 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[C@H](C3CC[NH+](C)CC3)C2)c1[N+](=O)[O-] ZINC000372305430 466291241 /nfs/dbraw/zinc/29/12/41/466291241.db2.gz QGSLHQACJZVDDR-ZDUSSCGKSA-N 1 1 349.435 2.074 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N2C[C@H]3CCCC[N@@H+]3C[C@@H]2C)c1[N+](=O)[O-] ZINC000331913286 466302703 /nfs/dbraw/zinc/30/27/03/466302703.db2.gz BDAMELAZVFARSV-NWDGAFQWSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N2C[C@H]3CCCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-] ZINC000331913286 466302707 /nfs/dbraw/zinc/30/27/07/466302707.db2.gz BDAMELAZVFARSV-NWDGAFQWSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2C[C@H]3CCCC[N@@H+]3C[C@@H]2C)c1[N+](=O)[O-] ZINC000331913286 466302719 /nfs/dbraw/zinc/30/27/19/466302719.db2.gz BDAMELAZVFARSV-NWDGAFQWSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2C[C@H]3CCCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-] ZINC000331913286 466302724 /nfs/dbraw/zinc/30/27/24/466302724.db2.gz BDAMELAZVFARSV-NWDGAFQWSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)[C@H]1CN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC[N@H+]1C ZINC000331921088 466306966 /nfs/dbraw/zinc/30/69/66/466306966.db2.gz CFFLOKNUZTYIRI-MRXNPFEDSA-N 1 1 330.388 2.488 20 5 EEBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000332072256 466372370 /nfs/dbraw/zinc/37/23/70/466372370.db2.gz XDQQPVQZAXSCON-CABCVRRESA-N 1 1 339.342 2.159 20 5 EEBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N)cn1 ZINC000372698395 466544206 /nfs/dbraw/zinc/54/42/06/466544206.db2.gz CLWBHDUSWVPCGE-UHFFFAOYSA-N 1 1 338.327 2.318 20 5 EEBDMO O=[N+]([O-])c1ccc2nc(NC[C@H]3C[N@H+]4CCC[C@@H]4CO3)ccc2c1 ZINC000325191077 466654505 /nfs/dbraw/zinc/65/45/05/466654505.db2.gz AAZOSVXHIIEIEC-CABCVRRESA-N 1 1 328.372 2.418 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@](O)(C3CC3)C2)cccc1[N+](=O)[O-] ZINC000373280322 466751464 /nfs/dbraw/zinc/75/14/64/466751464.db2.gz WUWIPRHYYJCLNE-YVEFUNNKSA-N 1 1 333.388 2.077 20 5 EEBDMO O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1c1ccncc1 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CCOC(=O)[C@@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCO1 ZINC001172914286 797148205 /nfs/dbraw/zinc/14/82/05/797148205.db2.gz GKCBAJMGVXDANI-RDJZCZTQSA-N 1 1 348.399 2.106 20 5 EEBDMO CC(C)N1CC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1=O ZINC001172919610 797150835 /nfs/dbraw/zinc/15/08/35/797150835.db2.gz GTTZCOYLZMLJLL-MRXNPFEDSA-N 1 1 331.416 2.395 20 5 EEBDMO CC(C)N1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1=O ZINC001172919610 797150841 /nfs/dbraw/zinc/15/08/41/797150841.db2.gz GTTZCOYLZMLJLL-MRXNPFEDSA-N 1 1 331.416 2.395 20 5 EEBDMO CC(=O)N[C@H]1CCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172914140 797170907 /nfs/dbraw/zinc/17/09/07/797170907.db2.gz CYPFHGHKGSMEBY-IRXDYDNUSA-N 1 1 331.416 2.443 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C[C@H]2CCN(C)C2)c1F ZINC001173178085 797278056 /nfs/dbraw/zinc/27/80/56/797278056.db2.gz ZUVMTHQBUONKSE-NWDGAFQWSA-N 1 1 325.384 2.215 20 5 EEBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]2[C@@H](CCC(=O)N2C)C1 ZINC001173237163 797321531 /nfs/dbraw/zinc/32/15/31/797321531.db2.gz INUSATZKKXLXTL-JLJPHGGASA-N 1 1 331.416 2.469 20 5 EEBDMO O=C(NC1CC[NH+](Cc2ccccc2C2CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001002789966 798599091 /nfs/dbraw/zinc/59/90/91/798599091.db2.gz ZBCYDTGSCHJRHN-QZTJIDSGSA-N 1 1 343.427 2.310 20 5 EEBDMO O=C1N(CC2CC2)CC[C@]12CCC[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169021575 803588226 /nfs/dbraw/zinc/58/82/26/803588226.db2.gz LQCJPNYYSHRAJX-JZXOWHBKSA-N 1 1 335.448 2.156 20 5 EEBDMO C[C@H](CN1CCOCC1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000789765790 808171762 /nfs/dbraw/zinc/17/17/62/808171762.db2.gz SOSVJGXTGBWENT-GFCCVEGCSA-N 1 1 327.812 2.401 20 5 EEBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790912081 808994791 /nfs/dbraw/zinc/99/47/91/808994791.db2.gz NGWUSXFBIPPGSW-UWVGGRQHSA-N 1 1 343.786 2.481 20 5 EEBDMO C[C@@]1(O)CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000791632605 809356106 /nfs/dbraw/zinc/35/61/06/809356106.db2.gz OHXXBTBYNSUBLM-OAHLLOKOSA-N 1 1 341.795 2.424 20 5 EEBDMO C[C@@]1(O)CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000791632605 809356113 /nfs/dbraw/zinc/35/61/13/809356113.db2.gz OHXXBTBYNSUBLM-OAHLLOKOSA-N 1 1 341.795 2.424 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[NH+](Cc2ccco2)Cc2ccco2)c1 ZINC000174706739 231285311 /nfs/dbraw/zinc/28/53/11/231285311.db2.gz ZWWPIKSVFMFKCQ-AWEZNQCLSA-N 1 1 346.343 2.041 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CC[C@@H](CN2CCOCC2)C1 ZINC000174875624 231331599 /nfs/dbraw/zinc/33/15/99/231331599.db2.gz CVDQWFQYHFRCJJ-ZDUSSCGKSA-N 1 1 339.823 2.402 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@@H](CN2CCOCC2)C1 ZINC000174875624 231331601 /nfs/dbraw/zinc/33/16/01/231331601.db2.gz CVDQWFQYHFRCJJ-ZDUSSCGKSA-N 1 1 339.823 2.402 20 5 EEBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@@H+](C)C2)cc1SC ZINC000104184371 219356308 /nfs/dbraw/zinc/35/63/08/219356308.db2.gz GLHAXCWHKRYGSA-JTQLQIEISA-N 1 1 339.417 2.007 20 5 EEBDMO Cc1[nH+]ccn1CCCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000129940677 223105229 /nfs/dbraw/zinc/10/52/29/223105229.db2.gz AEKQWMOTKMOZSV-UHFFFAOYSA-N 1 1 335.339 2.031 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1CO ZINC000191723046 239266954 /nfs/dbraw/zinc/26/69/54/239266954.db2.gz FKTQPQXOSPVKOX-DOMZBBRYSA-N 1 1 330.388 2.056 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)CC[N@H+]1C ZINC000445896402 242141639 /nfs/dbraw/zinc/14/16/39/242141639.db2.gz HZUSSOOEKUTQEK-IUODEOHRSA-N 1 1 332.404 2.145 20 5 EEBDMO Cc1ccc(NC(=O)[C@@H]2CCC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000133104016 223388432 /nfs/dbraw/zinc/38/84/32/223388432.db2.gz UYLCCKLVKXXQFP-HNNXBMFYSA-N 1 1 333.388 2.485 20 5 EEBDMO Cc1c(CC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000133206753 223396316 /nfs/dbraw/zinc/39/63/16/223396316.db2.gz JVNMPINAGLKOCI-RDJZCZTQSA-N 1 1 331.416 2.388 20 5 EEBDMO COc1cc(C(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000451162308 243017294 /nfs/dbraw/zinc/01/72/94/243017294.db2.gz MWJFUPIESSUYPW-AWEZNQCLSA-N 1 1 339.367 2.155 20 5 EEBDMO Cc1ncsc1CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000078950159 217155945 /nfs/dbraw/zinc/15/59/45/217155945.db2.gz NAJVCEBHKOFSRI-GFCCVEGCSA-N 1 1 333.417 2.484 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000081364071 217388724 /nfs/dbraw/zinc/38/87/24/217388724.db2.gz STOWFBDVORWCTC-LBPRGKRZSA-N 1 1 345.403 2.275 20 5 EEBDMO CCC[N@H+](C)C[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000081364071 217388726 /nfs/dbraw/zinc/38/87/26/217388726.db2.gz STOWFBDVORWCTC-LBPRGKRZSA-N 1 1 345.403 2.275 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000081364071 217388728 /nfs/dbraw/zinc/38/87/28/217388728.db2.gz STOWFBDVORWCTC-LBPRGKRZSA-N 1 1 345.403 2.275 20 5 EEBDMO COCCC[N@@H+](C)CCNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000091673938 218045904 /nfs/dbraw/zinc/04/59/04/218045904.db2.gz WZISRPVKFRHYMQ-UHFFFAOYSA-N 1 1 337.420 2.218 20 5 EEBDMO C[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCS1 ZINC000117339180 221055731 /nfs/dbraw/zinc/05/57/31/221055731.db2.gz ADLBOKNDWLYOKP-NSHDSACASA-N 1 1 337.401 2.330 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000267224155 256039545 /nfs/dbraw/zinc/03/95/45/256039545.db2.gz BFEZATDJFBDTTL-CQSZACIVSA-N 1 1 334.420 2.121 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000270373428 256128408 /nfs/dbraw/zinc/12/84/08/256128408.db2.gz NHSUZTZFJGENMG-APPDUMDISA-N 1 1 342.399 2.218 20 5 EEBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@H]2CC[N@@H+]3CCCC[C@@H]23)s1 ZINC000272819358 256241921 /nfs/dbraw/zinc/24/19/21/256241921.db2.gz IOXYRAFBDFFBCN-UWVGGRQHSA-N 1 1 345.446 2.099 20 5 EEBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@H]2CC[N@H+]3CCCC[C@@H]23)s1 ZINC000272819358 256241923 /nfs/dbraw/zinc/24/19/23/256241923.db2.gz IOXYRAFBDFFBCN-UWVGGRQHSA-N 1 1 345.446 2.099 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)[C@H](C)C1 ZINC000275964440 256391370 /nfs/dbraw/zinc/39/13/70/256391370.db2.gz CHRWTACCFAJOHX-GHMZBOCLSA-N 1 1 345.346 2.088 20 5 EEBDMO CC[N@@H+](C[C@H](C)O)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000352203505 153003388 /nfs/dbraw/zinc/00/33/88/153003388.db2.gz SGMIVMSDLNGPAZ-VHSXEESVSA-N 1 1 329.784 2.278 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])cc1OC ZINC000377236722 154098706 /nfs/dbraw/zinc/09/87/06/154098706.db2.gz GHJGLRAQMLNAJI-CHWSQXEVSA-N 1 1 336.388 2.470 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)Cn2cc[nH+]c2C)c1 ZINC000068360564 159018702 /nfs/dbraw/zinc/01/87/02/159018702.db2.gz LQMFDGNZBOSPLK-NSHDSACASA-N 1 1 332.360 2.174 20 5 EEBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H](CN2CCOCC2)C1 ZINC000069805411 159031070 /nfs/dbraw/zinc/03/10/70/159031070.db2.gz CJZJNHHLIDVPNY-MRXNPFEDSA-N 1 1 349.431 2.018 20 5 EEBDMO CC(C)[N@@H+](C)CCNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000101952563 159258265 /nfs/dbraw/zinc/25/82/65/159258265.db2.gz AGOPYWXQQROYOA-UHFFFAOYSA-N 1 1 345.403 2.065 20 5 EEBDMO COc1cc(C[N@@H+]2CCC[C@H](CCC(N)=O)C2)c([N+](=O)[O-])cc1F ZINC000184196035 160003665 /nfs/dbraw/zinc/00/36/65/160003665.db2.gz YCOMXERUYBULKR-LLVKDONJSA-N 1 1 339.367 2.220 20 5 EEBDMO COc1cc(C[N@H+]2CCC[C@H](CCC(N)=O)C2)c([N+](=O)[O-])cc1F ZINC000184196035 160003668 /nfs/dbraw/zinc/00/36/68/160003668.db2.gz YCOMXERUYBULKR-LLVKDONJSA-N 1 1 339.367 2.220 20 5 EEBDMO C[C@H](c1ccncc1)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248449798 160346770 /nfs/dbraw/zinc/34/67/70/160346770.db2.gz IJIYPPHVUVEKAD-UKRRQHHQSA-N 1 1 331.372 2.423 20 5 EEBDMO CS[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1N(C)C ZINC000343634105 161152950 /nfs/dbraw/zinc/15/29/50/161152950.db2.gz GALIGUHEPULRTD-HZPDHXFCSA-N 1 1 339.461 2.341 20 5 EEBDMO CS[C@@H]1CN(CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1[NH+](C)C ZINC000343634105 161152951 /nfs/dbraw/zinc/15/29/51/161152951.db2.gz GALIGUHEPULRTD-HZPDHXFCSA-N 1 1 339.461 2.341 20 5 EEBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000344403927 161224026 /nfs/dbraw/zinc/22/40/26/161224026.db2.gz WZCCVDLZLFOXOZ-NSHDSACASA-N 1 1 325.796 2.343 20 5 EEBDMO C[C@@H]1[C@@H](NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])CCC[N@H+]1C ZINC000345957860 161345296 /nfs/dbraw/zinc/34/52/96/161345296.db2.gz VXALENRHRQUGIR-HIFRSBDPSA-N 1 1 334.420 2.261 20 5 EEBDMO Cc1c(CNC(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000359210879 164084168 /nfs/dbraw/zinc/08/41/68/164084168.db2.gz DVDSLTUHXRRQNW-BXUZGUMPSA-N 1 1 332.404 2.328 20 5 EEBDMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC([N@@H+](C)CCCO)CC1 ZINC000360904649 164399092 /nfs/dbraw/zinc/39/90/92/164399092.db2.gz UGEWQKCHPQABFN-UHFFFAOYSA-N 1 1 335.404 2.080 20 5 EEBDMO Cc1c(C[N@@H+]2CCC[C@H]2C(=O)N2CCSCC2)cccc1[N+](=O)[O-] ZINC000364927336 165321719 /nfs/dbraw/zinc/32/17/19/165321719.db2.gz XNDKJFZRPAOKKQ-INIZCTEOSA-N 1 1 349.456 2.443 20 5 EEBDMO Cc1c(C[N@H+]2CCC[C@H]2C(=O)N2CCSCC2)cccc1[N+](=O)[O-] ZINC000364927336 165321722 /nfs/dbraw/zinc/32/17/22/165321722.db2.gz XNDKJFZRPAOKKQ-INIZCTEOSA-N 1 1 349.456 2.443 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NCc1c[nH+]c2n1CCCC2 ZINC000375374498 167121019 /nfs/dbraw/zinc/12/10/19/167121019.db2.gz XTNKCLRKIMCHBR-UHFFFAOYSA-N 1 1 330.344 2.066 20 5 EEBDMO COc1cc(C[NH2+]Cc2cnc3n2CCCC3)c([N+](=O)[O-])cc1O ZINC000376714973 167380869 /nfs/dbraw/zinc/38/08/69/167380869.db2.gz HYEVEXKZWIQBRL-UHFFFAOYSA-N 1 1 332.360 2.132 20 5 EEBDMO Cc1c(C(=O)N2CC[N@@H+](C3CCOCC3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000278905271 269250145 /nfs/dbraw/zinc/25/01/45/269250145.db2.gz SEVCFLGXHOITPW-CYBMUJFWSA-N 1 1 347.415 2.229 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CC[N@@H+](CC(C)C)C1 ZINC000277563609 274310313 /nfs/dbraw/zinc/31/03/13/274310313.db2.gz KKRQJHQSXWQHQS-CYBMUJFWSA-N 1 1 335.404 2.311 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000290893057 275250064 /nfs/dbraw/zinc/25/00/64/275250064.db2.gz KGYGDBRWDYEDRP-JTQLQIEISA-N 1 1 326.372 2.166 20 5 EEBDMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000291105061 275270805 /nfs/dbraw/zinc/27/08/05/275270805.db2.gz GDCUECYENFGHNS-CYBMUJFWSA-N 1 1 337.424 2.035 20 5 EEBDMO CC[N@@H+](C[C@@H](C)OC)[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000361570474 279217230 /nfs/dbraw/zinc/21/72/30/279217230.db2.gz WOOAZYHFZQQOOY-NEPJUHHUSA-N 1 1 339.392 2.287 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+](C2CC2)C[C@H](C)C1 ZINC000296859372 294085737 /nfs/dbraw/zinc/08/57/37/294085737.db2.gz YTFVPIQNCWFKEO-KGLIPLIRSA-N 1 1 346.431 2.338 20 5 EEBDMO CCOCCC[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])c(C)n2)[C@@H](C)C1 ZINC000297149700 294164891 /nfs/dbraw/zinc/16/48/91/294164891.db2.gz OGFYSEDXLOGBMP-JSGCOSHPSA-N 1 1 337.424 2.242 20 5 EEBDMO CCOCCC[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])c(C)n2)[C@H](C)C1 ZINC000297149708 294165002 /nfs/dbraw/zinc/16/50/02/294165002.db2.gz OGFYSEDXLOGBMP-OCCSQVGLSA-N 1 1 337.424 2.242 20 5 EEBDMO COC(=O)Cc1ccc(N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c([N+](=O)[O-])c1 ZINC000297667660 294310542 /nfs/dbraw/zinc/31/05/42/294310542.db2.gz ZQDZBCRFDNJZRZ-HUUCEWRRSA-N 1 1 347.415 2.231 20 5 EEBDMO Cc1c(CNC(=O)N2C[C@@H]3CCC[N@@H+]3C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000332570663 312026946 /nfs/dbraw/zinc/02/69/46/312026946.db2.gz WFCXQEBLPOURIX-WFASDCNBSA-N 1 1 332.404 2.281 20 5 EEBDMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000332686253 312045399 /nfs/dbraw/zinc/04/53/99/312045399.db2.gz VOCHQIXXOTWESR-MNOVXSKESA-N 1 1 339.342 2.111 20 5 EEBDMO C[C@@H]1C[N@H+](C[C@@H](O)CSCc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000338202662 312248984 /nfs/dbraw/zinc/24/89/84/312248984.db2.gz AWTFAOIMBRUZSG-DVOMOZLQSA-N 1 1 340.445 2.298 20 5 EEBDMO [NH3+]C[C@@H]1CN(C/C=C/c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414780880 313086516 /nfs/dbraw/zinc/08/65/16/313086516.db2.gz MCFQOWUAFCSWIU-LLCTXKFZSA-N 1 1 331.416 2.295 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@@H](C)C[C@H](CO)C2)cccc1[N+](=O)[O-] ZINC000420934776 314001066 /nfs/dbraw/zinc/00/10/66/314001066.db2.gz HFCHREDKOLBABJ-UBHSHLNASA-N 1 1 335.404 2.181 20 5 EEBDMO C[N@H+]1CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425389838 314384730 /nfs/dbraw/zinc/38/47/30/314384730.db2.gz ZTOMGQZTJBGQRP-UHFFFAOYSA-N 1 1 328.210 2.495 20 5 EEBDMO CC(C)[C@H](C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])N1CCN(C)CC1 ZINC000449075314 315412920 /nfs/dbraw/zinc/41/29/20/315412920.db2.gz MQJLSMKCDVLQCH-APWZRJJASA-N 1 1 348.491 2.387 20 5 EEBDMO CCN1CCN([C@@H](C)C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449080238 315413365 /nfs/dbraw/zinc/41/33/65/315413365.db2.gz UNEFGRRWUMAOOM-HOTGVXAUSA-N 1 1 334.464 2.141 20 5 EEBDMO O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000524137624 317008392 /nfs/dbraw/zinc/00/83/92/317008392.db2.gz GOXFZPNFFLYQNX-AWEZNQCLSA-N 1 1 332.404 2.411 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)CCCn2ccnc2)cccc1[N+](=O)[O-] ZINC000181094849 323339501 /nfs/dbraw/zinc/33/95/01/323339501.db2.gz SNDXMXQIGHRNJP-CQSZACIVSA-N 1 1 345.403 2.449 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000354577947 465034765 /nfs/dbraw/zinc/03/47/65/465034765.db2.gz PTRRRFAHDUWZDW-OCCSQVGLSA-N 1 1 341.433 2.088 20 5 EEBDMO CN(C)C(=O)NCC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339061725 465059951 /nfs/dbraw/zinc/05/99/51/465059951.db2.gz PWZAUCJWPCIHPQ-UHFFFAOYSA-N 1 1 348.325 2.317 20 5 EEBDMO CN(C)C(=O)NCC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339061725 465059956 /nfs/dbraw/zinc/05/99/56/465059956.db2.gz PWZAUCJWPCIHPQ-UHFFFAOYSA-N 1 1 348.325 2.317 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H](C)[NH+]1C ZINC000358702838 465274887 /nfs/dbraw/zinc/27/48/87/465274887.db2.gz GDVXGKSLWALXKV-NXEZZACHSA-N 1 1 343.330 2.361 20 5 EEBDMO CCc1[nH+]ccn1[C@H]1CCCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1 ZINC000342247638 465304485 /nfs/dbraw/zinc/30/44/85/465304485.db2.gz VALHQNOITPKESE-LBPRGKRZSA-N 1 1 343.387 2.294 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)NCCC[N@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000298363832 465375976 /nfs/dbraw/zinc/37/59/76/465375976.db2.gz BTWAMIFKKYODQJ-UHFFFAOYSA-N 1 1 338.364 2.272 20 5 EEBDMO C[C@@H]1CN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+](C2CC2)C1 ZINC000590654450 468296830 /nfs/dbraw/zinc/29/68/30/468296830.db2.gz AESMNUCZHPYXTK-CYBMUJFWSA-N 1 1 347.415 2.282 20 5 EEBDMO Cn1ccnc1[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000552044246 468302469 /nfs/dbraw/zinc/30/24/69/468302469.db2.gz WUCXWXOGVZHQMA-PBHICJAKSA-N 1 1 343.431 2.349 20 5 EEBDMO CC[N@@H+](C)CCNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000112926547 462555682 /nfs/dbraw/zinc/55/56/82/462555682.db2.gz NWJIDDVTDJSKQS-JTQLQIEISA-N 1 1 329.784 2.083 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087086232 462588337 /nfs/dbraw/zinc/58/83/37/462588337.db2.gz SLYCTGBKJABPAU-DLBZAZTESA-N 1 1 344.415 2.289 20 5 EEBDMO CC[C@@H](C[NH+]1CCCC1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000590690355 468308143 /nfs/dbraw/zinc/30/81/43/468308143.db2.gz PEDMQFGKAYAQIL-LBPRGKRZSA-N 1 1 341.433 2.285 20 5 EEBDMO CC[C@@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000114459768 462649548 /nfs/dbraw/zinc/64/95/48/462649548.db2.gz LJKHTMMYKCKDEQ-DZGCQCFKSA-N 1 1 335.404 2.467 20 5 EEBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000114459768 462649553 /nfs/dbraw/zinc/64/95/53/462649553.db2.gz LJKHTMMYKCKDEQ-DZGCQCFKSA-N 1 1 335.404 2.467 20 5 EEBDMO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 ZINC000075901207 462773054 /nfs/dbraw/zinc/77/30/54/462773054.db2.gz DBZAEFXEXNRKOT-HACGYAERSA-N 1 1 348.378 2.374 20 5 EEBDMO O=[N+]([O-])c1ccc(OCC[NH+]2CCN(c3nccs3)CC2)cc1 ZINC000065532438 462790716 /nfs/dbraw/zinc/79/07/16/462790716.db2.gz CLPHTCAKHOTUTH-UHFFFAOYSA-N 1 1 334.401 2.252 20 5 EEBDMO COc1ccc(C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C2CC2)cc1 ZINC000090511468 462794588 /nfs/dbraw/zinc/79/45/88/462794588.db2.gz GNTOJQRJFRIMLG-UHFFFAOYSA-N 1 1 343.383 2.430 20 5 EEBDMO C[C@H]1CN(C)c2ccccc2C[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090552036 462797858 /nfs/dbraw/zinc/79/78/58/462797858.db2.gz WTPYUDAUWTXHAR-AWEZNQCLSA-N 1 1 342.399 2.097 20 5 EEBDMO CC(C)CO[C@@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000119651442 462919900 /nfs/dbraw/zinc/91/99/00/462919900.db2.gz XMBAQGXRHVCETD-MRXNPFEDSA-N 1 1 347.415 2.231 20 5 EEBDMO CC(C)CO[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000119651442 462919905 /nfs/dbraw/zinc/91/99/05/462919905.db2.gz XMBAQGXRHVCETD-MRXNPFEDSA-N 1 1 347.415 2.231 20 5 EEBDMO CC[NH+]1CCN([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000066696920 462922035 /nfs/dbraw/zinc/92/20/35/462922035.db2.gz IWSAEYCCJWNDPU-GFCCVEGCSA-N 1 1 331.376 2.343 20 5 EEBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](Cc2ccc3c(c2)CCO3)CC1 ZINC000015141388 462943249 /nfs/dbraw/zinc/94/32/49/462943249.db2.gz XACHYLYRPKNAPQ-UHFFFAOYSA-N 1 1 340.383 2.247 20 5 EEBDMO COC(=O)[C@@H]1CCC[C@@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000590753651 468327490 /nfs/dbraw/zinc/32/74/90/468327490.db2.gz SRJSLHFIPIGEBV-OLZOCXBDSA-N 1 1 346.343 2.076 20 5 EEBDMO CC[NH+]1CCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000120875079 463048551 /nfs/dbraw/zinc/04/85/51/463048551.db2.gz JJEAEYUEMUXIPF-UHFFFAOYSA-N 1 1 334.420 2.265 20 5 EEBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000157323928 463119701 /nfs/dbraw/zinc/11/97/01/463119701.db2.gz NYSWTIROMMZDQL-CJNGLKHVSA-N 1 1 335.379 2.219 20 5 EEBDMO CSC[C@@H]1CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000135424368 463154115 /nfs/dbraw/zinc/15/41/15/463154115.db2.gz JDXLXFYUBZQJBZ-AWEZNQCLSA-N 1 1 335.429 2.311 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCc1ccncc1 ZINC000121553394 463156548 /nfs/dbraw/zinc/15/65/48/463156548.db2.gz DKBXPOGSLGZLQO-UHFFFAOYSA-N 1 1 328.372 2.411 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCc1ccncc1 ZINC000121553394 463156549 /nfs/dbraw/zinc/15/65/49/463156549.db2.gz DKBXPOGSLGZLQO-UHFFFAOYSA-N 1 1 328.372 2.411 20 5 EEBDMO CC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000158344438 463228411 /nfs/dbraw/zinc/22/84/11/463228411.db2.gz TUQWIWFKLBQBHR-UHFFFAOYSA-N 1 1 342.193 2.135 20 5 EEBDMO CCC(CC)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)[NH+]1CCOCC1 ZINC000029208183 463247206 /nfs/dbraw/zinc/24/72/06/463247206.db2.gz WTBSRHLMDKULPC-QGZVFWFLSA-N 1 1 349.431 2.462 20 5 EEBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000054646776 463250947 /nfs/dbraw/zinc/25/09/47/463250947.db2.gz SMSJFOKAOBUTTC-HZPDHXFCSA-N 1 1 332.404 2.063 20 5 EEBDMO C[N@@H+]1CCCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC1 ZINC000097024310 463305688 /nfs/dbraw/zinc/30/56/88/463305688.db2.gz PGQAKWQILNXCDT-UHFFFAOYSA-N 1 1 349.434 2.319 20 5 EEBDMO C[N@H+]1CCCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC1 ZINC000097024310 463305691 /nfs/dbraw/zinc/30/56/91/463305691.db2.gz PGQAKWQILNXCDT-UHFFFAOYSA-N 1 1 349.434 2.319 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)c1 ZINC000072580387 463522605 /nfs/dbraw/zinc/52/26/05/463522605.db2.gz FEWPZFYUOHIHOG-AEFFLSMTSA-N 1 1 342.399 2.304 20 5 EEBDMO CC(C)OCC[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000072731896 463541842 /nfs/dbraw/zinc/54/18/42/463541842.db2.gz IVEBDELXADQFRU-UHFFFAOYSA-N 1 1 336.392 2.169 20 5 EEBDMO CC1(C)C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CCS1 ZINC000083416563 463544798 /nfs/dbraw/zinc/54/47/98/463544798.db2.gz CNWOJESKMQFCFS-UHFFFAOYSA-N 1 1 335.429 2.311 20 5 EEBDMO CC1(C)C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CCS1 ZINC000083416563 463544801 /nfs/dbraw/zinc/54/48/01/463544801.db2.gz CNWOJESKMQFCFS-UHFFFAOYSA-N 1 1 335.429 2.311 20 5 EEBDMO C[C@@H](NC(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000108559065 463615300 /nfs/dbraw/zinc/61/53/00/463615300.db2.gz PXTANXFWUVWGNM-IUODEOHRSA-N 1 1 332.404 2.439 20 5 EEBDMO 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CC[C@@H]1CN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000255051209 465023527 /nfs/dbraw/zinc/02/35/27/465023527.db2.gz BIMPXFORJKVIFX-XITLMJRVSA-N 1 1 347.415 2.177 20 5 EEBDMO COc1cc(C(=O)NCCC[N@@H+](C)C(C)C)c([N+](=O)[O-])cc1OC ZINC000298373133 465377572 /nfs/dbraw/zinc/37/75/72/465377572.db2.gz FQBKQVRFAJTPSX-UHFFFAOYSA-N 1 1 339.392 2.072 20 5 EEBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000337551012 465428706 /nfs/dbraw/zinc/42/87/06/465428706.db2.gz PNKUTVAYDVCMMN-HUUCEWRRSA-N 1 1 332.404 2.363 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000362289378 465634817 /nfs/dbraw/zinc/63/48/17/465634817.db2.gz VWGDZYMXVIESNK-UHFFFAOYSA-N 1 1 335.404 2.306 20 5 EEBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC[C@H]1C[NH+]1CCCC1 ZINC000299536878 465789832 /nfs/dbraw/zinc/78/98/32/465789832.db2.gz ODSPSMMXHUOWBK-ZDUSSCGKSA-N 1 1 343.387 2.172 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000366825152 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C[C@H](Nc1ncnc2cccc([N+](=O)[O-])c21)[C@H](C)[NH+]1CCOCC1 ZINC000347402217 466613553 /nfs/dbraw/zinc/61/35/53/466613553.db2.gz FWDYYCXSAPJKQJ-RYUDHWBXSA-N 1 1 331.376 2.059 20 5 EEBDMO CC1(C)CCC[N@@H+](CCNC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000347433372 466629825 /nfs/dbraw/zinc/62/98/25/466629825.db2.gz QALDCDWXTMFNEM-UHFFFAOYSA-N 1 1 335.404 2.212 20 5 EEBDMO O=[N+]([O-])c1ccc2nc(NC[C@@H]3C[N@H+]4CCC[C@@H]4CO3)ccc2c1 ZINC000325191079 466654702 /nfs/dbraw/zinc/65/47/02/466654702.db2.gz AAZOSVXHIIEIEC-HUUCEWRRSA-N 1 1 328.372 2.418 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@H](n3ncc4ccccc43)C2)c1 ZINC000374727105 466726830 /nfs/dbraw/zinc/72/68/30/466726830.db2.gz AXOFZXZOMZGKJG-CQSZACIVSA-N 1 1 326.360 2.088 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@](O)(C3CC3)C2)cccc1[N+](=O)[O-] ZINC000373280315 466751680 /nfs/dbraw/zinc/75/16/80/466751680.db2.gz WUWIPRHYYJCLNE-PXAZEXFGSA-N 1 1 333.388 2.077 20 5 EEBDMO C[C@H]1CC[C@H]([N@@H+](CCO)CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000411638760 466862194 /nfs/dbraw/zinc/86/21/94/466862194.db2.gz DZENQIKUFWSLAY-KBPBESRZSA-N 1 1 335.404 2.406 20 5 EEBDMO CCN1C[C@@H](C)[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000411726126 466888089 /nfs/dbraw/zinc/88/80/89/466888089.db2.gz XMMWKMCWUUMFOL-ZIAGYGMSSA-N 1 1 334.420 2.338 20 5 EEBDMO O=C(CC[N@H+]1CC[C@H](n2cccn2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000365829680 466954147 /nfs/dbraw/zinc/95/41/47/466954147.db2.gz HNLFXYCLTJEJKO-HNNXBMFYSA-N 1 1 329.360 2.067 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000424285022 467022507 /nfs/dbraw/zinc/02/25/07/467022507.db2.gz DWZXEFLMZFRQOP-AWEZNQCLSA-N 1 1 346.431 2.306 20 5 EEBDMO O=[N+]([O-])c1cnc(NC[C@@H]2CCC[N@@H+]2CCCO)c(C(F)(F)F)c1 ZINC000413323896 467216507 /nfs/dbraw/zinc/21/65/07/467216507.db2.gz ISYVZLSZYUUDOM-JTQLQIEISA-N 1 1 348.325 2.267 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](O)C12CCCC2 ZINC000433300162 467315900 /nfs/dbraw/zinc/31/59/00/467315900.db2.gz SGRBFNCFGLWRAI-AWEZNQCLSA-N 1 1 333.388 2.221 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](O)C12CCCC2 ZINC000433300162 467315901 /nfs/dbraw/zinc/31/59/01/467315901.db2.gz SGRBFNCFGLWRAI-AWEZNQCLSA-N 1 1 333.388 2.221 20 5 EEBDMO CN(CC(F)(F)F)C(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429267861 467317929 /nfs/dbraw/zinc/31/79/29/467317929.db2.gz ZUVSXHQBZVNGGA-UHFFFAOYSA-N 1 1 333.310 2.440 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H]1[C@@H](C)CCN[C@H]1C ZINC000420369812 467381408 /nfs/dbraw/zinc/38/14/08/467381408.db2.gz ONPGVSATWXDJMH-PLQHRBFRSA-N 1 1 334.420 2.208 20 5 EEBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1c(C(N)=O)cccc1[N+](=O)[O-] ZINC000420581058 467428417 /nfs/dbraw/zinc/42/84/17/467428417.db2.gz GNESQZUYBLGGTG-XQQFMLRXSA-N 1 1 334.420 2.472 20 5 EEBDMO CCN1CCC([N@@H+]2CCCN(c3ncc(C)cc3[N+](=O)[O-])CC2)CC1 ZINC000420631594 467438507 /nfs/dbraw/zinc/43/85/07/467438507.db2.gz VLIBYLCELZWHQG-UHFFFAOYSA-N 1 1 347.463 2.295 20 5 EEBDMO CCN1CCC([N@H+]2CCCN(c3ncc(C)cc3[N+](=O)[O-])CC2)CC1 ZINC000420631594 467438510 /nfs/dbraw/zinc/43/85/10/467438510.db2.gz VLIBYLCELZWHQG-UHFFFAOYSA-N 1 1 347.463 2.295 20 5 EEBDMO Cc1nn(C)c(C(=O)N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000408013941 467495935 /nfs/dbraw/zinc/49/59/35/467495935.db2.gz ZFEVPALAKZQBPN-MBNYWOFBSA-N 1 1 349.435 2.114 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000449565745 467663089 /nfs/dbraw/zinc/66/30/89/467663089.db2.gz KQDBIKIQRHXKBE-HNNXBMFYSA-N 1 1 335.404 2.377 20 5 EEBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000458565934 467858588 /nfs/dbraw/zinc/85/85/88/467858588.db2.gz BQBRVQZWCOIHDA-OAHLLOKOSA-N 1 1 334.420 2.263 20 5 EEBDMO CN(C(=O)C[N@@H+]1CC[C@H](c2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000517832818 468099564 /nfs/dbraw/zinc/09/95/64/468099564.db2.gz MMGZRECSOPHBOE-HNNXBMFYSA-N 1 1 340.383 2.442 20 5 EEBDMO CN(C(=O)C[N@H+]1CC[C@H](c2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000517832818 468099566 /nfs/dbraw/zinc/09/95/66/468099566.db2.gz MMGZRECSOPHBOE-HNNXBMFYSA-N 1 1 340.383 2.442 20 5 EEBDMO Cc1[nH]nc(C(=O)N(CC[NH+]2CCCCCC2)C2CCC2)c1[N+](=O)[O-] ZINC000488877528 468109901 /nfs/dbraw/zinc/10/99/01/468109901.db2.gz KJMGUEASQRKHFY-UHFFFAOYSA-N 1 1 349.435 2.497 20 5 EEBDMO NC(=O)C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590183052 468222210 /nfs/dbraw/zinc/22/22/10/468222210.db2.gz RGSPEHNHGFEXGQ-VIFPVBQESA-N 1 1 331.294 2.311 20 5 EEBDMO O=C(NCc1c[nH+]c2n1CCCC2)NCc1cccc([N+](=O)[O-])c1 ZINC000551218129 468234426 /nfs/dbraw/zinc/23/44/26/468234426.db2.gz GCPACALBWBEUIH-UHFFFAOYSA-N 1 1 329.360 2.127 20 5 EEBDMO O=C(NCc1c[nH+]c2n1CCCC2)NCc1ccccc1[N+](=O)[O-] ZINC000551217208 468234744 /nfs/dbraw/zinc/23/47/44/468234744.db2.gz NUJCAKLUYZLMCX-UHFFFAOYSA-N 1 1 329.360 2.127 20 5 EEBDMO CN(CC(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccccc1[N+](=O)[O-] ZINC000594194935 468507842 /nfs/dbraw/zinc/50/78/42/468507842.db2.gz BGCMRASWHURTNS-GJZGRUSLSA-N 1 1 346.431 2.164 20 5 EEBDMO O=C(CCN[C@@H]1CC[N@@H+]2CCC[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000591726555 468511252 /nfs/dbraw/zinc/51/12/52/468511252.db2.gz MRTYLJKKDVPPAB-KGLIPLIRSA-N 1 1 332.404 2.140 20 5 EEBDMO O=C(CCN[C@@H]1CC[N@H+]2CCC[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000591726555 468511254 /nfs/dbraw/zinc/51/12/54/468511254.db2.gz MRTYLJKKDVPPAB-KGLIPLIRSA-N 1 1 332.404 2.140 20 5 EEBDMO CC(C)[N@H+]1CCCC[C@@H]1CN1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000556193034 468514502 /nfs/dbraw/zinc/51/45/02/468514502.db2.gz NJPAFQPTQXUYQE-QGZVFWFLSA-N 1 1 347.463 2.375 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000597855045 468694507 /nfs/dbraw/zinc/69/45/07/468694507.db2.gz PWCYSOWZHQGWFX-LLVKDONJSA-N 1 1 345.403 2.321 20 5 EEBDMO CC(C)(C)[N@@H+]1CC[C@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000597855045 468694509 /nfs/dbraw/zinc/69/45/09/468694509.db2.gz PWCYSOWZHQGWFX-LLVKDONJSA-N 1 1 345.403 2.321 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000597855045 468694510 /nfs/dbraw/zinc/69/45/10/468694510.db2.gz PWCYSOWZHQGWFX-LLVKDONJSA-N 1 1 345.403 2.321 20 5 EEBDMO C[C@@H]([NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C1(CO)CC1 ZINC000595071469 468752815 /nfs/dbraw/zinc/75/28/15/468752815.db2.gz ZUXDJAICJHBWCU-DOMZBBRYSA-N 1 1 330.388 2.168 20 5 EEBDMO COc1cc(C(=O)NC[C@@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000560093032 468767319 /nfs/dbraw/zinc/76/73/19/468767319.db2.gz AEFGGDNWKYZHMV-NSHDSACASA-N 1 1 339.367 2.203 20 5 EEBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595444733 468855569 /nfs/dbraw/zinc/85/55/69/468855569.db2.gz CWEKIMQEOQYXKR-JTQLQIEISA-N 1 1 349.284 2.234 20 5 EEBDMO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000595462721 468862402 /nfs/dbraw/zinc/86/24/02/468862402.db2.gz WTMVIJLALBNXSE-HNNXBMFYSA-N 1 1 325.365 2.302 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000595472321 468866522 /nfs/dbraw/zinc/86/65/22/468866522.db2.gz KXCLCJPMMIGCID-MRXNPFEDSA-N 1 1 349.431 2.290 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000595472321 468866525 /nfs/dbraw/zinc/86/65/25/468866525.db2.gz KXCLCJPMMIGCID-MRXNPFEDSA-N 1 1 349.431 2.290 20 5 EEBDMO O=C(COc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598562561 468914323 /nfs/dbraw/zinc/91/43/23/468914323.db2.gz WPKUXTQEBUTUHC-HNNXBMFYSA-N 1 1 347.415 2.212 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](C)[C@@H](CO)C1 ZINC000598650912 468946008 /nfs/dbraw/zinc/94/60/08/468946008.db2.gz QCLXDWLNKIMUHM-GXTWGEPZSA-N 1 1 335.404 2.182 20 5 EEBDMO COc1ccc(CC(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000572544352 468948590 /nfs/dbraw/zinc/94/85/90/468948590.db2.gz IMDSLQYDCKYTRM-OAHLLOKOSA-N 1 1 347.415 2.279 20 5 EEBDMO CCOc1cncc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000598673884 468955175 /nfs/dbraw/zinc/95/51/75/468955175.db2.gz RYITVHFJGIXHJI-AWEZNQCLSA-N 1 1 343.387 2.470 20 5 EEBDMO CCOc1cncc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000598673884 468955183 /nfs/dbraw/zinc/95/51/83/468955183.db2.gz RYITVHFJGIXHJI-AWEZNQCLSA-N 1 1 343.387 2.470 20 5 EEBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1COCCO1 ZINC000595738024 468979764 /nfs/dbraw/zinc/97/97/64/468979764.db2.gz UYDIWRGEEUAJDN-GFCCVEGCSA-N 1 1 334.294 2.461 20 5 EEBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1COCCO1 ZINC000595738024 468979771 /nfs/dbraw/zinc/97/97/71/468979771.db2.gz UYDIWRGEEUAJDN-GFCCVEGCSA-N 1 1 334.294 2.461 20 5 EEBDMO Cc1ccc(NCCCNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])[nH+]c1 ZINC000593506000 469008430 /nfs/dbraw/zinc/00/84/30/469008430.db2.gz XJNHRCOYDKULPU-UHFFFAOYSA-N 1 1 346.362 2.598 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[NH+]1CC(c2nc3ccccc3[nH]2)C1 ZINC000602794082 469079291 /nfs/dbraw/zinc/07/92/91/469079291.db2.gz FTNAIVAEGCIHSE-UHFFFAOYSA-N 1 1 326.360 2.075 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](NCC[N@H+]2CC[C@@H](O)C2)c2ccccc2)c1 ZINC000599085325 469111643 /nfs/dbraw/zinc/11/16/43/469111643.db2.gz POYRLVXEZBOXGG-MOPGFXCFSA-N 1 1 341.411 2.340 20 5 EEBDMO C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@@H](c2ccccc2)C1 ZINC000596062877 469133756 /nfs/dbraw/zinc/13/37/56/469133756.db2.gz SQJWTHDEJMYWDO-QGZVFWFLSA-N 1 1 340.383 2.187 20 5 EEBDMO CC(C)NC(=O)c1ccc(N[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000596087187 469148717 /nfs/dbraw/zinc/14/87/17/469148717.db2.gz GFSXFCQXMTXAAD-CYBMUJFWSA-N 1 1 332.404 2.382 20 5 EEBDMO C[N@@H+](CCc1ccccc1)CC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000602083478 469179814 /nfs/dbraw/zinc/17/98/14/469179814.db2.gz AXLPRDTWMPEPNP-UHFFFAOYSA-N 1 1 327.384 2.386 20 5 EEBDMO Cn1cc(C[N@H+](C)Cc2cn[nH]c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000611271906 469216654 /nfs/dbraw/zinc/21/66/54/469216654.db2.gz JOAZFXUCEARFSS-UHFFFAOYSA-N 1 1 326.360 2.350 20 5 EEBDMO Cn1cc(C[N@@H+](C)Cc2cn[nH]c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000611271906 469216659 /nfs/dbraw/zinc/21/66/59/469216659.db2.gz JOAZFXUCEARFSS-UHFFFAOYSA-N 1 1 326.360 2.350 20 5 EEBDMO COCCC1CC[NH+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000599506495 469279694 /nfs/dbraw/zinc/27/96/94/469279694.db2.gz DODJXSUAOAFELD-UHFFFAOYSA-N 1 1 347.415 2.232 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+][C@H]1CC[C@H](O)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000611560808 469279761 /nfs/dbraw/zinc/27/97/61/469279761.db2.gz BLVYBAZFJNEGOU-FVQBIDKESA-N 1 1 330.388 2.311 20 5 EEBDMO CCN1CCC[C@@H](C[NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C1 ZINC000602525077 469349832 /nfs/dbraw/zinc/34/98/32/469349832.db2.gz QFXHBONFDNIQRC-HNNXBMFYSA-N 1 1 347.463 2.280 20 5 EEBDMO CCc1nn(C)c(N(C)CCC[N@@H+](C)Cc2ccncc2)c1[N+](=O)[O-] ZINC000603399693 469377769 /nfs/dbraw/zinc/37/77/69/469377769.db2.gz ICQCPKMQFSGVFL-UHFFFAOYSA-N 1 1 346.435 2.244 20 5 EEBDMO CNc1ccc(C(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000603671244 469422472 /nfs/dbraw/zinc/42/24/72/469422472.db2.gz 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ZINC001165125295 1321459777 /nfs/dbraw/zinc/45/97/77/1321459777.db2.gz VTBDEXYDDOJMQC-UHFFFAOYSA-N 1 1 325.372 2.015 20 5 EEBDMO C[N@@H+](C1CN(c2ccc3ccc([N+](=O)[O-])cc3n2)C1)[C@@H]1CCOC1 ZINC001165204114 1321471618 /nfs/dbraw/zinc/47/16/18/1321471618.db2.gz UHFKIQLGWFCZFW-CQSZACIVSA-N 1 1 328.372 2.052 20 5 EEBDMO Cc1[nH+]cc2n1C[C@H](C(=O)N1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001327284208 1334259237 /nfs/dbraw/zinc/25/92/37/1334259237.db2.gz UIBMFJVPPXIRNX-CYBMUJFWSA-N 1 1 326.356 2.205 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)nc1-c1ccccn1 ZINC001330042656 1334767211 /nfs/dbraw/zinc/76/72/11/1334767211.db2.gz NDOJFROBSFVJEV-XJKSGUPXSA-N 1 1 343.387 2.312 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)nc1-c1ccccn1 ZINC001330042656 1334767213 /nfs/dbraw/zinc/76/72/13/1334767213.db2.gz NDOJFROBSFVJEV-XJKSGUPXSA-N 1 1 343.387 2.312 20 5 EEBDMO Cn1c2ccccc2c(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1=O ZINC001333630856 1336091672 /nfs/dbraw/zinc/09/16/72/1336091672.db2.gz XEFFXTOEDMHQPL-OLZOCXBDSA-N 1 1 342.399 2.485 20 5 EEBDMO COC(=O)CC(C)(C)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001335183773 1336345870 /nfs/dbraw/zinc/34/58/70/1336345870.db2.gz XKQBWPMOBUDOOE-UHFFFAOYSA-N 1 1 348.359 2.418 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC001589714976 1349022929 /nfs/dbraw/zinc/02/29/29/1349022929.db2.gz OVLXQUYJGDCWFX-LBPRGKRZSA-N 1 1 345.407 2.307 20 5 EEBDMO C[C@H](CNc1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1 ZINC001590258861 1349232543 /nfs/dbraw/zinc/23/25/43/1349232543.db2.gz CXBJASLWGPTXKM-VXGBXAGGSA-N 1 1 345.407 2.307 20 5 EEBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CCS1 ZINC001590273132 1349243848 /nfs/dbraw/zinc/24/38/48/1349243848.db2.gz VFUNGJJXELXRIR-SNVBAGLBSA-N 1 1 334.405 2.102 20 5 EEBDMO CC1(C)C[NH+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])CC(C)(C)O1 ZINC001603785838 1350767584 /nfs/dbraw/zinc/76/75/84/1350767584.db2.gz OLSLRTCEXPOJJI-UHFFFAOYSA-N 1 1 346.391 2.164 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001603897183 1350797424 /nfs/dbraw/zinc/79/74/24/1350797424.db2.gz CXNYTTGRYYUUCF-RYUDHWBXSA-N 1 1 345.407 2.307 20 5 EEBDMO O=C1NCC2(CC[NH+](Cc3ccc([N+](=O)[O-])cc3Cl)CC2)O1 ZINC000781992443 1371258556 /nfs/dbraw/zinc/25/85/56/1371258556.db2.gz JPUADDYJYNHIEM-UHFFFAOYSA-N 1 1 325.752 2.323 20 5 EEBDMO COC(C)(C)C[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000782511523 1371304891 /nfs/dbraw/zinc/30/48/91/1371304891.db2.gz XLHLBDNEFNMMDQ-UHFFFAOYSA-N 1 1 327.356 2.419 20 5 EEBDMO C[C@@]([NH3+])(C(=O)N1CCc2ccsc2C1)c1cccc([N+](=O)[O-])c1 ZINC001122105889 1371946487 /nfs/dbraw/zinc/94/64/87/1371946487.db2.gz ZDXKUVYDAKIIKD-INIZCTEOSA-N 1 1 331.397 2.415 20 5 EEBDMO O=C(CC(F)(F)F)NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001754100121 1406842017 /nfs/dbraw/zinc/84/20/17/1406842017.db2.gz QDRDSJUIWDHQOA-UPHRSURJSA-N 1 1 337.323 2.371 20 5 EEBDMO COC(=O)[C@@]1(C)CC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000179548705 774053281 /nfs/dbraw/zinc/05/32/81/774053281.db2.gz AHUFDRKDJKKOLG-INIZCTEOSA-N 1 1 332.360 2.095 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NCC1=CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC001127655020 777661820 /nfs/dbraw/zinc/66/18/20/777661820.db2.gz ZSVPWZYSHLMLSG-UHFFFAOYSA-N 1 1 346.431 2.188 20 5 EEBDMO Cc1nc(C(=O)NCC2C[NH+](Cc3ccccc3[N+](=O)[O-])C2)cs1 ZINC001031920612 779704009 /nfs/dbraw/zinc/70/40/09/779704009.db2.gz NKCHSMOCBONJFR-UHFFFAOYSA-N 1 1 346.412 2.222 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C[NH+](CC3=CCCCC3)C2)CC1 ZINC001035704172 784984997 /nfs/dbraw/zinc/98/49/97/784984997.db2.gz FRUMZJQALRKSAG-HZPDHXFCSA-N 1 1 333.432 2.076 20 5 EEBDMO COCC(C)(C)[NH+]1CCN(c2ccc(C(C)=O)cc2[N+](=O)[O-])CC1 ZINC000819944231 785734972 /nfs/dbraw/zinc/73/49/72/785734972.db2.gz XNAVXFYUQWYVIQ-UHFFFAOYSA-N 1 1 335.404 2.344 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)N(C)CCCNc1ccccc1[N+](=O)[O-] ZINC001109564971 805687634 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348.447 2.284 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCO[C@@H]3C[C@@H](CO)C[C@H]31)CC2 ZINC001172903916 797131173 /nfs/dbraw/zinc/13/11/73/797131173.db2.gz JPBWNKYBVUSKMW-UONJOCPKSA-N 1 1 346.427 2.314 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCn3nccc3C2)c1F ZINC001173192890 797282581 /nfs/dbraw/zinc/28/25/81/797282581.db2.gz NHLKIPZQURFHLT-LLVKDONJSA-N 1 1 334.351 2.386 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCn3nccc3C2)c1F ZINC001173192890 797282583 /nfs/dbraw/zinc/28/25/83/797282583.db2.gz NHLKIPZQURFHLT-LLVKDONJSA-N 1 1 334.351 2.386 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NCC1(Nc2nccc(C)c2[N+](=O)[O-])CC1 ZINC001110191466 798281714 /nfs/dbraw/zinc/28/17/14/798281714.db2.gz UTPCMCHZADWCPE-UHFFFAOYSA-N 1 1 349.435 2.091 20 5 EEBDMO Cc1ccc(C[NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1C ZINC001002789602 798599017 /nfs/dbraw/zinc/59/90/17/798599017.db2.gz VCGOWHPNTQZXQE-IAGOWNOFSA-N 1 1 331.416 2.049 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CCC[NH2+]CCCF)CC1CCCC1 ZINC001177313923 798854246 /nfs/dbraw/zinc/85/42/46/798854246.db2.gz WFEVHCPWOGDFKG-HUUCEWRRSA-N 1 1 329.416 2.010 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[C@H]2C[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@H]21 ZINC001169012492 803571454 /nfs/dbraw/zinc/57/14/54/803571454.db2.gz QOIZOCFUGXGGTE-LXTVHRRPSA-N 1 1 339.436 2.373 20 5 EEBDMO CC(C)OCc1ncn2c1C[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)CCC2 ZINC001169027408 803575142 /nfs/dbraw/zinc/57/51/42/803575142.db2.gz PIPJDLATMIMXTN-CABCVRRESA-N 1 1 336.436 2.459 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@]3(C[C@H](Oc4ccccn4)CO3)C2)C1 ZINC001169025150 803590493 /nfs/dbraw/zinc/59/04/93/803590493.db2.gz SNIMZVFJFUTYAS-CVYDXHPNSA-N 1 1 347.415 2.139 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@@H+]2CCN(C(C)=O)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001170355024 809903115 /nfs/dbraw/zinc/90/31/15/809903115.db2.gz UWPGQBFLCGSLFS-CHWSQXEVSA-N 1 1 335.404 2.087 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@H+]2CCN(C(C)=O)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001170355024 809903116 /nfs/dbraw/zinc/90/31/16/809903116.db2.gz UWPGQBFLCGSLFS-CHWSQXEVSA-N 1 1 335.404 2.087 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@]3(CCNC3=O)C2)c([N+](=O)[O-])c1 ZINC001170340465 809914425 /nfs/dbraw/zinc/91/44/25/809914425.db2.gz LWNHHNVVQPFUMJ-SCLBCKFNSA-N 1 1 347.415 2.137 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3nn(C)cc3C2)c([N+](=O)[O-])c1 ZINC001170344574 809916152 /nfs/dbraw/zinc/91/61/52/809916152.db2.gz CGTONONXIQBPNQ-LBPRGKRZSA-N 1 1 330.388 2.326 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H](NC(C)=O)C2)c([N+](=O)[O-])c1 ZINC001170346322 809916469 /nfs/dbraw/zinc/91/64/69/809916469.db2.gz NGQSJCPLMRJLQZ-DOMZBBRYSA-N 1 1 335.404 2.135 20 5 EEBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@H](O)c3ncc[nH]3)CC2)c(F)c1 ZINC000793181337 810177532 /nfs/dbraw/zinc/17/75/32/810177532.db2.gz CIFMAFWIMXQHDU-HNNXBMFYSA-N 1 1 334.351 2.403 20 5 EEBDMO CC[NH+]1CCN([C@H](C)CNc2cc([N+](=O)[O-])ccc2C(C)=O)CC1 ZINC000807926490 812388135 /nfs/dbraw/zinc/38/81/35/812388135.db2.gz QVHNMEJMXABDGD-CYBMUJFWSA-N 1 1 334.420 2.235 20 5 EEBDMO CC[C@@]1(CO)CCC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000187554820 529554960 /nfs/dbraw/zinc/55/49/60/529554960.db2.gz RJGIANMRVVTTAD-SUMWQHHRSA-N 1 1 335.404 2.406 20 5 EEBDMO CC[C@@]1(CO)CCC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000187554820 529554963 /nfs/dbraw/zinc/55/49/63/529554963.db2.gz RJGIANMRVVTTAD-SUMWQHHRSA-N 1 1 335.404 2.406 20 5 EEBDMO CCC[N@H+]1CCC[C@@H]1CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000349643462 283336082 /nfs/dbraw/zinc/33/60/82/283336082.db2.gz XRVUGCGEUAMNHR-MRXNPFEDSA-N 1 1 349.435 2.180 20 5 EEBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N)[N@@H+](C)Cc1ccccc1 ZINC000191532917 239170423 /nfs/dbraw/zinc/17/04/23/239170423.db2.gz HNMRKUGRTHJCET-ZDUSSCGKSA-N 1 1 342.399 2.427 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@H+](CC(C)(C)O)C[C@H]1C ZINC000421878882 240041487 /nfs/dbraw/zinc/04/14/87/240041487.db2.gz 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349.435 2.113 20 5 EEBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)[C@H]3C[C@@H]3c3cccc([N+](=O)[O-])c3)[C@@H]2C1 ZINC000823276419 787651759 /nfs/dbraw/zinc/65/17/59/787651759.db2.gz QSGWWHXOKCBNSI-PQEBFOHHSA-N 1 1 329.400 2.251 20 5 EEBDMO Nc1ccc(NC(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000823913725 787978698 /nfs/dbraw/zinc/97/86/98/787978698.db2.gz ANHGWCJCUBHXGD-CYBMUJFWSA-N 1 1 347.419 2.421 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCc3ncn(C)c3C2)c1F ZINC001173191074 797281427 /nfs/dbraw/zinc/28/14/27/797281427.db2.gz ABYHITVPQAMXGX-NSHDSACASA-N 1 1 348.378 2.465 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCc3ncn(C)c3C2)c1F ZINC001173191074 797281430 /nfs/dbraw/zinc/28/14/30/797281430.db2.gz ABYHITVPQAMXGX-NSHDSACASA-N 1 1 348.378 2.465 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](C)CC(OC)OC)c1F ZINC001173197605 797284444 /nfs/dbraw/zinc/28/44/44/797284444.db2.gz VHFCZVCZTSFVCO-SNVBAGLBSA-N 1 1 330.356 2.224 20 5 EEBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(C[C@@H]2CCCO2)CC1 ZINC001173225997 797309994 /nfs/dbraw/zinc/30/99/94/797309994.db2.gz GWROZBXPMIZOOE-YJBOKZPZSA-N 1 1 333.432 2.322 20 5 EEBDMO O=C(NCCCCCC[NH2+]CC=C(Cl)Cl)[C@@H]1CC1[N+](=O)[O-] ZINC001178464477 799487439 /nfs/dbraw/zinc/48/74/39/799487439.db2.gz SUXPXVCEMWKIRW-GHMZBOCLSA-N 1 1 338.235 2.237 20 5 EEBDMO CN(CC1CC[NH+](C)CC1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000103461971 804213412 /nfs/dbraw/zinc/21/34/12/804213412.db2.gz OMZFCHBLOWWSOH-UHFFFAOYSA-N 1 1 344.419 2.084 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H]2C(=O)N(C)C)c([N+](=O)[O-])c1 ZINC001170353155 809901942 /nfs/dbraw/zinc/90/19/42/809901942.db2.gz WUFVKPXKHDYMKQ-WFASDCNBSA-N 1 1 335.404 2.087 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)C(C)(C)[NH+]1CCCC1 ZINC000805611249 811393640 /nfs/dbraw/zinc/39/36/40/811393640.db2.gz VBFXSXHIMUKWNN-UHFFFAOYSA-N 1 1 349.387 2.259 20 5 EEBDMO C[N@H+]1CC[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000159055669 529793706 /nfs/dbraw/zinc/79/37/06/529793706.db2.gz OZEBXLYTHDGQPL-VIFPVBQESA-N 1 1 342.193 2.039 20 5 EEBDMO COc1cc(C[NH+]2CCC3(CC2)OCCO3)c([N+](=O)[O-])cc1F ZINC000184245235 235345352 /nfs/dbraw/zinc/34/53/52/235345352.db2.gz HOQXBSHTHYVSIH-UHFFFAOYSA-N 1 1 326.324 2.081 20 5 EEBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCSC3(CCOCC3)C2)c1 ZINC000186808010 236028617 /nfs/dbraw/zinc/02/86/17/236028617.db2.gz HOKOFFUVHQIQTL-OAHLLOKOSA-N 1 1 338.429 2.226 20 5 EEBDMO CCN1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1=O ZINC000449519990 242554191 /nfs/dbraw/zinc/55/41/91/242554191.db2.gz RMDHQRFUFLBHMR-LBPRGKRZSA-N 1 1 346.412 2.429 20 5 EEBDMO O=C1NC2(CO1)CC[NH+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC2 ZINC000495252500 247100725 /nfs/dbraw/zinc/10/07/25/247100725.db2.gz NJOIAFDHWNLXCP-UHFFFAOYSA-N 1 1 325.752 2.323 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC2(C1)CCOCC2 ZINC000266607924 248381102 /nfs/dbraw/zinc/38/11/02/248381102.db2.gz GQVHIPAMVHTVHQ-ZDUSSCGKSA-N 1 1 333.388 2.424 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1ccccn1 ZINC000181521914 533138425 /nfs/dbraw/zinc/13/84/25/533138425.db2.gz MGVIAMPKPLXJFR-LLVKDONJSA-N 1 1 330.344 2.288 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H]2Cn2cnc3ccccc32)c1 ZINC000270453839 256137074 /nfs/dbraw/zinc/13/70/74/256137074.db2.gz LHRDMXWJCUQDLB-AWEZNQCLSA-N 1 1 340.387 2.306 20 5 EEBDMO CCC1(CO)CC[NH+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000270719500 256163944 /nfs/dbraw/zinc/16/39/44/256163944.db2.gz DEEMGWOOKYJKIY-UHFFFAOYSA-N 1 1 335.404 2.326 20 5 EEBDMO CC(C)OCCOC[C@@H](O)C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000274265313 256368948 /nfs/dbraw/zinc/36/89/48/256368948.db2.gz YIYFMBCPMTYPIS-YOEHRIQHSA-N 1 1 340.420 2.390 20 5 EEBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCO[C@@H]([C@H]3CCCO3)C2)cc1 ZINC000247312007 160319844 /nfs/dbraw/zinc/31/98/44/160319844.db2.gz LZHYKCAVNVMLJP-IAGOWNOFSA-N 1 1 336.388 2.244 20 5 EEBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCO[C@@H]([C@H]3CCCO3)C2)cc1 ZINC000247312007 160319845 /nfs/dbraw/zinc/31/98/45/160319845.db2.gz LZHYKCAVNVMLJP-IAGOWNOFSA-N 1 1 336.388 2.244 20 5 EEBDMO CCOC(=O)CC[N@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000343393723 161131686 /nfs/dbraw/zinc/13/16/86/161131686.db2.gz GBSYOZUWKWTFFM-GFCCVEGCSA-N 1 1 337.376 2.115 20 5 EEBDMO CCOC(=O)CC[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000343393723 161131687 /nfs/dbraw/zinc/13/16/87/161131687.db2.gz GBSYOZUWKWTFFM-GFCCVEGCSA-N 1 1 337.376 2.115 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000352498864 162159474 /nfs/dbraw/zinc/15/94/74/162159474.db2.gz ICCUUNMVQLSYME-AWEZNQCLSA-N 1 1 341.433 2.056 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]CCCn1ccnc1)c1cccc([N+](=O)[O-])c1 ZINC000353441315 162564411 /nfs/dbraw/zinc/56/44/11/162564411.db2.gz MKWKMYCVMXMJHD-MRXNPFEDSA-N 1 1 340.387 2.294 20 5 EEBDMO C[C@H]1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])c(N)c3F)CC2)CCO1 ZINC000356168393 163356771 /nfs/dbraw/zinc/35/67/71/163356771.db2.gz HFZHFSQYHPXSCJ-NSHDSACASA-N 1 1 338.383 2.006 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000360295965 164277740 /nfs/dbraw/zinc/27/77/40/164277740.db2.gz KOQKGLAMUIGLJQ-DZGCQCFKSA-N 1 1 342.399 2.184 20 5 EEBDMO C[C@@H]1C[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000360666064 164360017 /nfs/dbraw/zinc/36/00/17/164360017.db2.gz NLDBRNYKPVKTSY-NXEZZACHSA-N 1 1 347.824 2.009 20 5 EEBDMO O=C(Nc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1 ZINC000363824947 164966231 /nfs/dbraw/zinc/96/62/31/164966231.db2.gz MQDYEMURKVSSAH-HZPDHXFCSA-N 1 1 348.403 2.360 20 5 EEBDMO CCOc1ccc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000374871965 167056984 /nfs/dbraw/zinc/05/69/84/167056984.db2.gz CSBPIKMMBQEDHD-WFASDCNBSA-N 1 1 333.388 2.160 20 5 EEBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000378236330 167646780 /nfs/dbraw/zinc/64/67/80/167646780.db2.gz XLRLFUMDTGQTNY-CQSZACIVSA-N 1 1 343.387 2.075 20 5 EEBDMO Cc1c(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000159631796 225252127 /nfs/dbraw/zinc/25/21/27/225252127.db2.gz HAZUFTATARJHOK-UHFFFAOYSA-N 1 1 349.431 2.334 20 5 EEBDMO COC[C@H](C)[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000274797973 269054252 /nfs/dbraw/zinc/05/42/52/269054252.db2.gz DQTZOGGRXXXCDO-LBPRGKRZSA-N 1 1 333.392 2.018 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NCCCCn1cc[nH+]c1C ZINC000277627481 269165109 /nfs/dbraw/zinc/16/51/09/269165109.db2.gz RSOCEIUOUHIXBD-UHFFFAOYSA-N 1 1 332.360 2.319 20 5 EEBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](c2cnn(C)c2)[C@H](CO)C1 ZINC000277801733 269184886 /nfs/dbraw/zinc/18/48/86/269184886.db2.gz PLWBSLNAVOKEPG-NUTKFTJISA-N 1 1 330.388 2.097 20 5 EEBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1CCOc1ccc([N+](=O)[O-])cc1 ZINC000278959983 269253434 /nfs/dbraw/zinc/25/34/34/269253434.db2.gz ZZXPXMVPLKKLKF-HNNXBMFYSA-N 1 1 349.431 2.159 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@H]1C ZINC000105790507 274271387 /nfs/dbraw/zinc/27/13/87/274271387.db2.gz QTBCGCZMFNVABI-CHWSQXEVSA-N 1 1 330.388 2.034 20 5 EEBDMO C[N@H+]1CC[C@@H]2OCCN(Cc3c(Cl)cccc3[N+](=O)[O-])[C@@H]2C1 ZINC000344980743 277153688 /nfs/dbraw/zinc/15/36/88/277153688.db2.gz WLYGBNMQVPYTOJ-CABCVRRESA-N 1 1 325.796 2.153 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CCO)[C@H]1CC[C@@H](C)C1 ZINC000351652863 281261146 /nfs/dbraw/zinc/26/11/46/281261146.db2.gz SZUHAFXCNXQOLT-OCCSQVGLSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000293753720 293287348 /nfs/dbraw/zinc/28/73/48/293287348.db2.gz SUVTXZAQYBLIOA-LBPRGKRZSA-N 1 1 332.404 2.123 20 5 EEBDMO C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000297405439 294235024 /nfs/dbraw/zinc/23/50/24/294235024.db2.gz CMXXXHNFBSSMJM-KSZLIROESA-N 1 1 344.415 2.420 20 5 EEBDMO COc1cc(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])cc1F ZINC000297523159 294268648 /nfs/dbraw/zinc/26/86/48/294268648.db2.gz BKWDGZHYIQHDES-ZWNOBZJWSA-N 1 1 339.367 2.155 20 5 EEBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3cc(F)c(F)cc3[N+](=O)[O-])C2)C1 ZINC000297959577 294383606 /nfs/dbraw/zinc/38/36/06/294383606.db2.gz VBLKZJLKUGHBNZ-HNNXBMFYSA-N 1 1 325.315 2.041 20 5 EEBDMO Cc1ccc(S(=O)(=O)NCCCC[N@H+](C)C2CC2)cc1[N+](=O)[O-] ZINC000416501914 313239970 /nfs/dbraw/zinc/23/99/70/313239970.db2.gz NMQQNSDBZAQEOV-UHFFFAOYSA-N 1 1 341.433 2.056 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](CCO)CC1 ZINC000421007999 314022411 /nfs/dbraw/zinc/02/24/11/314022411.db2.gz CWLDZFIWVLDIDT-KBPBESRZSA-N 1 1 335.404 2.406 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)C[C@@H]1CCC[N@H+]1C ZINC000421014215 314026408 /nfs/dbraw/zinc/02/64/08/314026408.db2.gz VRWBXTPSCAHQIS-HNNXBMFYSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C[C@@H]1CCCN1C ZINC000421014215 314026412 /nfs/dbraw/zinc/02/64/12/314026412.db2.gz VRWBXTPSCAHQIS-HNNXBMFYSA-N 1 1 334.420 2.258 20 5 EEBDMO 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CCOC(=O)C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C ZINC000281861844 464612682 /nfs/dbraw/zinc/61/26/82/464612682.db2.gz AQBLEQPATROWBM-UHFFFAOYSA-N 1 1 337.376 2.197 20 5 EEBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C ZINC000281861844 464612687 /nfs/dbraw/zinc/61/26/87/464612687.db2.gz AQBLEQPATROWBM-UHFFFAOYSA-N 1 1 337.376 2.197 20 5 EEBDMO C[C@@H](O)CC[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000266727415 464800639 /nfs/dbraw/zinc/80/06/39/464800639.db2.gz JSUWWRUVXAFPSO-NXEZZACHSA-N 1 1 329.784 2.278 20 5 EEBDMO C[C@@H](O)CC[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000266727415 464800647 /nfs/dbraw/zinc/80/06/47/464800647.db2.gz JSUWWRUVXAFPSO-NXEZZACHSA-N 1 1 329.784 2.278 20 5 EEBDMO COCCOCCOCC[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000276253110 464865552 /nfs/dbraw/zinc/86/55/52/464865552.db2.gz NRYFJNOFGLWETC-CQSZACIVSA-N 1 1 326.393 2.267 20 5 EEBDMO C[N@@H+](CCOCCO)Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000282585132 464876115 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1 1 345.403 2.161 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2cccc(CNc3c([N+](=O)[O-])ncn3C)c2)CCO1 ZINC000299224491 465654528 /nfs/dbraw/zinc/65/45/28/465654528.db2.gz IRJCKMSXCNGTPT-CYBMUJFWSA-N 1 1 345.403 2.161 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCSC[C@H]1C ZINC000299325572 465698561 /nfs/dbraw/zinc/69/85/61/465698561.db2.gz PNLFYVDNQSDVPL-LLVKDONJSA-N 1 1 339.417 2.369 20 5 EEBDMO CNc1c(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000361124862 465782824 /nfs/dbraw/zinc/78/28/24/465782824.db2.gz UNPZUPHTHRBFBZ-ZDUSSCGKSA-N 1 1 332.360 2.262 20 5 EEBDMO CNc1c(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000361211584 465840439 /nfs/dbraw/zinc/84/04/39/465840439.db2.gz IROOGGPHFCLTBX-LBPRGKRZSA-N 1 1 332.404 2.383 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C)C[C@@H]1C(C)C ZINC000330979768 465883445 /nfs/dbraw/zinc/88/34/45/465883445.db2.gz NHXZCMAKDDXSBI-OAHLLOKOSA-N 1 1 334.420 2.114 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCC[N@H+](C(C)C)C1 ZINC000331053934 465915700 /nfs/dbraw/zinc/91/57/00/465915700.db2.gz ZZEFTTLPEOCHSU-ZDUSSCGKSA-N 1 1 341.433 2.054 20 5 EEBDMO CC(C)[C@H](O)CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353515862 465945809 /nfs/dbraw/zinc/94/58/09/465945809.db2.gz FYIRZMVVVZOKMH-HZPDHXFCSA-N 1 1 332.404 2.414 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]CC(C)(C)CCO)c1cccc([N+](=O)[O-])c1 ZINC000353513928 465946256 /nfs/dbraw/zinc/94/62/56/465946256.db2.gz GBOVMGRKSGTGEL-OAHLLOKOSA-N 1 1 332.404 2.416 20 5 EEBDMO CC[C@H](C)[C@@H](O)C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000353528378 465954435 /nfs/dbraw/zinc/95/44/35/465954435.db2.gz GVBVQYINMTUOGN-VBNZEHGJSA-N 1 1 332.404 2.414 20 5 EEBDMO COc1cc(C(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)cc([N+](=O)[O-])c1C ZINC000331166831 465964042 /nfs/dbraw/zinc/96/40/42/465964042.db2.gz STGFCQHUDCJTSK-OAHLLOKOSA-N 1 1 335.404 2.324 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1 ZINC000346181170 465968460 /nfs/dbraw/zinc/96/84/60/465968460.db2.gz HWKFJEBLHJHXMT-GDZNZVCISA-N 1 1 347.415 2.406 20 5 EEBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000346209454 465993664 /nfs/dbraw/zinc/99/36/64/465993664.db2.gz XSJJYTNSIDSMSW-GRDNDAEWSA-N 1 1 346.431 2.195 20 5 EEBDMO CNc1c(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000346216386 465999814 /nfs/dbraw/zinc/99/98/14/465999814.db2.gz INJDWGMKRACHCX-DVOMOZLQSA-N 1 1 346.431 2.439 20 5 EEBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000346230211 466010774 /nfs/dbraw/zinc/01/07/74/466010774.db2.gz MEUSEROJOBDWHB-GDZNZVCISA-N 1 1 349.406 2.465 20 5 EEBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000346254450 466031916 /nfs/dbraw/zinc/03/19/16/466031916.db2.gz BCMSXTKTJTXOCT-GRDNDAEWSA-N 1 1 331.416 2.326 20 5 EEBDMO COc1c(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000346263800 466040389 /nfs/dbraw/zinc/04/03/89/466040389.db2.gz NJTQBVOSMVUXKI-DVOMOZLQSA-N 1 1 347.415 2.406 20 5 EEBDMO CCOc1cc(N2CC[N@@H+](CC(C)(C)O)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000302534322 466151158 /nfs/dbraw/zinc/15/11/58/466151158.db2.gz MDBIEJVPERQPRA-CYBMUJFWSA-N 1 1 337.420 2.275 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+]2CC=C(C)CC2)c1 ZINC000338539652 466207982 /nfs/dbraw/zinc/20/79/82/466207982.db2.gz HWCLSUWRCFTGPD-UHFFFAOYSA-N 1 1 333.388 2.375 20 5 EEBDMO CCc1n[nH]c(C(=O)N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000331764368 466236658 /nfs/dbraw/zinc/23/66/58/466236658.db2.gz CUYPQIHKAJVMPI-XQQFMLRXSA-N 1 1 349.435 2.358 20 5 EEBDMO CCc1[nH]nc(C(=O)N2CCC[C@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000331764368 466236662 /nfs/dbraw/zinc/23/66/62/466236662.db2.gz CUYPQIHKAJVMPI-XQQFMLRXSA-N 1 1 349.435 2.358 20 5 EEBDMO CCc1[nH]nc(C(=O)N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000331764368 466236670 /nfs/dbraw/zinc/23/66/70/466236670.db2.gz CUYPQIHKAJVMPI-XQQFMLRXSA-N 1 1 349.435 2.358 20 5 EEBDMO C[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC[C@H]1c1ccccc1 ZINC000304273427 466273859 /nfs/dbraw/zinc/27/38/59/466273859.db2.gz CFOFSMCPBZKOGI-FHLIZLRMSA-N 1 1 344.415 2.278 20 5 EEBDMO COc1ccc(C[N@H+]2CCCC[C@H]2[C@@H]2CNC(=O)C2)cc1[N+](=O)[O-] ZINC000331879411 466287507 /nfs/dbraw/zinc/28/75/07/466287507.db2.gz IGNQWLHVMKOKBE-KBPBESRZSA-N 1 1 333.388 2.094 20 5 EEBDMO CCC[C@@]1(CO)CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000367362436 466290230 /nfs/dbraw/zinc/29/02/30/466290230.db2.gz XLMWPMPTXAYIAI-QGZVFWFLSA-N 1 1 335.404 2.042 20 5 EEBDMO CCC[C@@]1(CO)CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000367362436 466290239 /nfs/dbraw/zinc/29/02/39/466290239.db2.gz XLMWPMPTXAYIAI-QGZVFWFLSA-N 1 1 335.404 2.042 20 5 EEBDMO COC(=O)c1cccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000569382192 468483832 /nfs/dbraw/zinc/48/38/32/468483832.db2.gz XFOJPEJHGORLRY-UHFFFAOYSA-N 1 1 329.356 2.451 20 5 EEBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@]1(CO)CCOC1 ZINC000600178242 468486452 /nfs/dbraw/zinc/48/64/52/468486452.db2.gz ITNDIPVNPVMXBG-KRWDZBQOSA-N 1 1 332.356 2.438 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@]1(C)CO ZINC000597236098 468491188 /nfs/dbraw/zinc/49/11/88/468491188.db2.gz NVVPODRXNDQJNA-UGSOOPFHSA-N 1 1 344.415 2.446 20 5 EEBDMO NC(=O)C[C@@H]1CCCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000332249907 466470962 /nfs/dbraw/zinc/47/09/62/466470962.db2.gz LOGMTGOBHYWOSZ-ZDUSSCGKSA-N 1 1 346.387 2.264 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC[N@H+]1C ZINC000332313133 466503167 /nfs/dbraw/zinc/50/31/67/466503167.db2.gz IGBBEQDZNFECHG-VXGBXAGGSA-N 1 1 328.372 2.356 20 5 EEBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000354465577 466587249 /nfs/dbraw/zinc/58/72/49/466587249.db2.gz YGKFENLFQWICTG-CHWSQXEVSA-N 1 1 343.387 2.053 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000354465577 466587257 /nfs/dbraw/zinc/58/72/57/466587257.db2.gz YGKFENLFQWICTG-CHWSQXEVSA-N 1 1 343.387 2.053 20 5 EEBDMO CN(CC(=O)NCC[N@H+]1CCCC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000347447061 466636173 /nfs/dbraw/zinc/63/61/73/466636173.db2.gz PJMKMSDGOYSPRJ-UHFFFAOYSA-N 1 1 348.447 2.269 20 5 EEBDMO COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)[N@@H+]2Cc2cccc([N+](=O)[O-])c2)O1 ZINC000374635464 466700239 /nfs/dbraw/zinc/70/02/39/466700239.db2.gz HQEWSXMSFHWUGR-MWNCTCPHSA-N 1 1 334.372 2.278 20 5 EEBDMO COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)[N@H+]2Cc2cccc([N+](=O)[O-])c2)O1 ZINC000374635464 466700241 /nfs/dbraw/zinc/70/02/41/466700241.db2.gz HQEWSXMSFHWUGR-MWNCTCPHSA-N 1 1 334.372 2.278 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH2+][C@@H]3CCO[C@H]3C3CC3)o2)cc1 ZINC000365199190 466742493 /nfs/dbraw/zinc/74/24/93/466742493.db2.gz GILGNUNINAETOD-HIFRSBDPSA-N 1 1 330.344 2.302 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](Cn2ccnn2)C1 ZINC000373776132 466916978 /nfs/dbraw/zinc/91/69/78/466916978.db2.gz FQOJEVWHMFCFMQ-ZDUSSCGKSA-N 1 1 331.376 2.107 20 5 EEBDMO NC(=O)c1ccc(C[N@@H+]2C[C@@H](O)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000411944312 466943259 /nfs/dbraw/zinc/94/32/59/466943259.db2.gz NFHPFKFVRWCPNH-HOTGVXAUSA-N 1 1 341.367 2.002 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2C[C@@H](O)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000411944312 466943262 /nfs/dbraw/zinc/94/32/62/466943262.db2.gz NFHPFKFVRWCPNH-HOTGVXAUSA-N 1 1 341.367 2.002 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3ncccc32)C[C@H]1C ZINC000413124911 467174557 /nfs/dbraw/zinc/17/45/57/467174557.db2.gz DTRPMUFVYKJCBR-OLZOCXBDSA-N 1 1 330.388 2.034 20 5 EEBDMO O=[N+]([O-])c1ccc2ccnc(NCC[N@@H+]3C[C@H]4CC[C@@H](C3)O4)c2c1 ZINC000413309093 467212366 /nfs/dbraw/zinc/21/23/66/467212366.db2.gz AZLOTRXXDQEGNH-GASCZTMLSA-N 1 1 328.372 2.418 20 5 EEBDMO O=[N+]([O-])c1cccc(Cl)c1N1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000432328046 467231788 /nfs/dbraw/zinc/23/17/88/467231788.db2.gz VMSOQPWGPQUGLG-GFCCVEGCSA-N 1 1 325.796 2.407 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C2CC2)C[C@H](C)C1 ZINC000451080221 467242108 /nfs/dbraw/zinc/24/21/08/467242108.db2.gz BBNVEGUESJMCEW-CYBMUJFWSA-N 1 1 346.431 2.258 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C(N)=O)[C@@H](C)c1ccccc1 ZINC000428843337 467274023 /nfs/dbraw/zinc/27/40/23/467274023.db2.gz SUKLUCIRHFETEG-YVEFUNNKSA-N 1 1 343.383 2.351 20 5 EEBDMO CCCCNC(=O)NC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429267279 467318245 /nfs/dbraw/zinc/31/82/45/467318245.db2.gz WVXVUPDXTVWRSN-UHFFFAOYSA-N 1 1 336.392 2.045 20 5 EEBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)[C@@H]1CC[N@H+](C(C)C)C1 ZINC000452091035 467318789 /nfs/dbraw/zinc/31/87/89/467318789.db2.gz AMGRZRWIIGSBPW-CYBMUJFWSA-N 1 1 341.433 2.006 20 5 EEBDMO CN(CCC[N@@H+](C)Cc1ccco1)c1c(C(N)=O)cccc1[N+](=O)[O-] ZINC000420621590 467435853 /nfs/dbraw/zinc/43/58/53/467435853.db2.gz BYKMBUINLOIMPC-UHFFFAOYSA-N 1 1 346.387 2.245 20 5 EEBDMO CCCC[N@@H+](C)CCNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000448964280 467608609 /nfs/dbraw/zinc/60/86/09/467608609.db2.gz ZMYVJQMJLGMEFS-UHFFFAOYSA-N 1 1 327.356 2.204 20 5 EEBDMO C[N@H+]1CCC[C@H](CCNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000458209437 467789534 /nfs/dbraw/zinc/78/95/34/467789534.db2.gz OOBHWAUNTUUYMU-CQSZACIVSA-N 1 1 347.415 2.406 20 5 EEBDMO C[C@@H]1CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@@H+]1C ZINC000450348933 467832413 /nfs/dbraw/zinc/83/24/13/467832413.db2.gz MJXZFNVPORJGTG-OLZOCXBDSA-N 1 1 333.388 2.109 20 5 EEBDMO C[C@@H]1CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1C ZINC000450348933 467832419 /nfs/dbraw/zinc/83/24/19/467832419.db2.gz MJXZFNVPORJGTG-OLZOCXBDSA-N 1 1 333.388 2.109 20 5 EEBDMO COC(=O)c1cc(N2CC[N@@H+](C)[C@H](C(C)C)C2)cc(C)c1[N+](=O)[O-] ZINC000487107527 468022933 /nfs/dbraw/zinc/02/29/33/468022933.db2.gz CMSYEDGGUBOIBH-HNNXBMFYSA-N 1 1 335.404 2.466 20 5 EEBDMO O=C(NC1CC1)c1ccc(NC[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000549852958 468199385 /nfs/dbraw/zinc/19/93/85/468199385.db2.gz JFXUSCUDDAAINK-GFCCVEGCSA-N 1 1 344.415 2.383 20 5 EEBDMO Cc1cc(N2CC[N@@H+]3CCOC[C@@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590137632 468218406 /nfs/dbraw/zinc/21/84/06/468218406.db2.gz HHAAXQNKGZFVAZ-NSHDSACASA-N 1 1 345.321 2.443 20 5 EEBDMO Cc1cc(N2CC[N@H+]3CCOC[C@@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590137632 468218411 /nfs/dbraw/zinc/21/84/11/468218411.db2.gz HHAAXQNKGZFVAZ-NSHDSACASA-N 1 1 345.321 2.443 20 5 EEBDMO C[C@@H]1C[N@H+](CCCNC(=O)/C=C\c2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000490736632 468243732 /nfs/dbraw/zinc/24/37/32/468243732.db2.gz XZMXDYOBIQYZLH-ZMWOBVFASA-N 1 1 347.415 2.224 20 5 EEBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000594195984 468508430 /nfs/dbraw/zinc/50/84/30/468508430.db2.gz JTRNOKDAVUBLOI-CABCVRRESA-N 1 1 343.387 2.218 20 5 EEBDMO CN(C)c1nc(C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])cs1 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EEBDMO C[N@@H+]1CCc2c(NCc3ccccc3C(N)=O)ccc([N+](=O)[O-])c2C1 ZINC001166236969 1321684813 /nfs/dbraw/zinc/68/48/13/1321684813.db2.gz XDTGKEQKTYLKGT-UHFFFAOYSA-N 1 1 340.383 2.294 20 5 EEBDMO C[N@H+]1CCc2c(NCc3ccccc3C(N)=O)ccc([N+](=O)[O-])c2C1 ZINC001166236969 1321684818 /nfs/dbraw/zinc/68/48/18/1321684818.db2.gz XDTGKEQKTYLKGT-UHFFFAOYSA-N 1 1 340.383 2.294 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@](CO)(C(C)C)C1 ZINC000351948825 1321967824 /nfs/dbraw/zinc/96/78/24/1321967824.db2.gz ITHHOUZFNUKRTE-KRWDZBQOSA-N 1 1 335.404 2.182 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@](CO)(C(C)C)C1 ZINC000351948825 1321967825 /nfs/dbraw/zinc/96/78/25/1321967825.db2.gz ITHHOUZFNUKRTE-KRWDZBQOSA-N 1 1 335.404 2.182 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NCC[NH+]1CC=CC1 ZINC001322325848 1333247220 /nfs/dbraw/zinc/24/72/20/1333247220.db2.gz JNXVOCWPBZNIKZ-UHFFFAOYSA-N 1 1 325.752 2.319 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCNc1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1 ZINC001609165986 1351873094 /nfs/dbraw/zinc/87/30/94/1351873094.db2.gz CSQLSSWFGLFZCT-NSHDSACASA-N 1 1 331.380 2.061 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001335837570 1336435207 /nfs/dbraw/zinc/43/52/07/1336435207.db2.gz CZAUAXKITCECJK-MUIFIZLQSA-N 1 1 329.400 2.441 20 5 EEBDMO C[C@H](O)C[NH+]1CCN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1 ZINC001336657945 1336576831 /nfs/dbraw/zinc/57/68/31/1336576831.db2.gz FTKSOPDCGLMMGL-JTQLQIEISA-N 1 1 333.310 2.116 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@@H+](C3CCCC3)[C@H](C)C2)n1 ZINC001336727691 1336586668 /nfs/dbraw/zinc/58/66/68/1336586668.db2.gz ZVSKMZBGQDBKHH-GFCCVEGCSA-N 1 1 348.403 2.230 20 5 EEBDMO CC[C@H](CNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-])[NH+]1CCCC1 ZINC001590445954 1349328395 /nfs/dbraw/zinc/32/83/95/1349328395.db2.gz MGONCAQXCNJRBY-SECBINFHSA-N 1 1 337.409 2.123 20 5 EEBDMO C[C@H](CNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC001603893747 1350796527 /nfs/dbraw/zinc/79/65/27/1350796527.db2.gz AMVSXJJSFJGPIN-VXGBXAGGSA-N 1 1 345.407 2.450 20 5 EEBDMO CC[N@@H+](CCN1CCOCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172920564 1368128111 /nfs/dbraw/zinc/12/81/11/1368128111.db2.gz KOFTTZVPZVHBNN-SFHVURJKSA-N 1 1 347.459 2.496 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1CON=C(N)C[N@H+]1CCCC[C@H]1C ZINC000797422544 1371530695 /nfs/dbraw/zinc/53/06/95/1371530695.db2.gz PHACBTKDDQTKGS-GFCCVEGCSA-N 1 1 336.392 2.476 20 5 EEBDMO Cn1c2ccccc2c(NCC2=CC[N@@H+](C)CC2)c([N+](=O)[O-])c1=O ZINC001355264977 1373152417 /nfs/dbraw/zinc/15/24/17/1373152417.db2.gz OAIFQDXTOLAUSZ-UHFFFAOYSA-N 1 1 328.372 2.121 20 5 EEBDMO O=C(NC1(C[NH2+]Cc2ccsc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001755350743 1407350612 /nfs/dbraw/zinc/35/06/12/1407350612.db2.gz FFVCTFUZEIGGTD-ZIAGYGMSSA-N 1 1 337.445 2.322 20 5 EEBDMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cccc([N+](=O)[O-])n1)C2 ZINC001164809826 720086093 /nfs/dbraw/zinc/08/60/93/720086093.db2.gz KRMKFQCNWYBRDF-MAUKXSAKSA-N 1 1 346.431 2.175 20 5 EEBDMO Cc1nc(N2CC[NH+](CCc3ccccn3)CC2)ccc1[N+](=O)[O-] ZINC001165054627 722008685 /nfs/dbraw/zinc/00/86/85/722008685.db2.gz UPELTBHTBRTKRC-UHFFFAOYSA-N 1 1 327.388 2.058 20 5 EEBDMO O=C(NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccccc1 ZINC001031519328 769326592 /nfs/dbraw/zinc/32/65/92/769326592.db2.gz WIVMCIYUAATWPB-UHFFFAOYSA-N 1 1 325.368 2.457 20 5 EEBDMO CCN(CCNc1ccccc1[N+](=O)[O-])C(=O)Cn1c[nH+]cc1C ZINC001106892399 769383758 /nfs/dbraw/zinc/38/37/58/769383758.db2.gz QMXPFYHGKDRICZ-UHFFFAOYSA-N 1 1 331.376 2.060 20 5 EEBDMO C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1N)Cc1ccccc1 ZINC000184309430 782812484 /nfs/dbraw/zinc/81/24/84/782812484.db2.gz PMIUGSXBEQCIIA-UHFFFAOYSA-N 1 1 328.372 2.039 20 5 EEBDMO C[C@@H](NC(=O)N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1)c1ccccc1[N+](=O)[O-] ZINC000894017171 780405636 /nfs/dbraw/zinc/40/56/36/780405636.db2.gz YPTRPSTZDMBODI-IIYDPXPESA-N 1 1 332.404 2.249 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1c1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000894089857 780511931 /nfs/dbraw/zinc/51/19/31/780511931.db2.gz IHPGLRRLRHPCCQ-ZDUSSCGKSA-N 1 1 344.415 2.367 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC/C=C/CNc1ccc(C)cc1[N+](=O)[O-] ZINC001107321320 786859243 /nfs/dbraw/zinc/85/92/43/786859243.db2.gz DHAARCXGBBXCNB-AATRIKPKSA-N 1 1 334.420 2.329 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)NC/C=C/CNc1ccc([N+](=O)[O-])cc1F ZINC001107425435 787201590 /nfs/dbraw/zinc/20/15/90/787201590.db2.gz XOUZWVHGJSAUON-NSCUHMNNSA-N 1 1 347.350 2.023 20 5 EEBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000825401150 788613805 /nfs/dbraw/zinc/61/38/05/788613805.db2.gz ZIVCOUZCBAMOKE-QDEZUTFSSA-N 1 1 349.431 2.111 20 5 EEBDMO C[C@@H](OC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000785727383 806557316 /nfs/dbraw/zinc/55/73/16/806557316.db2.gz GLYNQRHTQCGVCZ-FRRDWIJNSA-N 1 1 349.387 2.338 20 5 EEBDMO C[C@@H](OC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000785727383 806557326 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334.420 2.340 20 5 EEBDMO O=C(NC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1)c1cscn1 ZINC001002434746 798071845 /nfs/dbraw/zinc/07/18/45/798071845.db2.gz OJHZJIZYZVJQKK-UHFFFAOYSA-N 1 1 346.412 2.446 20 5 EEBDMO CC(C)(C)OC(=O)N1C[C@H]([NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)C(F)(F)C1 ZINC001169001283 803566591 /nfs/dbraw/zinc/56/65/91/803566591.db2.gz FGUGAHMHVCRYMZ-TUAOUCFPSA-N 1 1 349.378 2.276 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@]3(C2)CCCN(c2ncccn2)C3)C1 ZINC001169019343 803587862 /nfs/dbraw/zinc/58/78/62/803587862.db2.gz HXUIYMWGAKSEHL-JFIYKMOQSA-N 1 1 345.447 2.214 20 5 EEBDMO CC(C)n1nc(CN(C)C)c2c1C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)CC2 ZINC001169022221 803588206 /nfs/dbraw/zinc/58/82/06/803588206.db2.gz QTRMHRQVIZCSEW-LSDHHAIUSA-N 1 1 349.479 2.329 20 5 EEBDMO Cc1nn(CN2CC[C@]3(CC[N@H+](C)C3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000793750970 810519420 /nfs/dbraw/zinc/51/94/20/810519420.db2.gz ZWDMJUYVVITIGC-KRWDZBQOSA-N 1 1 329.404 2.238 20 5 EEBDMO CC[N@@H+](C)CCNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000103206824 219270283 /nfs/dbraw/zinc/27/02/83/219270283.db2.gz KMTCIKRBWWRBMW-UHFFFAOYSA-N 1 1 327.406 2.007 20 5 EEBDMO CC(C)c1ccc(C(=O)N2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000456249066 535370401 /nfs/dbraw/zinc/37/04/01/535370401.db2.gz QVITXGABTPPOJT-OKILXGFUSA-N 1 1 349.431 2.245 20 5 EEBDMO CC(C)c1ccc(C(=O)N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000456249066 535370403 /nfs/dbraw/zinc/37/04/03/535370403.db2.gz QVITXGABTPPOJT-OKILXGFUSA-N 1 1 349.431 2.245 20 5 EEBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000129388978 223050849 /nfs/dbraw/zinc/05/08/49/223050849.db2.gz MZFMEPAZXHNRFU-RYUDHWBXSA-N 1 1 339.367 2.298 20 5 EEBDMO COc1cc(C[N@@H+]2CCC[C@@H](CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000073092592 216347880 /nfs/dbraw/zinc/34/78/80/216347880.db2.gz MYYAGWZAAUAVJE-SNVBAGLBSA-N 1 1 346.330 2.409 20 5 EEBDMO COc1cc(C[N@H+]2CCC[C@@H](CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000073092592 216347881 /nfs/dbraw/zinc/34/78/81/216347881.db2.gz MYYAGWZAAUAVJE-SNVBAGLBSA-N 1 1 346.330 2.409 20 5 EEBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000131985394 223289559 /nfs/dbraw/zinc/28/95/59/223289559.db2.gz IXHQUSIGJQQEMQ-JSGCOSHPSA-N 1 1 336.417 2.335 20 5 EEBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000131985394 223289562 /nfs/dbraw/zinc/28/95/62/223289562.db2.gz IXHQUSIGJQQEMQ-JSGCOSHPSA-N 1 1 336.417 2.335 20 5 EEBDMO C[N@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)Cc1ccccc1 ZINC000023694674 212390655 /nfs/dbraw/zinc/39/06/55/212390655.db2.gz UZJZTMTVGOEUSY-UHFFFAOYSA-N 1 1 343.339 2.394 20 5 EEBDMO C[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)Cc1ccccc1 ZINC000023694674 212390657 /nfs/dbraw/zinc/39/06/57/212390657.db2.gz UZJZTMTVGOEUSY-UHFFFAOYSA-N 1 1 343.339 2.394 20 5 EEBDMO CCC[C@]1(C)C(=O)NCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000445888187 242139591 /nfs/dbraw/zinc/13/95/91/242139591.db2.gz 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C[NH+](C)[C@@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000144813176 463377893 /nfs/dbraw/zinc/37/78/93/463377893.db2.gz VTUQBTSJUUQLIW-QGZVFWFLSA-N 1 1 342.399 2.426 20 5 EEBDMO CCCC[N@H+](CCOC)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000109334116 463639147 /nfs/dbraw/zinc/63/91/47/463639147.db2.gz VEZINNYVDMAIGD-UHFFFAOYSA-N 1 1 339.392 2.290 20 5 EEBDMO CCCC[N@@H+](CCOC)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000109334116 463639155 /nfs/dbraw/zinc/63/91/55/463639155.db2.gz VEZINNYVDMAIGD-UHFFFAOYSA-N 1 1 339.392 2.290 20 5 EEBDMO COCC[N@@H+](C)CCNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000171138958 463796336 /nfs/dbraw/zinc/79/63/36/463796336.db2.gz OEWZYEONJJVVGI-UHFFFAOYSA-N 1 1 337.420 2.200 20 5 EEBDMO CC[C@H](C)[N@@H+](CCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000287258270 463850140 /nfs/dbraw/zinc/85/01/40/463850140.db2.gz HDOJQQYVKURSQV-JTQLQIEISA-N 1 1 329.784 2.280 20 5 EEBDMO CN(C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1 ZINC000279253067 464078887 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C[C@@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000175382046 464537358 /nfs/dbraw/zinc/53/73/58/464537358.db2.gz STZUOVCTKOVHLJ-MYODQAERSA-N 1 1 336.417 2.222 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000285450448 464569180 /nfs/dbraw/zinc/56/91/80/464569180.db2.gz SNYLNSDOAYBPSI-ZFWWWQNUSA-N 1 1 346.387 2.285 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000285450448 464569187 /nfs/dbraw/zinc/56/91/87/464569187.db2.gz SNYLNSDOAYBPSI-ZFWWWQNUSA-N 1 1 346.387 2.285 20 5 EEBDMO CCOc1cccc(NCCN2CC[N@@H+](C)C(C)(C)C2)c1[N+](=O)[O-] ZINC000281748717 464569710 /nfs/dbraw/zinc/56/97/10/464569710.db2.gz XOJGDBDWILJSQZ-UHFFFAOYSA-N 1 1 336.436 2.431 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+](CC(C)(C)O)C2CC2)cccc1[N+](=O)[O-] ZINC000189979823 464577214 /nfs/dbraw/zinc/57/72/14/464577214.db2.gz NBENYTHCJNHFMT-UHFFFAOYSA-N 1 1 335.404 2.467 20 5 EEBDMO CCOCC[NH+]1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182137377 464580288 /nfs/dbraw/zinc/58/02/88/464580288.db2.gz VUUSKISAKQWIIW-UHFFFAOYSA-N 1 1 327.812 2.402 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CC(=O)N(C)C)CC1 ZINC000182162265 464587317 /nfs/dbraw/zinc/58/73/17/464587317.db2.gz VMCOZOBXLILHHG-UHFFFAOYSA-N 1 1 335.404 2.294 20 5 EEBDMO CC(C)[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000294742471 464592630 /nfs/dbraw/zinc/59/26/30/464592630.db2.gz CKQIEILCHWQABM-UHFFFAOYSA-N 1 1 340.399 2.260 20 5 EEBDMO C[C@@H]1CSCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000190470950 464652119 /nfs/dbraw/zinc/65/21/19/464652119.db2.gz GZQZOTBZNWWYSW-JSGCOSHPSA-N 1 1 326.418 2.019 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H]2c2cccc3c2OCCO3)n1 ZINC000176227847 464725680 /nfs/dbraw/zinc/72/56/80/464725680.db2.gz SHDMRPYPLOYSGW-AWEZNQCLSA-N 1 1 344.371 2.400 20 5 EEBDMO COc1ccc(OCC[N@H+]2CC[C@H](O)CC(C)(C)C2)c([N+](=O)[O-])c1 ZINC000295258453 464764810 /nfs/dbraw/zinc/76/48/10/464764810.db2.gz CZLVBFAASPHKTL-ZDUSSCGKSA-N 1 1 338.404 2.465 20 5 EEBDMO CCc1n[nH]c(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000183363140 464855473 /nfs/dbraw/zinc/85/54/73/464855473.db2.gz ZVDMLVVGCMQSBW-NEPJUHHUSA-N 1 1 349.435 2.263 20 5 EEBDMO C[C@@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])c2cccnc21 ZINC000286316164 464877761 /nfs/dbraw/zinc/87/77/61/464877761.db2.gz KOAZZELAROTNEH-KGLIPLIRSA-N 1 1 342.399 2.442 20 5 EEBDMO C[N@H+](Cc1cc2ccccc2o1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266954938 464884387 /nfs/dbraw/zinc/88/43/87/464884387.db2.gz VPZNMLCPHMNXQI-CQSZACIVSA-N 1 1 330.344 2.030 20 5 EEBDMO CN1CC[N@@H+](C)C[C@H]1CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000267020019 464907297 /nfs/dbraw/zinc/90/72/97/464907297.db2.gz JOZVQLNXMGGTEK-LLVKDONJSA-N 1 1 332.326 2.271 20 5 EEBDMO C[C@@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000286438979 464918232 /nfs/dbraw/zinc/91/82/32/464918232.db2.gz SKZHNDVSVRPGNK-CJNGLKHVSA-N 1 1 342.399 2.442 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000268187747 464963923 /nfs/dbraw/zinc/96/39/23/464963923.db2.gz UZDMYTROBJCUCU-IUODEOHRSA-N 1 1 332.404 2.219 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000298770580 465499384 /nfs/dbraw/zinc/49/93/84/465499384.db2.gz OLTXTUZYMYJHDW-PBHICJAKSA-N 1 1 331.372 2.500 20 5 EEBDMO CNC(=O)c1ccc(NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000299071647 465586184 /nfs/dbraw/zinc/58/61/84/465586184.db2.gz PAEZEGMWFMIYNX-QWHCGFSZSA-N 1 1 334.420 2.487 20 5 EEBDMO COc1cc(C[NH2+]Cc2cnn3ccccc23)c([N+](=O)[O-])cc1O ZINC000353037088 465592990 /nfs/dbraw/zinc/59/29/90/465592990.db2.gz IMDCNKYOLHANGI-UHFFFAOYSA-N 1 1 328.328 2.247 20 5 EEBDMO C[C@@H]1COCC[N@H+]1C1CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000593990683 468452777 /nfs/dbraw/zinc/45/27/77/468452777.db2.gz IEGUIBGBFNBUIL-CYBMUJFWSA-N 1 1 337.395 2.419 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000340141030 465806593 /nfs/dbraw/zinc/80/65/93/465806593.db2.gz HPFOXQDOSOUBOA-CABCVRRESA-N 1 1 332.404 2.063 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C[C@H]1CCCOC1)c1cccc([N+](=O)[O-])c1 ZINC000353455482 465896854 /nfs/dbraw/zinc/89/68/54/465896854.db2.gz RGELUSCSVIYLBC-CJNGLKHVSA-N 1 1 330.388 2.434 20 5 EEBDMO Cc1c(Br)c(N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)ncc1[N+](=O)[O-] ZINC000362661228 465919943 /nfs/dbraw/zinc/91/99/43/465919943.db2.gz CUGUTDWRSFBDAM-AOOOYVTPSA-N 1 1 341.209 2.059 20 5 EEBDMO O=C(C[NH+]1CCC(C(F)F)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000362732676 465983608 /nfs/dbraw/zinc/98/36/08/465983608.db2.gz GYRRPSZRFYOGLV-UHFFFAOYSA-N 1 1 339.342 2.461 20 5 EEBDMO COc1cc(C(=O)NCCNc2cccc(C)[nH+]2)ccc1[N+](=O)[O-] ZINC000346246159 466025542 /nfs/dbraw/zinc/02/55/42/466025542.db2.gz NYCDHQHVPUIRBS-UHFFFAOYSA-N 1 1 330.344 2.149 20 5 EEBDMO Cn1nccc1[C@@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000372170806 466203233 /nfs/dbraw/zinc/20/32/33/466203233.db2.gz WGDLJERTFYRKJP-RHSMWYFYSA-N 1 1 330.388 2.241 20 5 EEBDMO CC(C)[N@@H+](C)C[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000349801851 466247628 /nfs/dbraw/zinc/24/76/28/466247628.db2.gz PENWRNKKLLEZKW-JTQLQIEISA-N 1 1 349.840 2.255 20 5 EEBDMO C[C@]1(O)CCOC[C@H]1[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000331836111 466265387 /nfs/dbraw/zinc/26/53/87/466265387.db2.gz BWPRFPPFKBCCBF-UAGQMJEPSA-N 1 1 338.379 2.486 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCCC[C@@H]2c2ccco2)c1 ZINC000304332302 466284685 /nfs/dbraw/zinc/28/46/85/466284685.db2.gz VOJUZOJTYPXOHP-HUUCEWRRSA-N 1 1 334.376 2.363 20 5 EEBDMO COc1cc(S(=O)(=O)N(C)c2cc[nH+]c(C)c2)ccc1[N+](=O)[O-] ZINC000361817168 466315231 /nfs/dbraw/zinc/31/52/31/466315231.db2.gz XJBSZJXEQHORGF-UHFFFAOYSA-N 1 1 337.357 2.132 20 5 EEBDMO CN(Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000372364021 466331752 /nfs/dbraw/zinc/33/17/52/466331752.db2.gz DANJMOYWFWRREQ-GOSISDBHSA-N 1 1 332.448 2.195 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@@H](C3CC[NH+](C)CC3)C2)c1[N+](=O)[O-] ZINC000332191615 466437972 /nfs/dbraw/zinc/43/79/72/466437972.db2.gz XVQMCGKANDQLKZ-CYBMUJFWSA-N 1 1 349.435 2.245 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000347218887 466485648 /nfs/dbraw/zinc/48/56/48/466485648.db2.gz YJBNSSFIMVVNQU-AWEZNQCLSA-N 1 1 335.404 2.134 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2cccs2)[C@H]2C=C[C@@H](CO)C2)n1 ZINC000347344494 466580525 /nfs/dbraw/zinc/58/05/25/466580525.db2.gz QLZZBHBMBQQSCL-KGLIPLIRSA-N 1 1 348.428 2.292 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@](C)(F)C1 ZINC000347361756 466589388 /nfs/dbraw/zinc/58/93/88/466589388.db2.gz VTJTXUWQADAWQD-OAHLLOKOSA-N 1 1 325.340 2.366 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@](O)(C3CC3)C2)cccc1[N+](=O)[O-] ZINC000373280320 466751707 /nfs/dbraw/zinc/75/17/07/466751707.db2.gz WUWIPRHYYJCLNE-SJKOYZFVSA-N 1 1 333.388 2.077 20 5 EEBDMO CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000411061720 466763525 /nfs/dbraw/zinc/76/35/25/466763525.db2.gz QERBGMXXDGILJT-LLVKDONJSA-N 1 1 339.367 2.299 20 5 EEBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000411061720 466763531 /nfs/dbraw/zinc/76/35/31/466763531.db2.gz QERBGMXXDGILJT-LLVKDONJSA-N 1 1 339.367 2.299 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(=O)N(C)C)C1 ZINC000411933215 466938804 /nfs/dbraw/zinc/93/88/04/466938804.db2.gz JLMORORQYAHADF-CYBMUJFWSA-N 1 1 335.404 2.292 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1c(N)cccc1[N+](=O)[O-])CCC(F)(F)F ZINC000427422458 467156428 /nfs/dbraw/zinc/15/64/28/467156428.db2.gz VOQNSQHKDRZFCD-UHFFFAOYSA-N 1 1 348.325 2.181 20 5 EEBDMO C[C@H](CNc1ccc([N+](=O)[O-])c2ncccc12)N1CC[NH+](C)CC1 ZINC000413111804 467171629 /nfs/dbraw/zinc/17/16/29/467171629.db2.gz JDXKDIIPBKIIQW-CYBMUJFWSA-N 1 1 329.404 2.191 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@H]2C[N@@H+](C3CC3)CCO2)c2cccnc21 ZINC000413130984 467175467 /nfs/dbraw/zinc/17/54/67/467175467.db2.gz RREHGRCHVQELJZ-ZDUSSCGKSA-N 1 1 328.372 2.418 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@H]2C[N@H+](C3CC3)CCO2)c2cccnc21 ZINC000413130984 467175470 /nfs/dbraw/zinc/17/54/70/467175470.db2.gz RREHGRCHVQELJZ-ZDUSSCGKSA-N 1 1 328.372 2.418 20 5 EEBDMO O=[N+]([O-])c1cnc(NCc2ccccc2C[N@@H+]2CC[C@H](O)C2)c(F)c1 ZINC000413231677 467193883 /nfs/dbraw/zinc/19/38/83/467193883.db2.gz BWZBHQSEMUMQCJ-HNNXBMFYSA-N 1 1 346.362 2.308 20 5 EEBDMO C[N@H+]1CCO[C@H]2CCN(c3ccc([N+](=O)[O-])c4ncccc43)C[C@H]21 ZINC000413286961 467208139 /nfs/dbraw/zinc/20/81/39/467208139.db2.gz FBQMJQGUXWEMHS-CVEARBPZSA-N 1 1 328.372 2.052 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCCNC(=O)C1CCC1 ZINC000429556291 467347419 /nfs/dbraw/zinc/34/74/19/467347419.db2.gz OVYUGGQQFVOMRB-UHFFFAOYSA-N 1 1 335.404 2.342 20 5 EEBDMO Cn1cc(CN2CCC[C@@H](C[NH3+])C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000435371084 467463055 /nfs/dbraw/zinc/46/30/55/467463055.db2.gz SJMJOODOUVMEMN-ZDUSSCGKSA-N 1 1 329.404 2.166 20 5 EEBDMO Cc1ccc([C@@H](C)NC(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)cc1[N+](=O)[O-] ZINC000454600941 467603595 /nfs/dbraw/zinc/60/35/95/467603595.db2.gz HDWYXCBBSDBKHX-IVMMDQJWSA-N 1 1 332.404 2.310 20 5 EEBDMO C[C@@H]1CN(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)[N@@H+]1C ZINC000454787763 467615900 /nfs/dbraw/zinc/61/59/00/467615900.db2.gz CUXKSPWOOTUOFQ-PHIMTYICSA-N 1 1 340.811 2.482 20 5 EEBDMO CCOc1cc(C[N@H+]2CCC[C@H](CCC(N)=O)C2)ccc1[N+](=O)[O-] ZINC000492722677 467727314 /nfs/dbraw/zinc/72/73/14/467727314.db2.gz OGZXTOGGXYACDB-CYBMUJFWSA-N 1 1 335.404 2.471 20 5 EEBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000515508232 467995573 /nfs/dbraw/zinc/99/55/73/467995573.db2.gz CSQNRICNFDSIEB-CQSZACIVSA-N 1 1 333.388 2.110 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000515508232 467995575 /nfs/dbraw/zinc/99/55/75/467995575.db2.gz CSQNRICNFDSIEB-CQSZACIVSA-N 1 1 333.388 2.110 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCOCC1 ZINC000532588291 468125227 /nfs/dbraw/zinc/12/52/27/468125227.db2.gz RPCNIEWREPAYFA-UHFFFAOYSA-N 1 1 327.768 2.298 20 5 EEBDMO COCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCO[C@H]1C ZINC000489429485 468135384 /nfs/dbraw/zinc/13/53/84/468135384.db2.gz NXIKZRTUINQHBC-XHDPSFHLSA-N 1 1 334.376 2.097 20 5 EEBDMO COCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCO[C@H]1C ZINC000489429485 468135388 /nfs/dbraw/zinc/13/53/88/468135388.db2.gz NXIKZRTUINQHBC-XHDPSFHLSA-N 1 1 334.376 2.097 20 5 EEBDMO CNc1ccc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)cc1[N+](=O)[O-] ZINC000533194351 468178476 /nfs/dbraw/zinc/17/84/76/468178476.db2.gz ORIYTENOIUIYNQ-ZFWWWQNUSA-N 1 1 332.404 2.193 20 5 EEBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H](n3ccnn3)C2)cc1 ZINC000591851636 468531179 /nfs/dbraw/zinc/53/11/79/468531179.db2.gz SBUWXZJGRZXEPX-HNNXBMFYSA-N 1 1 331.376 2.292 20 5 EEBDMO Cc1c(CC(=O)N2CCC[C@]3(CC[N@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000597714189 468649162 /nfs/dbraw/zinc/64/91/62/468649162.db2.gz HDVHPWCWVMYKJG-GOSISDBHSA-N 1 1 331.416 2.390 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC000597717059 468650065 /nfs/dbraw/zinc/65/00/65/468650065.db2.gz XPTRYYZZDCWLBV-QGZVFWFLSA-N 1 1 333.388 2.161 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CC[N@H+](C(C)(C)C)C1 ZINC000594801416 468691631 /nfs/dbraw/zinc/69/16/31/468691631.db2.gz NRUKAKYXXAMVTC-GFCCVEGCSA-N 1 1 341.433 2.054 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1CN1CCC([C@@H]3CCC[NH2+]3)CC1)OCCO2 ZINC000592424327 468694604 /nfs/dbraw/zinc/69/46/04/468694604.db2.gz HIVNTYFJACACTF-HNNXBMFYSA-N 1 1 347.415 2.330 20 5 EEBDMO CC(=O)NC1CCC(Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000601111771 468745540 /nfs/dbraw/zinc/74/55/40/468745540.db2.gz WFWMARHTBVMIBK-UHFFFAOYSA-N 1 1 328.372 2.424 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C[C@H](CO)CC1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000595088178 468756070 /nfs/dbraw/zinc/75/60/70/468756070.db2.gz INBYFLSOCFWPOQ-PBHICJAKSA-N 1 1 344.415 2.416 20 5 EEBDMO CS(=O)(=O)[C@@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601144788 468758816 /nfs/dbraw/zinc/75/88/16/468758816.db2.gz WUSJNZNOPKREIX-GFCCVEGCSA-N 1 1 335.385 2.156 20 5 EEBDMO Cc1ccc(NCCCNC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000592769918 468780680 /nfs/dbraw/zinc/78/06/80/468780680.db2.gz RAICIVOKWRKKHH-ZIAGYGMSSA-N 1 1 334.420 2.162 20 5 EEBDMO O=C(N[C@@H]1CC[N@@H+](C2CCCCC2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000598217797 468796234 /nfs/dbraw/zinc/79/62/34/468796234.db2.gz BWBOLAAGPCWSEY-CYBMUJFWSA-N 1 1 333.388 2.437 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000598217797 468796236 /nfs/dbraw/zinc/79/62/36/468796236.db2.gz BWBOLAAGPCWSEY-CYBMUJFWSA-N 1 1 333.388 2.437 20 5 EEBDMO Nc1c(F)c(N2CC[NH+](Cc3ccc(O)cc3)CC2)ccc1[N+](=O)[O-] ZINC000601256718 468800260 /nfs/dbraw/zinc/80/02/60/468800260.db2.gz GBMYIBJKEHECOI-UHFFFAOYSA-N 1 1 346.362 2.344 20 5 EEBDMO O=C1NCCCN1C1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595389934 468835229 /nfs/dbraw/zinc/83/52/29/468835229.db2.gz RNHJKPHIMQJHAH-UHFFFAOYSA-N 1 1 336.367 2.114 20 5 EEBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000584391443 468859126 /nfs/dbraw/zinc/85/91/26/468859126.db2.gz CSRWLILEOFFTSC-GFCCVEGCSA-N 1 1 343.387 2.057 20 5 EEBDMO COC(=O)[C@@H]1C[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000595564864 468904173 /nfs/dbraw/zinc/90/41/73/468904173.db2.gz WEGLXXRHPAOJGF-UONOGXRCSA-N 1 1 345.355 2.280 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598559375 468912982 /nfs/dbraw/zinc/91/29/82/468912982.db2.gz GMLVRUAOWHTPGT-AWEZNQCLSA-N 1 1 347.415 2.455 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](C)[C@@H]1CCO ZINC000595694756 468958135 /nfs/dbraw/zinc/95/81/35/468958135.db2.gz FNQZKWATUODFEI-JSGCOSHPSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H](C)[C@@H]1CCO ZINC000595694756 468958142 /nfs/dbraw/zinc/95/81/42/468958142.db2.gz FNQZKWATUODFEI-JSGCOSHPSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@@H]1CCNC(=O)[C@@H]1[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602658728 468994533 /nfs/dbraw/zinc/99/45/33/468994533.db2.gz WZZYRIMDIHGVBN-HZGVNTEJSA-N 1 1 348.222 2.033 20 5 EEBDMO COc1cc(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)cc([N+](=O)[O-])c1C ZINC000573273473 469096554 /nfs/dbraw/zinc/09/65/54/469096554.db2.gz KVHICBFFJMETQT-UONOGXRCSA-N 1 1 333.388 2.221 20 5 EEBDMO COc1ccc(NC(=O)C[NH+]2CCC3(CCOC3)CC2)c([N+](=O)[O-])c1 ZINC000611178648 469184323 /nfs/dbraw/zinc/18/43/23/469184323.db2.gz ZZTWWTCSYMHYAP-UHFFFAOYSA-N 1 1 349.387 2.044 20 5 EEBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)CC1 ZINC000618480205 469362438 /nfs/dbraw/zinc/36/24/38/469362438.db2.gz VACHZDSIJIKHGV-UHFFFAOYSA-N 1 1 344.371 2.320 20 5 EEBDMO C[C@@H]1OCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H]1C ZINC000128935282 534166380 /nfs/dbraw/zinc/16/63/80/534166380.db2.gz STLAVGBTXBKCJI-QWRGUYRKSA-N 1 1 325.340 2.172 20 5 EEBDMO C[C@@H]1OCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H]1C ZINC000128935282 534166383 /nfs/dbraw/zinc/16/63/83/534166383.db2.gz STLAVGBTXBKCJI-QWRGUYRKSA-N 1 1 325.340 2.172 20 5 EEBDMO O=C(Nc1ccncc1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000183558862 534424139 /nfs/dbraw/zinc/42/41/39/534424139.db2.gz APAPUEVNKMOLKW-SWLSCSKDSA-N 1 1 345.403 2.470 20 5 EEBDMO CC[NH+](CC)[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccccc1 ZINC000158971547 528245719 /nfs/dbraw/zinc/24/57/19/528245719.db2.gz HBCOCXRRACMTJB-ZDUSSCGKSA-N 1 1 331.376 2.131 20 5 EEBDMO CC[C@](C)(O)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1 ZINC000189718906 529373117 /nfs/dbraw/zinc/37/31/17/529373117.db2.gz ILDHLTHQWTYNSY-KRWDZBQOSA-N 1 1 332.404 2.455 20 5 EEBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000774626282 577407289 /nfs/dbraw/zinc/40/72/89/577407289.db2.gz SYCVMTBWQRWMOB-SWLSCSKDSA-N 1 1 346.387 2.441 20 5 EEBDMO O=C1CCCN1C[C@H]1CCCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581336 577463151 /nfs/dbraw/zinc/46/31/51/577463151.db2.gz CXRUUSSBWODWRS-SJORKVTESA-N 1 1 347.415 2.105 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@](O)(c3ccc(F)cc3)C2)cc1 ZINC000777735368 577485611 /nfs/dbraw/zinc/48/56/11/577485611.db2.gz JGCJEHLSMPLUDY-QZTJIDSGSA-N 1 1 346.358 2.361 20 5 EEBDMO Cc1cc[nH+]c(N2CCN(c3nc4ccccn4c3[N+](=O)[O-])CC2)c1 ZINC000765586222 577503495 /nfs/dbraw/zinc/50/34/95/577503495.db2.gz PFXXDZUCGYBLPI-UHFFFAOYSA-N 1 1 338.371 2.273 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)C[C@@H]1C ZINC000765931982 577509274 /nfs/dbraw/zinc/50/92/74/577509274.db2.gz XCYAZFKZJUUTAK-RYUDHWBXSA-N 1 1 339.367 2.054 20 5 EEBDMO O=C(OCCC[NH+]1CCOCC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000750889079 577744486 /nfs/dbraw/zinc/74/44/86/577744486.db2.gz WSPQLGYLAQRXSW-UHFFFAOYSA-N 1 1 328.752 2.127 20 5 EEBDMO C[C@H](O)C[C@@H]1CCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000752143216 577766611 /nfs/dbraw/zinc/76/66/11/577766611.db2.gz MVGCDSBMJRLLBL-JQWIXIFHSA-N 1 1 341.795 2.422 20 5 EEBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000752143216 577766612 /nfs/dbraw/zinc/76/66/12/577766612.db2.gz MVGCDSBMJRLLBL-JQWIXIFHSA-N 1 1 341.795 2.422 20 5 EEBDMO O=[N+]([O-])c1ccc2nc(N3CC[C@@H](C[NH+]4CCOCC4)C3)sc2c1 ZINC000742415267 577872724 /nfs/dbraw/zinc/87/27/24/577872724.db2.gz ARHFBVHKUIMTPH-LBPRGKRZSA-N 1 1 348.428 2.363 20 5 EEBDMO Cc1cccc(NCCNC(=O)COc2ccc([N+](=O)[O-])c(F)c2)[nH+]1 ZINC000743464076 577885818 /nfs/dbraw/zinc/88/58/18/577885818.db2.gz HUKNJPGGTADOEW-UHFFFAOYSA-N 1 1 348.334 2.044 20 5 EEBDMO Cc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000741724993 578123151 /nfs/dbraw/zinc/12/31/51/578123151.db2.gz PIGWXGPRSLHUEO-ONGXEEELSA-N 1 1 336.348 2.024 20 5 EEBDMO Cc1cccc(NCCNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)[nH+]1 ZINC000742203083 578129440 /nfs/dbraw/zinc/12/94/40/578129440.db2.gz HMMNWIYHFIUADK-UHFFFAOYSA-N 1 1 343.387 2.206 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(Cn3ncc4ccc([N+](=O)[O-])cc43)CC[C@H]21 ZINC000247225106 675738397 /nfs/dbraw/zinc/73/83/97/675738397.db2.gz XXQMIUGUUDDDHX-GOEBONIOSA-N 1 1 329.404 2.318 20 5 EEBDMO O=C(N[C@H]1C[C@H](C[NH2+]Cc2ccc(Cl)s2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC000983647854 683049486 /nfs/dbraw/zinc/04/94/86/683049486.db2.gz DXWOSCRWGWLLFU-CNVPUSNMSA-N 1 1 343.836 2.051 20 5 EEBDMO O=C(N[C@H]1C[C@H](C[NH2+]Cc2ccccc2C2CC2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC000983655167 683081542 /nfs/dbraw/zinc/08/15/42/683081542.db2.gz QQJGNPYLTZSPJF-DGCUDZEOSA-N 1 1 343.427 2.214 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCC2(C[C@@H]1F)OCCO2 ZINC000892939701 683232469 /nfs/dbraw/zinc/23/24/69/683232469.db2.gz UYEVKESIDXEABU-UONOGXRCSA-N 1 1 340.351 2.327 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21)C1(F)CCCC1 ZINC001025837403 683336586 /nfs/dbraw/zinc/33/65/86/683336586.db2.gz BIVIAYRRHWAJAG-ZSHCYNCHSA-N 1 1 347.390 2.424 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21)[C@H]1C[C@H]2C[C@H]2C1 ZINC001025963001 683691296 /nfs/dbraw/zinc/69/12/96/683691296.db2.gz ZTYOOBAOGSILGM-DERKNEBMSA-N 1 1 341.411 2.187 20 5 EEBDMO CC[C@@H](C[NH+]1CCOCC1)Nc1ncnc2cccc([N+](=O)[O-])c21 ZINC000895802389 684730881 /nfs/dbraw/zinc/73/08/81/684730881.db2.gz RIICXTPLUTWUSC-LBPRGKRZSA-N 1 1 331.376 2.061 20 5 EEBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)c2cocn2)CC1 ZINC000985329446 686339718 /nfs/dbraw/zinc/33/97/18/686339718.db2.gz GDNPNPKJMRQXJI-UHFFFAOYSA-N 1 1 344.371 2.319 20 5 EEBDMO O=C(N[C@H]1CC[C@H]([NH2+]CC2CC3(CCC3)C2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034644926 1196466327 /nfs/dbraw/zinc/46/63/27/1196466327.db2.gz OCHOWVMTZHTPQI-KLHDSHLOSA-N 1 1 335.448 2.249 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)CCCN1CCN(C)CC1 ZINC000873140108 1198511238 /nfs/dbraw/zinc/51/12/38/1198511238.db2.gz JNCCISVJDVAVEM-UHFFFAOYSA-N 1 1 334.464 2.281 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)CCCN1CCN(C)CC1 ZINC000873140108 1198511241 /nfs/dbraw/zinc/51/12/41/1198511241.db2.gz JNCCISVJDVAVEM-UHFFFAOYSA-N 1 1 334.464 2.281 20 5 EEBDMO C[C@@H]1CC2(CN1C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1)CCOCC2 ZINC000876940005 1199824444 /nfs/dbraw/zinc/82/44/44/1199824444.db2.gz OBSDKCRVRLXPCQ-CXAGYDPISA-N 1 1 347.415 2.186 20 5 EEBDMO COCCC1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1 ZINC000876991968 1199839084 /nfs/dbraw/zinc/83/90/84/1199839084.db2.gz JISPXYGZYDTACC-QGZVFWFLSA-N 1 1 335.404 2.044 20 5 EEBDMO C[N@H+]1CC[C@](O)(CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811490933 1200084166 /nfs/dbraw/zinc/08/41/66/1200084166.db2.gz WFGOBGUQKNIIFJ-ZDUSSCGKSA-N 1 1 334.203 2.058 20 5 EEBDMO CC[C@@]1(O)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000879313590 1200990400 /nfs/dbraw/zinc/99/04/00/1200990400.db2.gz MLSLCPMKEPVGOK-MRXNPFEDSA-N 1 1 339.367 2.299 20 5 EEBDMO C[N@H+](CCC1CCOCC1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000121182007 1201582201 /nfs/dbraw/zinc/58/22/01/1201582201.db2.gz WRPFPGCHMPFOHZ-UHFFFAOYSA-N 1 1 335.360 2.209 20 5 EEBDMO C[N@@H+](CCC1CCOCC1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000121182007 1201582204 /nfs/dbraw/zinc/58/22/04/1201582204.db2.gz WRPFPGCHMPFOHZ-UHFFFAOYSA-N 1 1 335.360 2.209 20 5 EEBDMO COC1CCC(N(C)C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1 ZINC000867927754 1201707756 /nfs/dbraw/zinc/70/77/56/1201707756.db2.gz NEVYWPALTUPMBK-PUJMQQBBSA-N 1 1 335.404 2.185 20 5 EEBDMO CN(CCOc1ccccc1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867957559 1201714920 /nfs/dbraw/zinc/71/49/20/1201714920.db2.gz QGOICYVDINSLOM-GOSISDBHSA-N 1 1 343.383 2.306 20 5 EEBDMO CC1(C)CC[N@@H+](CCNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000890069025 1204776101 /nfs/dbraw/zinc/77/61/01/1204776101.db2.gz OMXYKCBVGUUIKI-UHFFFAOYSA-N 1 1 347.415 2.406 20 5 EEBDMO COc1ccc(NC(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000930768499 1206581507 /nfs/dbraw/zinc/58/15/07/1206581507.db2.gz HXIYEWMQVPDHAG-MFKMUULPSA-N 1 1 334.376 2.208 20 5 EEBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000935191241 1208112532 /nfs/dbraw/zinc/11/25/32/1208112532.db2.gz VGGQJCSTCYHMNB-HTQZYQBOSA-N 1 1 344.774 2.134 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000935191241 1208112534 /nfs/dbraw/zinc/11/25/34/1208112534.db2.gz VGGQJCSTCYHMNB-HTQZYQBOSA-N 1 1 344.774 2.134 20 5 EEBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2[nH]cc[nH+]2)CC1 ZINC000935665491 1208195857 /nfs/dbraw/zinc/19/58/57/1208195857.db2.gz XHDPAUKDHOAXNP-UHFFFAOYSA-N 1 1 347.400 2.002 20 5 EEBDMO COC(=O)C[C@]1([NH2+]Cc2c(F)cc([N+](=O)[O-])cc2F)CCCOC1 ZINC000796013988 1215265806 /nfs/dbraw/zinc/26/58/06/1215265806.db2.gz IXZFGUPHOOMVDZ-OAHLLOKOSA-N 1 1 344.314 2.075 20 5 EEBDMO COC(=O)CC[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC000112959018 1226369711 /nfs/dbraw/zinc/36/97/11/1226369711.db2.gz YVCOSKHCRKIJKF-UHFFFAOYSA-N 1 1 347.375 2.084 20 5 EEBDMO COC(=O)Cc1ccc(N2CC[C@@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC000827813349 1248792394 /nfs/dbraw/zinc/79/23/94/1248792394.db2.gz PPNOLKAAHLDCKX-CYBMUJFWSA-N 1 1 344.371 2.038 20 5 EEBDMO O=C(NCCC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CCC1 ZINC001096243620 1236595797 /nfs/dbraw/zinc/59/57/97/1236595797.db2.gz ZRYBZYDIYODADO-UHFFFAOYSA-N 1 1 346.431 2.023 20 5 EEBDMO O=C(c1ccoc1)N1C[C@@H]2C[N@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001048676482 1238265810 /nfs/dbraw/zinc/26/58/10/1238265810.db2.gz BGDTUOIDTDCVHU-OKILXGFUSA-N 1 1 347.396 2.453 20 5 EEBDMO O=C(c1ccoc1)N1C[C@@H]2C[N@@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001048676482 1238265816 /nfs/dbraw/zinc/26/58/16/1238265816.db2.gz BGDTUOIDTDCVHU-OKILXGFUSA-N 1 1 347.396 2.453 20 5 EEBDMO Cc1ccc(C[N@@H+]2CC=C(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1F ZINC001000674473 1240707837 /nfs/dbraw/zinc/70/78/37/1240707837.db2.gz PAHOVVOTVVZXPJ-NVXWUHKLSA-N 1 1 347.390 2.048 20 5 EEBDMO Cc1cc(Cl)c(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-] ZINC000827105174 1249941265 /nfs/dbraw/zinc/94/12/65/1249941265.db2.gz HOUYKOTVYSHINE-IINYFYTJSA-N 1 1 341.795 2.006 20 5 EEBDMO Cc1cc(Cl)c(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-] ZINC000827105174 1249941272 /nfs/dbraw/zinc/94/12/72/1249941272.db2.gz HOUYKOTVYSHINE-IINYFYTJSA-N 1 1 341.795 2.006 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NCCN(c1cc(C)ccc1[N+](=O)[O-])C1CC1 ZINC001101381788 1245743198 /nfs/dbraw/zinc/74/31/98/1245743198.db2.gz FQEVBBWLLFFSLK-UHFFFAOYSA-N 1 1 348.447 2.330 20 5 EEBDMO Cc1cc(NC2(CNC(=O)C[N@H+](C)C3CCC3)CC2)ccc1[N+](=O)[O-] ZINC001110383736 1279179619 /nfs/dbraw/zinc/17/96/19/1279179619.db2.gz XDGDGCVTMSMMHW-UHFFFAOYSA-N 1 1 346.431 2.448 20 5 EEBDMO CCCCOCC(=O)N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001195410698 1283558216 /nfs/dbraw/zinc/55/82/16/1283558216.db2.gz CWKRWYIIUNTKLQ-UHFFFAOYSA-N 1 1 349.431 2.446 20 5 EEBDMO CCCCOCC(=O)N1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001195410698 1283558226 /nfs/dbraw/zinc/55/82/26/1283558226.db2.gz CWKRWYIIUNTKLQ-UHFFFAOYSA-N 1 1 349.431 2.446 20 5 EEBDMO O=[N+]([O-])c1cc(C(F)F)ccc1N1CC[NH+]([C@H]2CCOC2)CC1 ZINC000853452124 1292387227 /nfs/dbraw/zinc/38/72/27/1292387227.db2.gz QVDYKFHISJKIIH-LBPRGKRZSA-N 1 1 327.331 2.443 20 5 EEBDMO C[NH+]1CCN(c2cc(Nc3ccc(F)c([N+](=O)[O-])c3)ncn2)CC1 ZINC001211190595 1295737684 /nfs/dbraw/zinc/73/76/84/1295737684.db2.gz VBQVWOJNQZWPKJ-UHFFFAOYSA-N 1 1 332.339 2.019 20 5 EEBDMO COC(=O)Cc1ccc(O[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])c1 ZINC001226214181 1301304112 /nfs/dbraw/zinc/30/41/12/1301304112.db2.gz KODFZGUTIFUSEM-BTTYYORXSA-N 1 1 334.372 2.314 20 5 EEBDMO COc1c(C)cc([N+](=O)[O-])c(O[C@@H]2CCC[N@H+](C)C2)c1[N+](=O)[O-] ZINC001229869467 1302971868 /nfs/dbraw/zinc/97/18/68/1302971868.db2.gz BAVRBTIQKTVZCX-SNVBAGLBSA-N 1 1 325.321 2.293 20 5 EEBDMO COc1c(C)cc([N+](=O)[O-])c(O[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-] ZINC001229869467 1302971869 /nfs/dbraw/zinc/97/18/69/1302971869.db2.gz BAVRBTIQKTVZCX-SNVBAGLBSA-N 1 1 325.321 2.293 20 5 EEBDMO C[C@H]1CCC[N@H+]1CCN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000780769023 1303699913 /nfs/dbraw/zinc/69/99/13/1303699913.db2.gz VURLEUZPHJISFV-YOEHRIQHSA-N 1 1 343.431 2.492 20 5 EEBDMO c1nnc2n1CC[N@H+](Cc1ccc3ccc4cccnc4c3n1)CC2 ZINC001232218908 1304041928 /nfs/dbraw/zinc/04/19/28/1304041928.db2.gz PIRGLAQKYRWCLJ-UHFFFAOYSA-N 1 1 330.395 2.433 20 5 EEBDMO O=C(NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001118003523 1306239099 /nfs/dbraw/zinc/23/90/99/1306239099.db2.gz BWGOHJHSXXFCHF-PYWTVGQWSA-N 1 1 343.427 2.354 20 5 EEBDMO O=C(NC1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-] ZINC001118003523 1306239111 /nfs/dbraw/zinc/23/91/11/1306239111.db2.gz BWGOHJHSXXFCHF-PYWTVGQWSA-N 1 1 343.427 2.354 20 5 EEBDMO O=C(NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-] ZINC001118003523 1306239123 /nfs/dbraw/zinc/23/91/23/1306239123.db2.gz BWGOHJHSXXFCHF-PYWTVGQWSA-N 1 1 343.427 2.354 20 5 EEBDMO C[C@@H]1C[C@@H]2CC[C@H](C(=O)NCCc3cccc([N+](=O)[O-])c3)C[N@H+]2C1 ZINC001123677503 1310673425 /nfs/dbraw/zinc/67/34/25/1310673425.db2.gz KJLHQOZLSCLRLB-KBMXLJTQSA-N 1 1 331.416 2.374 20 5 EEBDMO C[C@H]1CC[N@@H+](CCOc2ccc(NC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)C1 ZINC000839694844 1315234900 /nfs/dbraw/zinc/23/49/00/1315234900.db2.gz SQSSQSXSBVADTN-APHBMKBZSA-N 1 1 333.388 2.011 20 5 EEBDMO C[C@H]1CC[N@H+](CCOc2ccc(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2)C1 ZINC000839694844 1315234903 /nfs/dbraw/zinc/23/49/03/1315234903.db2.gz SQSSQSXSBVADTN-APHBMKBZSA-N 1 1 333.388 2.011 20 5 EEBDMO C[C@H]1CC[N@@H+](CCOc2ccc(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2)C1 ZINC000839694844 1315234906 /nfs/dbraw/zinc/23/49/06/1315234906.db2.gz SQSSQSXSBVADTN-APHBMKBZSA-N 1 1 333.388 2.011 20 5 EEBDMO COC(=O)[C@@]1(C)CCC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000840185066 1315320986 /nfs/dbraw/zinc/32/09/86/1315320986.db2.gz OAPGZSLLPCACEZ-KRWDZBQOSA-N 1 1 346.387 2.486 20 5 EEBDMO Cc1nc(CC[N@H+](C)C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)no1 ZINC001254474458 1318082215 /nfs/dbraw/zinc/08/22/15/1318082215.db2.gz QXQJLCJUPMVQHK-UHFFFAOYSA-N 1 1 345.403 2.430 20 5 EEBDMO CCNC(=O)CO[C@@H]1CCC[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254560122 1318120734 /nfs/dbraw/zinc/12/07/34/1318120734.db2.gz PJDLTKWJUZTLIY-GDBMZVCRSA-N 1 1 349.431 2.143 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H](N[C@@H]1CC[N@H+](CC3CCOCC3)C1)C2 ZINC001254583997 1318133108 /nfs/dbraw/zinc/13/31/08/1318133108.db2.gz FROYETZRKMIDSL-QZTJIDSGSA-N 1 1 345.443 2.153 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H](N[C@@H]1CC[N@@H+](CC3CCOCC3)C1)C2 ZINC001254583997 1318133113 /nfs/dbraw/zinc/13/31/13/1318133113.db2.gz FROYETZRKMIDSL-QZTJIDSGSA-N 1 1 345.443 2.153 20 5 EEBDMO COC(=O)[C@@H]1C[N@H+](C)CCN1c1ccc2ccc3cccnc3c2n1 ZINC001157770688 1318848599 /nfs/dbraw/zinc/84/85/99/1318848599.db2.gz PCCIUHSDCHYWBB-HNNXBMFYSA-N 1 1 336.395 2.076 20 5 EEBDMO COC(=O)[C@@H]1C[N@@H+](C)CCN1c1ccc2ccc3cccnc3c2n1 ZINC001157770688 1318848608 /nfs/dbraw/zinc/84/86/08/1318848608.db2.gz PCCIUHSDCHYWBB-HNNXBMFYSA-N 1 1 336.395 2.076 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)nc(N[C@@H]2CCC[C@@H]2[NH+]2CCOCC2)c1 ZINC001160720860 1320246346 /nfs/dbraw/zinc/24/63/46/1320246346.db2.gz TZQWYIKVZHREQK-NEPJUHHUSA-N 1 1 326.784 2.308 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](Nc2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])[C@H](C)C1 ZINC001163366705 1321106422 /nfs/dbraw/zinc/10/64/22/1321106422.db2.gz WJEHZYBPBZIMER-ZYHUDNBSSA-N 1 1 328.800 2.412 20 5 EEBDMO [NH3+][C@H]1CN(C(F)(F)c2cnc(Cl)c([N+](=O)[O-])c2)CCC1(F)F ZINC001164316769 1321349288 /nfs/dbraw/zinc/34/92/88/1321349288.db2.gz HDYONLSWRCMJNY-QMMMGPOBSA-N 1 1 342.680 2.361 20 5 EEBDMO [NH3+][C@H]1CN(c2nc(Cl)c(Cl)cc2[N+](=O)[O-])CCC1(F)F ZINC001164319757 1321350630 /nfs/dbraw/zinc/35/06/30/1321350630.db2.gz OLTKLYSOTGXYCZ-ZETCQYMHSA-N 1 1 327.118 2.469 20 5 EEBDMO COc1cc2ncnc(N3CCn4c(C)[nH+]cc4C3)c2cc1[N+](=O)[O-] ZINC001165385391 1321512614 /nfs/dbraw/zinc/51/26/14/1321512614.db2.gz MWITZLIKHZPCPC-UHFFFAOYSA-N 1 1 340.343 2.072 20 5 EEBDMO COC(=O)CC1([NH2+]Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CCC1 ZINC001307618500 1331543106 /nfs/dbraw/zinc/54/31/06/1331543106.db2.gz IQHMOKGJEFFWFR-UHFFFAOYSA-N 1 1 346.343 2.220 20 5 EEBDMO CC1(C)CCC[N@@H+](CCNc2cccc(-c3nn[nH]n3)c2[N+](=O)[O-])C1 ZINC001609145584 1351860668 /nfs/dbraw/zinc/86/06/68/1351860668.db2.gz SSPSHBHTYRXYKS-UHFFFAOYSA-N 1 1 345.407 2.309 20 5 EEBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[N@H+]1CCCC[C@@H]1C ZINC001609165092 1351872433 /nfs/dbraw/zinc/87/24/33/1351872433.db2.gz DALREVFHDVRJBR-NWDGAFQWSA-N 1 1 345.407 2.450 20 5 EEBDMO O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCC[N@H+](CC3CC3)C2)c1 ZINC001336802053 1336597427 /nfs/dbraw/zinc/59/74/27/1336597427.db2.gz AOKOHMRFBMQASB-CRAIPNDOSA-N 1 1 333.432 2.340 20 5 EEBDMO O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCC[N@@H+](CC3CC3)C2)c1 ZINC001336802053 1336597428 /nfs/dbraw/zinc/59/74/28/1336597428.db2.gz AOKOHMRFBMQASB-CRAIPNDOSA-N 1 1 333.432 2.340 20 5 EEBDMO COC(=O)CC(C)(C)[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC001340963166 1337270444 /nfs/dbraw/zinc/27/04/44/1337270444.db2.gz RYGUKGMHVLJCBL-UHFFFAOYSA-N 1 1 337.376 2.115 20 5 EEBDMO C[C@@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@@H]1C[NH3+] ZINC001576811219 1344064455 /nfs/dbraw/zinc/06/44/55/1344064455.db2.gz CRZJFWYKJBVTLA-DGCLKSJQSA-N 1 1 331.376 2.062 20 5 EEBDMO CC(C)(C[NH+]1CCCC1)Nc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001589278996 1348979014 /nfs/dbraw/zinc/97/90/14/1348979014.db2.gz YGRVEJKAEMQVDV-UHFFFAOYSA-N 1 1 337.409 2.123 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1C[N@H+]1CC[C@H](C2CCC2)C1 ZINC001607083713 1351411285 /nfs/dbraw/zinc/41/12/85/1351411285.db2.gz MJJYURBJWSPKJY-LBPRGKRZSA-N 1 1 328.376 2.397 20 5 EEBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CC1=CCCOC1 ZINC000852518085 1369278628 /nfs/dbraw/zinc/27/86/28/1369278628.db2.gz CSVWPMJOBSEMAP-UHFFFAOYSA-N 1 1 337.351 2.341 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000829126759 1372269176 /nfs/dbraw/zinc/26/91/76/1372269176.db2.gz MJCZHSDUCFHWHF-ZDUSSCGKSA-N 1 1 332.404 2.400 20 5 EEBDMO CCN(CCc1ccccn1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC001577728621 1403671904 /nfs/dbraw/zinc/67/19/04/1403671904.db2.gz IUVMOQHXVBELDU-GOSISDBHSA-N 1 1 342.399 2.255 20 5 EEBDMO COc1cc2ncnc(N3C[C@@H](C)[N@@H+](C)C[C@H]3C)c2cc1[N+](=O)[O-] ZINC001164642503 719202214 /nfs/dbraw/zinc/20/22/14/719202214.db2.gz WAZMNJJEVHNCSB-GHMZBOCLSA-N 1 1 331.376 2.075 20 5 EEBDMO Cc1nc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)ccc1[N+](=O)[O-] ZINC001164781719 721390406 /nfs/dbraw/zinc/39/04/06/721390406.db2.gz CZOPPWKGZMJFPR-CHWSQXEVSA-N 1 1 345.428 2.323 20 5 EEBDMO COC(=O)[C@H]1CN(c2cc(C)c([N+](=O)[O-])cc2Cl)CC[N@@H+](C)C1 ZINC000840360796 782563999 /nfs/dbraw/zinc/56/39/99/782563999.db2.gz OWCFODDMQMNIJV-LLVKDONJSA-N 1 1 341.795 2.098 20 5 EEBDMO COCC(=O)N1CCC2(CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC001035143544 783892005 /nfs/dbraw/zinc/89/20/05/783892005.db2.gz DOJQGGVSBXABLD-UHFFFAOYSA-N 1 1 347.415 2.056 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]Cc2ccccc2Cl)CC1 ZINC000996430106 786397089 /nfs/dbraw/zinc/39/70/89/786397089.db2.gz ZRUVBPNJVOJZSJ-UKRRQHHQSA-N 1 1 337.807 2.086 20 5 EEBDMO CC(C)(O)[C@H]1CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000129295616 786426564 /nfs/dbraw/zinc/42/65/64/786426564.db2.gz VTFPWFKFJPSRFN-CQSZACIVSA-N 1 1 339.367 2.298 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@H](OCc3ccncc3)C2)cc1 ZINC000805753731 786439817 /nfs/dbraw/zinc/43/98/17/786439817.db2.gz RVPGTHRLUMMQJG-MSOLQXFVSA-N 1 1 343.383 2.314 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)[C@H](C)C1 ZINC000910275752 786605083 /nfs/dbraw/zinc/60/50/83/786605083.db2.gz XKPCGGPPLMLODT-CQSZACIVSA-N 1 1 335.404 2.225 20 5 EEBDMO CC1(C)CC[N@@H+](CC(=O)NC/C=C/CNc2ccc([N+](=O)[O-])cc2)C1 ZINC001107513843 787471528 /nfs/dbraw/zinc/47/15/28/787471528.db2.gz OUUBVOQLFBZZGZ-ONEGZZNKSA-N 1 1 346.431 2.411 20 5 EEBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@@](C)(O)c1ccccc1 ZINC000823605378 787829303 /nfs/dbraw/zinc/82/93/03/787829303.db2.gz JPSGNARKVXQPAO-ZWKOTPCHSA-N 1 1 330.384 2.468 20 5 EEBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000824003011 787996206 /nfs/dbraw/zinc/99/62/06/787996206.db2.gz LHWPEFIQFRMKHE-VXGBXAGGSA-N 1 1 335.408 2.419 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1Cn1nccc1[N+](=O)[O-] ZINC000156491938 789122576 /nfs/dbraw/zinc/12/25/76/789122576.db2.gz PGYCKIZBIVBVJH-OAHLLOKOSA-N 1 1 329.404 2.345 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](CC1CCCC1)CC2 ZINC001040699448 792273047 /nfs/dbraw/zinc/27/30/47/792273047.db2.gz DGSZDMBQKSQFKR-HZPDHXFCSA-N 1 1 335.448 2.156 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NCCCNc1ccc([N+](=O)[O-])cc1F ZINC001094640023 796509946 /nfs/dbraw/zinc/50/99/46/796509946.db2.gz NEXLKBBXOXWUFD-UHFFFAOYSA-N 1 1 340.399 2.382 20 5 EEBDMO COC[C@]12COC[C@H]1C[N@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172908132 797133604 /nfs/dbraw/zinc/13/36/04/797133604.db2.gz BBMVICGUCWVMMF-ZHALLVOQSA-N 1 1 346.427 2.437 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)c(OC(F)F)c1 ZINC000785802534 806605219 /nfs/dbraw/zinc/60/52/19/806605219.db2.gz VRROXYLROFBVSY-NEPJUHHUSA-N 1 1 343.330 2.471 20 5 EEBDMO Cc1cnoc1C(=O)NC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001003895003 800442111 /nfs/dbraw/zinc/44/21/11/800442111.db2.gz DIWBNLGWMBULRR-UHFFFAOYSA-N 1 1 344.371 2.286 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)NCC1(Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC001110279642 801118250 /nfs/dbraw/zinc/11/82/50/801118250.db2.gz QRVMHXLRVOGDBU-UHFFFAOYSA-N 1 1 343.387 2.169 20 5 EEBDMO COc1cccc(C2(N)CC[NH+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)CC2)c1 ZINC001168999808 803565123 /nfs/dbraw/zinc/56/51/23/803565123.db2.gz VZJSWPUAZMUDGN-ZBFHGGJFSA-N 1 1 333.432 2.390 20 5 EEBDMO COc1cccc(C2([NH3+])CCN([C@H]3CC[C@@H](C[N+](=O)[O-])C3)CC2)c1 ZINC001168999808 803565126 /nfs/dbraw/zinc/56/51/26/803565126.db2.gz VZJSWPUAZMUDGN-ZBFHGGJFSA-N 1 1 333.432 2.390 20 5 EEBDMO Cn1cc2c(n1)C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@H]2COCC1CC1 ZINC001169025273 803591458 /nfs/dbraw/zinc/59/14/58/803591458.db2.gz YITFROKIBPZILZ-HRCADAONSA-N 1 1 348.447 2.191 20 5 EEBDMO Cn1cc2c(n1)C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@H]2COCC1CC1 ZINC001169025273 803591461 /nfs/dbraw/zinc/59/14/61/803591461.db2.gz YITFROKIBPZILZ-HRCADAONSA-N 1 1 348.447 2.191 20 5 EEBDMO CSc1nc(Cl)c([N+](=O)[O-])c(N2C[C@H]3CCC[N@@H+](C)[C@@H]3C2)n1 ZINC001157262746 807177128 /nfs/dbraw/zinc/17/71/28/807177128.db2.gz YCCGSDUVJNYWFP-RKDXNWHRSA-N 1 1 343.840 2.291 20 5 EEBDMO C[C@H]1CC[C@H](C)[NH+]1CC(=O)OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792204319 809653005 /nfs/dbraw/zinc/65/30/05/809653005.db2.gz QQTAYFWULLGHDG-QWRGUYRKSA-N 1 1 337.332 2.419 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@@H]3[C@H]2CCC(=O)N3C)c([N+](=O)[O-])c1 ZINC001170340147 809914647 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C[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)(C)CN(C)C ZINC000564854251 319118721 /nfs/dbraw/zinc/11/87/21/319118721.db2.gz MXOAXYFHRTWHPD-ZDUSSCGKSA-N 1 1 336.436 2.489 20 5 EEBDMO O=C(C[N@@H+]1CCSC[C@@H]1C1CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000576078373 320138496 /nfs/dbraw/zinc/13/84/96/320138496.db2.gz MWXSNMYHMXDQDM-MRXNPFEDSA-N 1 1 347.440 2.311 20 5 EEBDMO O=C(C[N@H+]1CCSC[C@@H]1C1CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000576078373 320138497 /nfs/dbraw/zinc/13/84/97/320138497.db2.gz MWXSNMYHMXDQDM-MRXNPFEDSA-N 1 1 347.440 2.311 20 5 EEBDMO CNc1ccc(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000581684662 324303003 /nfs/dbraw/zinc/30/30/03/324303003.db2.gz XGBTTYXPOYHYQK-WOSRLPQWSA-N 1 1 346.431 2.439 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC[C@H]21 ZINC000358474706 465147267 /nfs/dbraw/zinc/14/72/67/465147267.db2.gz YRCDIFVRXPUJLF-XJKSGUPXSA-N 1 1 335.379 2.219 20 5 EEBDMO Cc1c(CNC(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cccc1[N+](=O)[O-] 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CN(C(=O)c1ccc([N+](=O)[O-])c2cccnc12)[C@@H]1CCC[N@@H+](C)C1 ZINC000156098467 462979806 /nfs/dbraw/zinc/97/98/06/462979806.db2.gz QGFIGHGHLYAKTA-GFCCVEGCSA-N 1 1 328.372 2.309 20 5 EEBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000521757789 468330195 /nfs/dbraw/zinc/33/01/95/468330195.db2.gz WJPZOAQSYHIWPY-GFCCVEGCSA-N 1 1 349.387 2.174 20 5 EEBDMO CCC[N@H+]1CC[C@H](CNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000120661561 463023555 /nfs/dbraw/zinc/02/35/55/463023555.db2.gz PTOKSLWOMDNWPZ-OAHLLOKOSA-N 1 1 334.420 2.168 20 5 EEBDMO C[N@@H+](CCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C1CC1 ZINC000067701884 463039587 /nfs/dbraw/zinc/03/95/87/463039587.db2.gz XDTHEAIGLSNBGW-UHFFFAOYSA-N 1 1 332.404 2.019 20 5 EEBDMO Cc1[nH+]ccn1CCCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000078333396 463105029 /nfs/dbraw/zinc/10/50/29/463105029.db2.gz FLFLHLTVAKHUKU-UHFFFAOYSA-N 1 1 338.389 2.005 20 5 EEBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 ZINC000158044280 463199355 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ZKRZYDMVEXFTMW-VGOVLVCLSA-N 1 1 329.400 2.440 20 5 EEBDMO CC[NH+](CC)[C@@H](C(=O)OCCn1cc([N+](=O)[O-])cn1)c1ccccc1 ZINC000177787013 681521671 /nfs/dbraw/zinc/52/16/71/681521671.db2.gz LEKJMTOJRVKOMA-MRXNPFEDSA-N 1 1 346.387 2.418 20 5 EEBDMO O=[N+]([O-])c1cnc2c(Cl)cccc2c1N1CC[N@H+]2C[C@H](O)C[C@H]2C1 ZINC000894432953 682894377 /nfs/dbraw/zinc/89/43/77/682894377.db2.gz XRMKBHPHRFZRJN-WDEREUQCSA-N 1 1 348.790 2.052 20 5 EEBDMO C[C@@H](CNC(=O)NC[C@H](C)[N@@H+](C)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000892820665 683102360 /nfs/dbraw/zinc/10/23/60/683102360.db2.gz REHLMJQLHZDMCU-STQMWFEESA-N 1 1 334.420 2.480 20 5 EEBDMO C[C@@H](CNC(=O)N[C@H]1CC[N@@H+](CC2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000893104203 683773630 /nfs/dbraw/zinc/77/36/30/683773630.db2.gz ZLXVUGQCYAHTJI-ZFWWWQNUSA-N 1 1 346.431 2.482 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC1CCCCC1 ZINC001029304637 683939804 /nfs/dbraw/zinc/93/98/04/683939804.db2.gz DGPOOYSFVHKJMT-YYIAUSFCSA-N 1 1 335.448 2.297 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@H+]2CCC1CCCCC1 ZINC001029304637 683939807 /nfs/dbraw/zinc/93/98/07/683939807.db2.gz DGPOOYSFVHKJMT-YYIAUSFCSA-N 1 1 335.448 2.297 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC1CCCCC1 ZINC001029304637 683939810 /nfs/dbraw/zinc/93/98/10/683939810.db2.gz DGPOOYSFVHKJMT-YYIAUSFCSA-N 1 1 335.448 2.297 20 5 EEBDMO C[C@H](CNC(=O)N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccccc1[N+](=O)[O-] ZINC000893221559 684172018 /nfs/dbraw/zinc/17/20/18/684172018.db2.gz MTYHUPWAWQZMCO-MGPQQGTHSA-N 1 1 334.420 2.480 20 5 EEBDMO O=[N+]([O-])c1cnc(NCC[N@@H+]2CCC3(C2)OCCO3)c2ccccc21 ZINC000895252455 684388141 /nfs/dbraw/zinc/38/81/41/684388141.db2.gz KDLPYLLPZGDPCI-UHFFFAOYSA-N 1 1 344.371 2.004 20 5 EEBDMO O=[N+]([O-])c1cnc(NCC[N@H+]2CCC3(C2)OCCO3)c2ccccc21 ZINC000895252455 684388147 /nfs/dbraw/zinc/38/81/47/684388147.db2.gz KDLPYLLPZGDPCI-UHFFFAOYSA-N 1 1 344.371 2.004 20 5 EEBDMO CC(C)[N@H+](CC(=O)N1CCO[C@@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350119 690857737 /nfs/dbraw/zinc/85/77/37/690857737.db2.gz XQNONLLTWVQSLK-AWEZNQCLSA-N 1 1 335.404 2.053 20 5 EEBDMO CC(C)[N@@H+](CC(=O)N1CCO[C@@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350119 690857741 /nfs/dbraw/zinc/85/77/41/690857741.db2.gz XQNONLLTWVQSLK-AWEZNQCLSA-N 1 1 335.404 2.053 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]CC[C@H](O)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000898203832 691893446 /nfs/dbraw/zinc/89/34/46/691893446.db2.gz JVZSMIHLMBQQFN-JKSUJKDBSA-N 1 1 330.388 2.168 20 5 EEBDMO CCC[N@H+]1CCC[C@@H](C(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000905321532 694602268 /nfs/dbraw/zinc/60/22/68/694602268.db2.gz JHFDKWFVRHMZJY-CQSZACIVSA-N 1 1 334.420 2.245 20 5 EEBDMO CC1(C)CN(c2ccc([N+](=O)[O-])cc2C(F)F)CC[N@H+]1CCO ZINC000865708920 1198340646 /nfs/dbraw/zinc/34/06/46/1198340646.db2.gz GJMCWZMCSSDTMX-UHFFFAOYSA-N 1 1 329.347 2.425 20 5 EEBDMO CC[C@@H]1COCC[N@@H+]1CCNc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000872772752 1198378012 /nfs/dbraw/zinc/37/80/12/1198378012.db2.gz ZYSYWSRAQCXJSW-GFCCVEGCSA-N 1 1 331.376 2.061 20 5 EEBDMO CC[C@@H]1COCC[N@H+]1CCNc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000872772752 1198378019 /nfs/dbraw/zinc/37/80/19/1198378019.db2.gz ZYSYWSRAQCXJSW-GFCCVEGCSA-N 1 1 331.376 2.061 20 5 EEBDMO COCC[N@H+]1CCC[C@@H](NC(=O)c2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC000874437876 1198890702 /nfs/dbraw/zinc/89/07/02/1198890702.db2.gz RYOVLNLZZPASAG-CQSZACIVSA-N 1 1 335.404 2.052 20 5 EEBDMO Cc1cccc(C(=O)N2CC[NH2+][C@@H](c3ccc(O)cc3)C2)c1[N+](=O)[O-] ZINC000870081534 1200450488 /nfs/dbraw/zinc/45/04/88/1200450488.db2.gz WGHXPHYOXBKQBA-MRXNPFEDSA-N 1 1 341.367 2.396 20 5 EEBDMO Cc1nn(C[N@@H+]2CC[C@@H](n3cccn3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000812293902 1200644517 /nfs/dbraw/zinc/64/45/17/1200644517.db2.gz AIZRFTFJLAFTMC-CQSZACIVSA-N 1 1 326.360 2.354 20 5 EEBDMO Cc1nn(C[N@H+]2CC[C@@H](n3cccn3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000812293902 1200644522 /nfs/dbraw/zinc/64/45/22/1200644522.db2.gz AIZRFTFJLAFTMC-CQSZACIVSA-N 1 1 326.360 2.354 20 5 EEBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1=COCCC1 ZINC000813174397 1201141989 /nfs/dbraw/zinc/14/19/89/1201141989.db2.gz RHKCCIUJUSVNFS-INIZCTEOSA-N 1 1 332.356 2.407 20 5 EEBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1=COCCC1 ZINC000813174397 1201141993 /nfs/dbraw/zinc/14/19/93/1201141993.db2.gz RHKCCIUJUSVNFS-INIZCTEOSA-N 1 1 332.356 2.407 20 5 EEBDMO CC(C)CC(=O)N1CCC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000879761099 1201245102 /nfs/dbraw/zinc/24/51/02/1201245102.db2.gz VFHGOBFUAHGEBV-KRWDZBQOSA-N 1 1 349.431 2.209 20 5 EEBDMO CC(C)CC(=O)N1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000879761099 1201245105 /nfs/dbraw/zinc/24/51/05/1201245105.db2.gz VFHGOBFUAHGEBV-KRWDZBQOSA-N 1 1 349.431 2.209 20 5 EEBDMO C[C@@]([NH3+])(C(=O)N1CCc2sccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000867927685 1201707634 /nfs/dbraw/zinc/70/76/34/1201707634.db2.gz LQIADFIFRJFWIZ-INIZCTEOSA-N 1 1 331.397 2.415 20 5 EEBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1)[N@@H+](C)C1CC1 ZINC000881911993 1201787461 /nfs/dbraw/zinc/78/74/61/1201787461.db2.gz NDFOZQRSJYKUNV-NSHDSACASA-N 1 1 332.404 2.382 20 5 EEBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCS[C@@H]4COCC[C@@H]43)c2c1 ZINC000131171453 1202028177 /nfs/dbraw/zinc/02/81/77/1202028177.db2.gz MTEOZCKLDMWEOM-DZGCQCFKSA-N 1 1 334.401 2.108 20 5 EEBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCS[C@@H]4COCC[C@@H]43)c2c1 ZINC000131171453 1202028179 /nfs/dbraw/zinc/02/81/79/1202028179.db2.gz MTEOZCKLDMWEOM-DZGCQCFKSA-N 1 1 334.401 2.108 20 5 EEBDMO COC(=O)[C@@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000886268953 1202486373 /nfs/dbraw/zinc/48/63/73/1202486373.db2.gz GWZJXKIMIUBSAX-JKSUJKDBSA-N 1 1 341.367 2.378 20 5 EEBDMO CC[N@H+]1CC[C@@H]1CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000890065339 1204775168 /nfs/dbraw/zinc/77/51/68/1204775168.db2.gz FYEHETZAHOVRSO-OAHLLOKOSA-N 1 1 332.404 2.363 20 5 EEBDMO NC(=O)C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000930498033 1206562813 /nfs/dbraw/zinc/56/28/13/1206562813.db2.gz UTCYPBGXBHAXSC-VIFPVBQESA-N 1 1 342.193 2.055 20 5 EEBDMO NC(=O)C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000930498033 1206562814 /nfs/dbraw/zinc/56/28/14/1206562814.db2.gz UTCYPBGXBHAXSC-VIFPVBQESA-N 1 1 342.193 2.055 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)cccc1[N+](=O)[O-] ZINC000931722178 1207448801 /nfs/dbraw/zinc/44/88/01/1207448801.db2.gz FKEFZQYOZMWCCK-ZNMIVQPWSA-N 1 1 346.431 2.399 20 5 EEBDMO CC(C)(C)NC(=O)[C@@H]1CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000932441601 1207607242 /nfs/dbraw/zinc/60/72/42/1207607242.db2.gz XGAUJLVOVHXFME-GJZGRUSLSA-N 1 1 335.404 2.007 20 5 EEBDMO CC(C)(C)NC(=O)[C@@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000932441601 1207607243 /nfs/dbraw/zinc/60/72/43/1207607243.db2.gz XGAUJLVOVHXFME-GJZGRUSLSA-N 1 1 335.404 2.007 20 5 EEBDMO CC1(C(=O)N2C[C@@H]3C[N@H+](Cc4cccc([N+](=O)[O-])c4)C[C@@H]3C2)CC1 ZINC001048831790 1238795681 /nfs/dbraw/zinc/79/56/81/1238795681.db2.gz FJVNOEVBTRUJHY-GASCZTMLSA-N 1 1 329.400 2.285 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)N[C@H]1C[C@H](Nc2nc(C)ccc2[N+](=O)[O-])C1 ZINC001097050203 1243624897 /nfs/dbraw/zinc/62/48/97/1243624897.db2.gz GQUANASRMMKWRW-HDJSIYSDSA-N 1 1 349.435 2.089 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)N[C@H]1C[C@H](Nc2cc(C)c([N+](=O)[O-])cn2)C1 ZINC001097078192 1243674045 /nfs/dbraw/zinc/67/40/45/1243674045.db2.gz IZOSSVHPGDEXAK-JOCQHMNTSA-N 1 1 349.435 2.088 20 5 EEBDMO Cc1cccc(C[NH+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)c1 ZINC001050517624 1243769170 /nfs/dbraw/zinc/76/91/70/1243769170.db2.gz XGMNIINGZSPDNU-IAGOWNOFSA-N 1 1 343.427 2.085 20 5 EEBDMO COc1cc(N2CC[NH+](CCOC(C)C)CC2)c([N+](=O)[O-])cc1C ZINC000853397120 1292372920 /nfs/dbraw/zinc/37/29/20/1292372920.db2.gz WSIFGTHHYZMWHD-UHFFFAOYSA-N 1 1 337.420 2.459 20 5 EEBDMO Cc1noc(COC(=O)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000853926752 1292533295 /nfs/dbraw/zinc/53/32/95/1292533295.db2.gz PQHXVFJTBQCFNI-AWEZNQCLSA-N 1 1 345.355 2.457 20 5 EEBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC000854737151 1292934520 /nfs/dbraw/zinc/93/45/20/1292934520.db2.gz NFPKAQKJNRVEFD-GOSISDBHSA-N 1 1 346.431 2.219 20 5 EEBDMO O=[N+]([O-])c1ccc(COC[C@H]2C[N@H+](Cc3ccccc3)CCO2)cn1 ZINC001224109169 1300424479 /nfs/dbraw/zinc/42/44/79/1300424479.db2.gz PQOCDSUONOYGPD-QGZVFWFLSA-N 1 1 343.383 2.407 20 5 EEBDMO O=[N+]([O-])c1ccc(COC[C@H]2C[N@@H+](Cc3ccccc3)CCO2)cn1 ZINC001224109169 1300424483 /nfs/dbraw/zinc/42/44/83/1300424483.db2.gz PQOCDSUONOYGPD-QGZVFWFLSA-N 1 1 343.383 2.407 20 5 EEBDMO O=[N+]([O-])c1ccc(COC[C@@H]2C[N@H+](Cc3ccccc3)CCO2)cn1 ZINC001224109167 1300424601 /nfs/dbraw/zinc/42/46/01/1300424601.db2.gz PQOCDSUONOYGPD-KRWDZBQOSA-N 1 1 343.383 2.407 20 5 EEBDMO O=[N+]([O-])c1ccc(COC[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)cn1 ZINC001224109167 1300424614 /nfs/dbraw/zinc/42/46/14/1300424614.db2.gz PQOCDSUONOYGPD-KRWDZBQOSA-N 1 1 343.383 2.407 20 5 EEBDMO CC(C)=CC(=O)N(C)CC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001102411895 1301001690 /nfs/dbraw/zinc/00/16/90/1301001690.db2.gz QDAHMQALLQBXCO-UHFFFAOYSA-N 1 1 346.431 2.141 20 5 EEBDMO C[NH+](C)CCCC(=O)NC1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC001228888495 1302506192 /nfs/dbraw/zinc/50/61/92/1302506192.db2.gz HARCMDXYLHNTHJ-UHFFFAOYSA-N 1 1 348.447 2.017 20 5 EEBDMO COCCCCC(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001235339323 1305198771 /nfs/dbraw/zinc/19/87/71/1305198771.db2.gz RUXXJZQQPLBZTQ-UHFFFAOYSA-N 1 1 337.420 2.350 20 5 EEBDMO O=[N+]([O-])c1ccc2cnn(C[NH+]3CCC4(CC3)OCCCO4)c2c1 ZINC000840087433 1315290402 /nfs/dbraw/zinc/29/04/02/1315290402.db2.gz XTSDCMZIXDWHMI-UHFFFAOYSA-N 1 1 332.360 2.131 20 5 EEBDMO C[C@@H]1CCN[C@@H](C)[C@@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000842475796 1315712900 /nfs/dbraw/zinc/71/29/00/1315712900.db2.gz CMPAHUIEYBJGBP-OHUAYANFSA-N 1 1 338.383 2.039 20 5 EEBDMO CN1C[C@@]2(CC1=O)CCCC[N@H+]2[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254599425 1318140526 /nfs/dbraw/zinc/14/05/26/1318140526.db2.gz ZFGQFPYVNVVVOH-AEFFLSMTSA-N 1 1 329.400 2.149 20 5 EEBDMO O=C(NCCC[NH2+]Cc1ccc(Cl)cc1Cl)[C@@H]1CC1[N+](=O)[O-] ZINC001157767740 1318847202 /nfs/dbraw/zinc/84/72/02/1318847202.db2.gz SIYXXCFMXMLQSN-DGCLKSJQSA-N 1 1 346.214 2.255 20 5 EEBDMO COCCC(=O)NCCC1=CC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001159068479 1319591854 /nfs/dbraw/zinc/59/18/54/1319591854.db2.gz FTBUSCDPDBWGAG-UHFFFAOYSA-N 1 1 347.415 2.270 20 5 EEBDMO [NH3+][C@H]1CN(c2nc(Cl)nc3ccc([N+](=O)[O-])cc32)CCC1(F)F ZINC001164319586 1321350781 /nfs/dbraw/zinc/35/07/81/1321350781.db2.gz KFWBALPSXZLDDV-JTQLQIEISA-N 1 1 343.721 2.364 20 5 EEBDMO Cc1ccc(C)c(C[NH2+]CC2(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001164490397 1321394550 /nfs/dbraw/zinc/39/45/50/1321394550.db2.gz HWZUUJZJAPZMIT-IAGOWNOFSA-N 1 1 345.443 2.345 20 5 EEBDMO Nc1nc(N2C[C@H]3[C@@H](CC[N@H+]3Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001165082027 1321452058 /nfs/dbraw/zinc/45/20/58/1321452058.db2.gz CHYSOKTZJUJWRX-HOCLYGCPSA-N 1 1 339.399 2.283 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(C(F)(F)c3cc([N+](=O)[O-])cnc3Cl)C[C@H]2C1 ZINC001165152499 1321466592 /nfs/dbraw/zinc/46/65/92/1321466592.db2.gz XZXHQQIHHRWZAX-DTORHVGOSA-N 1 1 332.738 2.186 20 5 EEBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1cc(Cl)cc([N+](=O)[O-])n1)CC2 ZINC001166032313 1321639136 /nfs/dbraw/zinc/63/91/36/1321639136.db2.gz DRWTUTDPVRYLHG-UHFFFAOYSA-N 1 1 339.783 2.278 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@]1(CO)c1ccccc1 ZINC001308161273 1331568769 /nfs/dbraw/zinc/56/87/69/1331568769.db2.gz BHVBXPXEVSOIIM-KRWDZBQOSA-N 1 1 330.388 2.083 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2NC)C1 ZINC001318906631 1332621192 /nfs/dbraw/zinc/62/11/92/1332621192.db2.gz MMXHTIUJYIXIHU-ZDUSSCGKSA-N 1 1 334.420 2.440 20 5 EEBDMO Cc1cc(NCC[N@@H+]2CCCC[C@H]2C)c(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001609409282 1351965017 /nfs/dbraw/zinc/96/50/17/1351965017.db2.gz FZKOJXOAVXXQFN-GFCCVEGCSA-N 1 1 345.407 2.370 20 5 EEBDMO CN1CC[N@@H+](C)C[C@H]1CNc1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC001335843869 1336436159 /nfs/dbraw/zinc/43/61/59/1336436159.db2.gz SCZVULVFFVXZQR-LLVKDONJSA-N 1 1 332.326 2.271 20 5 EEBDMO C[C@@H](CNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC001603893705 1350795805 /nfs/dbraw/zinc/79/58/05/1350795805.db2.gz AMVSXJJSFJGPIN-NEPJUHHUSA-N 1 1 345.407 2.450 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC1(C)CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001110598080 1369127985 /nfs/dbraw/zinc/12/79/85/1369127985.db2.gz JKJCSDVKDLJBMD-UHFFFAOYSA-N 1 1 348.447 2.412 20 5 EEBDMO C[C@@H](O)C[C@@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1 ZINC000853504364 1369341119 /nfs/dbraw/zinc/34/11/19/1369341119.db2.gz QHWJRMAVHVUFAC-OLZOCXBDSA-N 1 1 331.376 2.046 20 5 EEBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1 ZINC000853504364 1369341125 /nfs/dbraw/zinc/34/11/25/1369341125.db2.gz QHWJRMAVHVUFAC-OLZOCXBDSA-N 1 1 331.376 2.046 20 5 EEBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286398463 1369749801 /nfs/dbraw/zinc/74/98/01/1369749801.db2.gz ZJWPEIXZPKZMGO-NNQSOWQGSA-N 1 1 346.431 2.358 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N1CCC(N(C)c2ccccc2[N+](=O)[O-])CC1 ZINC001115144968 1371529823 /nfs/dbraw/zinc/52/98/23/1371529823.db2.gz WIWCLBYACULPPK-UHFFFAOYSA-N 1 1 348.447 2.364 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NCC1(Nc2ncccc2[N+](=O)[O-])CCC1 ZINC001111869586 1410854305 /nfs/dbraw/zinc/85/43/05/1410854305.db2.gz ZKDHSTOVOOAARQ-UHFFFAOYSA-N 1 1 349.435 2.171 20 5 EEBDMO O=[N+]([O-])c1ccnc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164725222 720333058 /nfs/dbraw/zinc/33/30/58/720333058.db2.gz MRDCRFZJXFWONI-JKSUJKDBSA-N 1 1 325.372 2.238 20 5 EEBDMO Cc1ccn(C)c1C(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001031631932 770483247 /nfs/dbraw/zinc/48/32/47/770483247.db2.gz IKLFKIOXQVDSKI-UHFFFAOYSA-N 1 1 342.399 2.104 20 5 EEBDMO Cc1c(C(=O)NCC2C[NH+](Cc3ccc([N+](=O)[O-])cc3)C2)ccn1C ZINC001031956872 780665127 /nfs/dbraw/zinc/66/51/27/780665127.db2.gz HFABPOOGNKBBRN-UHFFFAOYSA-N 1 1 342.399 2.104 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NC/C=C\CNc1ccc(F)cc1[N+](=O)[O-] ZINC001107233221 786548705 /nfs/dbraw/zinc/54/87/05/786548705.db2.gz MRUDGLQMHWTLEP-PLNGDYQASA-N 1 1 338.383 2.158 20 5 EEBDMO COc1nc(SC)nc(N[C@H]2C[C@H]3CC[N@@H+](C2)[C@H]3C)c1[N+](=O)[O-] ZINC001170964028 786738667 /nfs/dbraw/zinc/73/86/67/786738667.db2.gz IGSAEQUTIRLZSO-AEJSXWLSSA-N 1 1 339.421 2.010 20 5 EEBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000823981390 788007300 /nfs/dbraw/zinc/00/73/00/788007300.db2.gz XBNNEJNEKWHISO-LBPRGKRZSA-N 1 1 335.408 2.276 20 5 EEBDMO C[N@@H+](CCCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000824615587 788244269 /nfs/dbraw/zinc/24/42/69/788244269.db2.gz JAVJZWRQOKOYIM-KRWDZBQOSA-N 1 1 349.431 2.399 20 5 EEBDMO Cc1nn(C[N@H+]2CCC[C@H](OC(C)C)C2)c2ncc([N+](=O)[O-])cc12 ZINC000844715324 789318241 /nfs/dbraw/zinc/31/82/41/789318241.db2.gz CEIVXVOJAPZLSY-AWEZNQCLSA-N 1 1 333.392 2.495 20 5 EEBDMO Cc1nn(C[N@@H+]2CCC[C@H](OC(C)C)C2)c2ncc([N+](=O)[O-])cc12 ZINC000844715324 789318249 /nfs/dbraw/zinc/31/82/49/789318249.db2.gz CEIVXVOJAPZLSY-AWEZNQCLSA-N 1 1 333.392 2.495 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)NCC1(Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC001110150270 795726324 /nfs/dbraw/zinc/72/63/24/795726324.db2.gz ZLNJYINCYHRVBT-UHFFFAOYSA-N 1 1 343.387 2.169 20 5 EEBDMO CN1CCN(CC[N@H+](C)[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172922578 797153229 /nfs/dbraw/zinc/15/32/29/797153229.db2.gz YRJBVNZPFHTEKW-SFHVURJKSA-N 1 1 346.475 2.021 20 5 EEBDMO CN1CCN(CC[N@@H+](C)[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172922578 797153232 /nfs/dbraw/zinc/15/32/32/797153232.db2.gz YRJBVNZPFHTEKW-SFHVURJKSA-N 1 1 346.475 2.021 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCn3cncc3C2)c1F ZINC001173196487 797283879 /nfs/dbraw/zinc/28/38/79/797283879.db2.gz MUCVIFCILJITQH-NSHDSACASA-N 1 1 334.351 2.386 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCn3cncc3C2)c1F ZINC001173196487 797283883 /nfs/dbraw/zinc/28/38/83/797283883.db2.gz MUCVIFCILJITQH-NSHDSACASA-N 1 1 334.351 2.386 20 5 EEBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C1CCS(=O)(=O)CC1 ZINC001173235833 797312812 /nfs/dbraw/zinc/31/28/12/797312812.db2.gz ZRMKQPFGSGHEQO-LBPRGKRZSA-N 1 1 326.418 2.035 20 5 EEBDMO C[NH+]1CCN(c2ncc(Nc3ccc(/C=C/[N+](=O)[O-])cc3)cn2)CC1 ZINC001175899411 798281320 /nfs/dbraw/zinc/28/13/20/798281320.db2.gz TUPZZKUCXGCSAW-VOTSOKGWSA-N 1 1 340.387 2.219 20 5 EEBDMO Cc1cc(C)cc(C[NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001002781449 798602794 /nfs/dbraw/zinc/60/27/94/798602794.db2.gz CHYNUSDZPONMBZ-IAGOWNOFSA-N 1 1 331.416 2.049 20 5 EEBDMO CC(C)(C)OC(=O)N1CC2(CC[N@H+]2[C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169012498 803571053 /nfs/dbraw/zinc/57/10/53/803571053.db2.gz QPKNABSYNRUDJP-OLZOCXBDSA-N 1 1 325.409 2.127 20 5 EEBDMO C[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CCN1C(=O)OC(C)(C)C ZINC001169011715 803571075 /nfs/dbraw/zinc/57/10/75/803571075.db2.gz MHYJJSHQWYHBTE-HZSPNIEDSA-N 1 1 327.425 2.373 20 5 EEBDMO CC(C)(C)OC(=O)N1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169018024 803586445 /nfs/dbraw/zinc/58/64/45/803586445.db2.gz BIOFWDBLZKTWDB-KGLIPLIRSA-N 1 1 327.425 2.375 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2CCn3cnc(COCC4CC4)c3C2)C1 ZINC001169018412 803587177 /nfs/dbraw/zinc/58/71/77/803587177.db2.gz BDNGUVCZVCIDGD-LSDHHAIUSA-N 1 1 334.420 2.071 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCn3cnc(COCC4CC4)c3C2)C1 ZINC001169018412 803587181 /nfs/dbraw/zinc/58/71/81/803587181.db2.gz BDNGUVCZVCIDGD-LSDHHAIUSA-N 1 1 334.420 2.071 20 5 EEBDMO COC(=O)[C@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)[C@H]1C ZINC000787241848 807050181 /nfs/dbraw/zinc/05/01/81/807050181.db2.gz HJKUWLLQQSGBBM-AAEUAGOBSA-N 1 1 332.360 2.094 20 5 EEBDMO COC(=O)[C@H]1CC[N@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)[C@@H]1C ZINC000787246756 807051953 /nfs/dbraw/zinc/05/19/53/807051953.db2.gz RJGMULBPTBBVCQ-RISCZKNCSA-N 1 1 332.360 2.094 20 5 EEBDMO COC(=O)[C@H]1CC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)[C@@H]1C ZINC000787246756 807051959 /nfs/dbraw/zinc/05/19/59/807051959.db2.gz RJGMULBPTBBVCQ-RISCZKNCSA-N 1 1 332.360 2.094 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O)Nc1ccccc1[N+](=O)[O-] ZINC000451418086 243105897 /nfs/dbraw/zinc/10/58/97/243105897.db2.gz LZLCBGJBUBTRQF-BJJXKVORSA-N 1 1 333.388 2.159 20 5 EEBDMO CN(C(=O)C[N@H+]1CC[C@@H]2C[C@@H](O)CC[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000451693934 243207983 /nfs/dbraw/zinc/20/79/83/243207983.db2.gz KANLDRANMDOYCC-KEYYUXOJSA-N 1 1 347.415 2.041 20 5 EEBDMO O=C(C[N@@H+]1CC[C@@H]2C[C@H](O)CC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000451698052 243210739 /nfs/dbraw/zinc/21/07/39/243210739.db2.gz RPIMXIUXRUXHQJ-MGPQQGTHSA-N 1 1 333.388 2.016 20 5 EEBDMO O=C(C[N@H+]1CC[C@@H]2C[C@H](O)CC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000451698052 243210744 /nfs/dbraw/zinc/21/07/44/243210744.db2.gz RPIMXIUXRUXHQJ-MGPQQGTHSA-N 1 1 333.388 2.016 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC[C@H]1[C@H](C)O ZINC000246338642 243232827 /nfs/dbraw/zinc/23/28/27/243232827.db2.gz KZFLMFSQIMOBBB-BBRMVZONSA-N 1 1 335.404 2.467 20 5 EEBDMO O=C(/C=C\c1ccc(F)cc1[N+](=O)[O-])NC[C@@H]1CCc2[nH+]ccn2C1 ZINC000491960440 246230963 /nfs/dbraw/zinc/23/09/63/246230963.db2.gz HKYDSCKSDROZCJ-RYBZSIHZSA-N 1 1 344.346 2.322 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(CCCC[NH+]3CCOCC3)n2)cc1 ZINC000265071704 247178308 /nfs/dbraw/zinc/17/83/08/247178308.db2.gz XJOWLGKHESZYFK-UHFFFAOYSA-N 1 1 332.360 2.300 20 5 EEBDMO CSc1ccc(C(=O)NCc2c[nH+]c(N(C)C)n2C)cc1[N+](=O)[O-] ZINC000265111003 247212591 /nfs/dbraw/zinc/21/25/91/247212591.db2.gz KNILUKQQPVGKNL-UHFFFAOYSA-N 1 1 349.416 2.046 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000266389761 248277587 /nfs/dbraw/zinc/27/75/87/248277587.db2.gz JPPRIAIAVWOQFC-CQSZACIVSA-N 1 1 344.415 2.350 20 5 EEBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000266451281 248307621 /nfs/dbraw/zinc/30/76/21/248307621.db2.gz AYMQSHDFCLVMKU-ZBFHGGJFSA-N 1 1 332.404 2.063 20 5 EEBDMO C[C@H]([C@H](C)[N@H+](C)CCCOc1ccc([N+](=O)[O-])cc1)S(C)(=O)=O ZINC000113257528 220497727 /nfs/dbraw/zinc/49/77/27/220497727.db2.gz CFMUYWIMEIWVFI-QWHCGFSZSA-N 1 1 344.433 2.117 20 5 EEBDMO C[C@H]([C@H](C)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1)S(C)(=O)=O ZINC000113257528 220497731 /nfs/dbraw/zinc/49/77/31/220497731.db2.gz CFMUYWIMEIWVFI-QWHCGFSZSA-N 1 1 344.433 2.117 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000270497419 256141730 /nfs/dbraw/zinc/14/17/30/256141730.db2.gz JXWBTEDZZWRKRQ-CZUORRHYSA-N 1 1 334.420 2.119 20 5 EEBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000270577228 256150295 /nfs/dbraw/zinc/15/02/95/256150295.db2.gz PQETVXCXRCHFGV-USXIJHARSA-N 1 1 349.431 2.282 20 5 EEBDMO COCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)c1ccccc1 ZINC000270611430 256153181 /nfs/dbraw/zinc/15/31/81/256153181.db2.gz ZFVWJSYHMJDGSZ-HNNXBMFYSA-N 1 1 345.399 2.466 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000271283049 256228765 /nfs/dbraw/zinc/22/87/65/256228765.db2.gz CJRYJVXVRWEZBF-JOYOIKCWSA-N 1 1 349.416 2.012 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](Cn2ccnn2)C1 ZINC000119130767 221250326 /nfs/dbraw/zinc/25/03/26/221250326.db2.gz AQBSFCAICXUHRY-CYBMUJFWSA-N 1 1 331.376 2.107 20 5 EEBDMO CC[C@@H](C)[N@@H+](C)CCNS(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000120375087 142387358 /nfs/dbraw/zinc/38/73/58/142387358.db2.gz IYWHXBZMGWZNQS-GFCCVEGCSA-N 1 1 343.449 2.220 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000067996776 292161064 /nfs/dbraw/zinc/16/10/64/292161064.db2.gz SKQZCEDHNRMCOH-AWEZNQCLSA-N 1 1 347.371 2.376 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000346238246 152866609 /nfs/dbraw/zinc/86/66/09/152866609.db2.gz OHVSMRRZPMZZBH-HEHGZKQESA-N 1 1 347.415 2.406 20 5 EEBDMO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCOC1 ZINC000352200992 153002758 /nfs/dbraw/zinc/00/27/58/153002758.db2.gz CSZYLKFXGQRONZ-LLVKDONJSA-N 1 1 327.768 2.298 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCOC1 ZINC000352200992 153002762 /nfs/dbraw/zinc/00/27/62/153002762.db2.gz CSZYLKFXGQRONZ-LLVKDONJSA-N 1 1 327.768 2.298 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CCc1ccccn1 ZINC000129938133 292365161 /nfs/dbraw/zinc/36/51/61/292365161.db2.gz VVJYLPAZWLCWBT-ZDUSSCGKSA-N 1 1 328.372 2.491 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1ccccn1 ZINC000129938133 292365163 /nfs/dbraw/zinc/36/51/63/292365163.db2.gz VVJYLPAZWLCWBT-ZDUSSCGKSA-N 1 1 328.372 2.491 20 5 EEBDMO CN(C[C@@H]1CCC[N@H+]1C)c1ncc(Br)cc1[N+](=O)[O-] ZINC000092670717 159225443 /nfs/dbraw/zinc/22/54/43/159225443.db2.gz NNYPKAHDERUBFE-JTQLQIEISA-N 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DPKLDSDQULIBOP-OAHLLOKOSA-N 1 1 349.431 2.148 20 5 EEBDMO COc1ccc(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000377576154 467090183 /nfs/dbraw/zinc/09/01/83/467090183.db2.gz WUNYXLRSDLYPLT-ZDUSSCGKSA-N 1 1 333.388 2.350 20 5 EEBDMO C[C@@H](CO)[N@H+]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432172106 467221685 /nfs/dbraw/zinc/22/16/85/467221685.db2.gz KBYGJZVLOAIXIJ-ZDUSSCGKSA-N 1 1 330.388 2.036 20 5 EEBDMO CC[C@@]1(O)CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000428433303 467233709 /nfs/dbraw/zinc/23/37/09/467233709.db2.gz SPMGVFCMBBPNPE-QGZVFWFLSA-N 1 1 330.388 2.342 20 5 EEBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H](O)COCC(F)(F)F)C1CC1 ZINC000432775841 467263163 /nfs/dbraw/zinc/26/31/63/467263163.db2.gz KLEPJQYTEJHZOW-CYBMUJFWSA-N 1 1 348.321 2.499 20 5 EEBDMO COC[C@]1(CO)CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000451926813 467284660 /nfs/dbraw/zinc/28/46/60/467284660.db2.gz IHZILJLMWAZZKC-QGZVFWFLSA-N 1 1 347.371 2.081 20 5 EEBDMO COC[C@]1(CO)CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000451926813 467284665 /nfs/dbraw/zinc/28/46/65/467284665.db2.gz IHZILJLMWAZZKC-QGZVFWFLSA-N 1 1 347.371 2.081 20 5 EEBDMO CCn1nccc1C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000429718897 467362207 /nfs/dbraw/zinc/36/22/07/467362207.db2.gz BOMAOVVOHZZSCT-UHFFFAOYSA-N 1 1 331.376 2.272 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)c1[N+](=O)[O-] ZINC000434244361 467383808 /nfs/dbraw/zinc/38/38/08/467383808.db2.gz HNGQZECYQICUEM-CYBMUJFWSA-N 1 1 349.435 2.436 20 5 EEBDMO O=[N+]([O-])c1ccccc1CNc1nc(N[C@@H]2CCCOC2)cc[nH+]1 ZINC000435352005 467461837 /nfs/dbraw/zinc/46/18/37/467461837.db2.gz YQOLPOBWAZQUPV-CYBMUJFWSA-N 1 1 329.360 2.588 20 5 EEBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000408069980 467503790 /nfs/dbraw/zinc/50/37/90/467503790.db2.gz HAQIRZVSRLJCMP-RYUDHWBXSA-N 1 1 328.372 2.308 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(c3ncnc4cccc([N+](=O)[O-])c43)CC[C@@H]21 ZINC000408194147 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KCXKHUKXGBOWCY-ZDUSSCGKSA-N 1 1 341.371 2.110 20 5 EEBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000533454001 468201347 /nfs/dbraw/zinc/20/13/47/468201347.db2.gz FTMRQPUFRLJMPI-WFASDCNBSA-N 1 1 332.404 2.022 20 5 EEBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H](n3ccnn3)C2)cc1 ZINC000591851637 468531785 /nfs/dbraw/zinc/53/17/85/468531785.db2.gz SBUWXZJGRZXEPX-OAHLLOKOSA-N 1 1 331.376 2.292 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)c1 ZINC000582454263 468541429 /nfs/dbraw/zinc/54/14/29/468541429.db2.gz SXXCERHQKQAASL-LSDHHAIUSA-N 1 1 347.415 2.367 20 5 EEBDMO COc1ccc(CC(=O)NCC[N@H+]2CCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000569874399 468556292 /nfs/dbraw/zinc/55/62/92/468556292.db2.gz CXBCSWPWEZICAE-UHFFFAOYSA-N 1 1 349.431 2.384 20 5 EEBDMO CNc1c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-] ZINC000594418834 468579321 /nfs/dbraw/zinc/57/93/21/468579321.db2.gz MFMHRGDZZQDXLU-KGLIPLIRSA-N 1 1 332.404 2.383 20 5 EEBDMO CC(C)NC(=O)c1ccc(N2C[C@@H](C)[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000570271322 468613584 /nfs/dbraw/zinc/61/35/84/468613584.db2.gz VFEFYTDWQKHFRG-CHWSQXEVSA-N 1 1 334.420 2.262 20 5 EEBDMO C[C@@H]1CC2(C[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-])CCOCC2 ZINC000592182219 468648003 /nfs/dbraw/zinc/64/80/03/468648003.db2.gz MUFSLCXGAVBHBY-CYBMUJFWSA-N 1 1 333.388 2.424 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000597855433 468694599 /nfs/dbraw/zinc/69/45/99/468694599.db2.gz QOKRDXNDUMDROO-ZDUSSCGKSA-N 1 1 335.404 2.210 20 5 EEBDMO CC[C@H]1CN(C)CC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000571503731 468796993 /nfs/dbraw/zinc/79/69/93/468796993.db2.gz OEVRAKRUMFLTIA-AWEZNQCLSA-N 1 1 334.420 2.258 20 5 EEBDMO CC[C@H]1C[N@H+](C)CCN1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000571503731 468796998 /nfs/dbraw/zinc/79/69/98/468796998.db2.gz OEVRAKRUMFLTIA-AWEZNQCLSA-N 1 1 334.420 2.258 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCN1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000571503731 468797002 /nfs/dbraw/zinc/79/70/02/468797002.db2.gz OEVRAKRUMFLTIA-AWEZNQCLSA-N 1 1 334.420 2.258 20 5 EEBDMO O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000598222077 468797945 /nfs/dbraw/zinc/79/79/45/468797945.db2.gz ZWAXDMJLSIYNME-CQSZACIVSA-N 1 1 347.415 2.497 20 5 EEBDMO Cc1noc(C[N@H+]2C[C@H]3CN(c4ccccc4)C[C@H]3C2)c1[N+](=O)[O-] ZINC000595293427 468802895 /nfs/dbraw/zinc/80/28/95/468802895.db2.gz NLGPCUFINSRQOH-OKILXGFUSA-N 1 1 328.372 2.459 20 5 EEBDMO Cc1noc(C[N@@H+]2C[C@H]3CN(c4ccccc4)C[C@H]3C2)c1[N+](=O)[O-] ZINC000595293427 468802897 /nfs/dbraw/zinc/80/28/97/468802897.db2.gz NLGPCUFINSRQOH-OKILXGFUSA-N 1 1 328.372 2.459 20 5 EEBDMO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000593314749 468936643 /nfs/dbraw/zinc/93/66/43/468936643.db2.gz HGILOFZQGXNKCO-CKEIUWERSA-N 1 1 337.395 2.452 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](C)[C@@H](CO)C1 ZINC000598647000 468943913 /nfs/dbraw/zinc/94/39/13/468943913.db2.gz BOTGSENXRVVLIG-GXTWGEPZSA-N 1 1 335.404 2.182 20 5 EEBDMO C[C@H](CO)[C@H]1CCCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000595671425 468946727 /nfs/dbraw/zinc/94/67/27/468946727.db2.gz GFVIQJAYKXYLJP-CZUORRHYSA-N 1 1 335.404 2.041 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCC[C@H]1[C@@H](C)CO ZINC000595677549 468950208 /nfs/dbraw/zinc/95/02/08/468950208.db2.gz OWFPEAKTLYGAFE-KBPBESRZSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCCC[C@H]1[C@@H](C)CO ZINC000595677549 468950213 /nfs/dbraw/zinc/95/02/13/468950213.db2.gz OWFPEAKTLYGAFE-KBPBESRZSA-N 1 1 335.404 2.325 20 5 EEBDMO CN(C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cccnc1[N+](=O)[O-] ZINC000614533756 468966395 /nfs/dbraw/zinc/96/63/95/468966395.db2.gz VSYDQRDXVMJMAP-SFHVURJKSA-N 1 1 342.399 2.063 20 5 EEBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1COCCO1 ZINC000595738025 468980420 /nfs/dbraw/zinc/98/04/20/468980420.db2.gz UYDIWRGEEUAJDN-LBPRGKRZSA-N 1 1 334.294 2.461 20 5 EEBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1COCCO1 ZINC000595738025 468980425 /nfs/dbraw/zinc/98/04/25/468980425.db2.gz UYDIWRGEEUAJDN-LBPRGKRZSA-N 1 1 334.294 2.461 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNc1cc2c(cc1[N+](=O)[O-])n(C)c(=O)n2C ZINC000585706847 469017691 /nfs/dbraw/zinc/01/76/91/469017691.db2.gz SDVKSMATUQQUJZ-LBPRGKRZSA-N 1 1 347.419 2.072 20 5 EEBDMO COc1ccc(CC(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000573778450 469203113 /nfs/dbraw/zinc/20/31/13/469203113.db2.gz XFVBKNDFWGKQOA-CQSZACIVSA-N 1 1 335.404 2.087 20 5 EEBDMO CCOc1cc(N2CCC[C@@H]([NH+]3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000596246255 469219508 /nfs/dbraw/zinc/21/95/08/469219508.db2.gz DFKVQVXDENMYSY-OAHLLOKOSA-N 1 1 335.404 2.295 20 5 EEBDMO CNC(=O)c1ccc(N2CC[N@@H+](C)C3(CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000596251062 469221333 /nfs/dbraw/zinc/22/13/33/469221333.db2.gz KVPYTFGURHZTHI-UHFFFAOYSA-N 1 1 346.431 2.409 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCN(c2cccc(F)c2)CC1 ZINC000603017992 469224510 /nfs/dbraw/zinc/22/45/10/469224510.db2.gz ZNEFPIJNTUHXRG-UHFFFAOYSA-N 1 1 333.367 2.061 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000615496300 469249686 /nfs/dbraw/zinc/24/96/86/469249686.db2.gz SFFIVPMFTVXIAE-VXGBXAGGSA-N 1 1 332.404 2.016 20 5 EEBDMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@H]2CCN(C3CC3)C2)n1 ZINC000616008145 469353303 /nfs/dbraw/zinc/35/33/03/469353303.db2.gz PDPGZPPDZVSSBB-VNQPRFMTSA-N 1 1 333.436 2.349 20 5 EEBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC[N@@H+](CC2CCC2)CC1 ZINC000619868417 469691100 /nfs/dbraw/zinc/69/11/00/469691100.db2.gz YSLZFBOZJZLOSC-UHFFFAOYSA-N 1 1 331.416 2.472 20 5 EEBDMO Cc1nc([N+](=O)[O-])cn1CCc1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)no1 ZINC000618399352 469984160 /nfs/dbraw/zinc/98/41/60/469984160.db2.gz INKUELGSQQJKFS-YHWZYXNKSA-N 1 1 346.391 2.066 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@]23CCOC3=O)cccc1[N+](=O)[O-] ZINC000186746138 533900393 /nfs/dbraw/zinc/90/03/93/533900393.db2.gz 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COCCC[N@@H+](CCOC)Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000764921239 577490914 /nfs/dbraw/zinc/49/09/14/577490914.db2.gz MYUJCAVQIZSZRJ-UHFFFAOYSA-N 1 1 336.392 2.195 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)[C@@H](C)C1 ZINC000770135607 577590971 /nfs/dbraw/zinc/59/09/71/577590971.db2.gz VWJAGSLFOOMNJI-WDEREUQCSA-N 1 1 336.417 2.096 20 5 EEBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CC1(O)CCC1 ZINC000759877323 577652868 /nfs/dbraw/zinc/65/28/68/577652868.db2.gz RHFBRLHHBBGGMS-JTQLQIEISA-N 1 1 341.795 2.422 20 5 EEBDMO C[C@H]([N@@H+](C)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1(C)CC1 ZINC000753108359 577781702 /nfs/dbraw/zinc/78/17/02/577781702.db2.gz DAQJZIQQXGNSCX-LBPRGKRZSA-N 1 1 346.387 2.441 20 5 EEBDMO Cn1cc([N+](=O)[O-])cc1C(=O)O[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000735209901 578140698 /nfs/dbraw/zinc/14/06/98/578140698.db2.gz CSXZRAZUDJNSIC-OAHLLOKOSA-N 1 1 329.356 2.365 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000804775355 675629315 /nfs/dbraw/zinc/62/93/15/675629315.db2.gz GXJYXKSRDQJHAM-LBPRGKRZSA-N 1 1 339.367 2.103 20 5 EEBDMO Cn1c2ccccc2c(N[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1=O ZINC000891999427 677890340 /nfs/dbraw/zinc/89/03/40/677890340.db2.gz DWEXXYIJVGLIMD-NSHDSACASA-N 1 1 328.372 2.095 20 5 EEBDMO C[C@H]1C[C@@H](Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000892875649 683159140 /nfs/dbraw/zinc/15/91/40/683159140.db2.gz HPPZRFNXINAJIO-NWDGAFQWSA-N 1 1 342.399 2.484 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21)c1ccco1 ZINC001025655409 683221990 /nfs/dbraw/zinc/22/19/90/683221990.db2.gz AJSYPALDKYMYND-FOLVSLTJSA-N 1 1 327.340 2.048 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCC2(C[C@H]1F)OCCO2 ZINC000892939702 683232311 /nfs/dbraw/zinc/23/23/11/683232311.db2.gz UYEVKESIDXEABU-ZIAGYGMSSA-N 1 1 340.351 2.327 20 5 EEBDMO Cc1cocc1C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21 ZINC001025947788 683679988 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1 1 331.376 2.061 20 5 EEBDMO Cc1c(CC(=O)OCCC[N@H+]2CCO[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000893387064 685186858 /nfs/dbraw/zinc/18/68/58/685186858.db2.gz ZCAPGPIFWXMOCT-CYBMUJFWSA-N 1 1 336.388 2.100 20 5 EEBDMO Cc1ccc(C[N@H+](C)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1F ZINC000985434218 686711986 /nfs/dbraw/zinc/71/19/86/686711986.db2.gz RHPZOYGVDDWNOD-NVXWUHKLSA-N 1 1 349.406 2.222 20 5 EEBDMO Cc1ccc(C[N@@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1F ZINC000985434218 686711989 /nfs/dbraw/zinc/71/19/89/686711989.db2.gz RHPZOYGVDDWNOD-NVXWUHKLSA-N 1 1 349.406 2.222 20 5 EEBDMO Cc1ccc(C[N@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1F ZINC000985434218 686711993 /nfs/dbraw/zinc/71/19/93/686711993.db2.gz RHPZOYGVDDWNOD-NVXWUHKLSA-N 1 1 349.406 2.222 20 5 EEBDMO Cc1ncc(C(=O)N2CCC([NH2+]Cc3ccccc3[N+](=O)[O-])CC2)[nH]1 ZINC000990287146 692797112 /nfs/dbraw/zinc/79/71/12/692797112.db2.gz IXWXVDZIJXHYPN-UHFFFAOYSA-N 1 1 343.387 2.021 20 5 EEBDMO Cc1c[nH]cc1C(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001032183382 1192856913 /nfs/dbraw/zinc/85/69/13/1192856913.db2.gz IWSJJQZIVFTCMY-UHFFFAOYSA-N 1 1 328.372 2.093 20 5 EEBDMO C[N@@H+](Cc1cn(C[C@@H](O)c2cccc([N+](=O)[O-])c2)nn1)C(C)(C)C ZINC000905822230 1189934531 /nfs/dbraw/zinc/93/45/31/1189934531.db2.gz XSEFHAPONZCLJY-OAHLLOKOSA-N 1 1 333.392 2.150 20 5 EEBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccccc2F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643750 1196465073 /nfs/dbraw/zinc/46/50/73/1196465073.db2.gz RRHSJBGRQVNPPM-IXYNUQLISA-N 1 1 335.379 2.008 20 5 EEBDMO C[C@@H](c1ccccc1)[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])C(N)=O ZINC000794720270 1197915073 /nfs/dbraw/zinc/91/50/73/1197915073.db2.gz MLBBQHXDXBYGKI-MEDUHNTESA-N 1 1 331.347 2.481 20 5 EEBDMO COC(=O)N1CCC(CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000865801598 1198381808 /nfs/dbraw/zinc/38/18/08/1198381808.db2.gz ADZFAVJQWISEOX-UHFFFAOYSA-N 1 1 344.371 2.455 20 5 EEBDMO Cc1c(C[NH2+]Cc2cccc(N3CCOCC3)n2)cccc1[N+](=O)[O-] ZINC000873108720 1198501446 /nfs/dbraw/zinc/50/14/46/1198501446.db2.gz QOOSPWRRIXVMKF-UHFFFAOYSA-N 1 1 342.399 2.425 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CCN(c3[nH]cc[nH+]3)CC2)c(OC(F)F)c1 ZINC000811840428 1200348046 /nfs/dbraw/zinc/34/80/46/1200348046.db2.gz XTBSVCRBJRHISP-UHFFFAOYSA-N 1 1 339.302 2.246 20 5 EEBDMO CC[C@]1(O)CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000879310140 1200988720 /nfs/dbraw/zinc/98/87/20/1200988720.db2.gz DUSMZESJITYVES-HNNXBMFYSA-N 1 1 341.795 2.424 20 5 EEBDMO CC[C@]1(O)CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000879310140 1200988725 /nfs/dbraw/zinc/98/87/25/1200988725.db2.gz DUSMZESJITYVES-HNNXBMFYSA-N 1 1 341.795 2.424 20 5 EEBDMO COc1ccc(C[N@@H+](CCO)C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000880572418 1201526705 /nfs/dbraw/zinc/52/67/05/1201526705.db2.gz QZFIFDAZGLDFAM-SFHVURJKSA-N 1 1 346.383 2.131 20 5 EEBDMO Cc1ccc(N2CCC(NC(=O)C[N@H+](C)C(C)C)CC2)c([N+](=O)[O-])c1 ZINC001095418498 1205721880 /nfs/dbraw/zinc/72/18/80/1205721880.db2.gz MXVDHLKAWVJBSA-UHFFFAOYSA-N 1 1 348.447 2.328 20 5 EEBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000932297958 1207577959 /nfs/dbraw/zinc/57/79/59/1207577959.db2.gz GOOMSVVGNCMAIE-HYVNUMGLSA-N 1 1 329.400 2.299 20 5 EEBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000155440446 1208327113 /nfs/dbraw/zinc/32/71/13/1208327113.db2.gz IEOASPIVWIHJEG-DOMZBBRYSA-N 1 1 331.376 2.046 20 5 EEBDMO COCC[N@@H+](CC(C)C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000075666586 1208799702 /nfs/dbraw/zinc/79/97/02/1208799702.db2.gz LJZOTVBHYNLTJO-UHFFFAOYSA-N 1 1 333.392 2.415 20 5 EEBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCS[C@H]3COCC[C@H]32)c1 ZINC000246786305 1213156556 /nfs/dbraw/zinc/15/65/56/1213156556.db2.gz IPTYOFBNEOEKBW-CABCVRRESA-N 1 1 334.401 2.108 20 5 EEBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCS[C@H]3COCC[C@H]32)c1 ZINC000246786305 1213156559 /nfs/dbraw/zinc/15/65/59/1213156559.db2.gz IPTYOFBNEOEKBW-CABCVRRESA-N 1 1 334.401 2.108 20 5 EEBDMO CN(CC[C@H]1CCCC[N@H+]1C)S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119869760 1229619511 /nfs/dbraw/zinc/61/95/11/1229619511.db2.gz WVRIPUBEPWQKOQ-LLVKDONJSA-N 1 1 347.462 2.151 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NCCCN(c1ccccc1[N+](=O)[O-])C1CC1 ZINC001096039174 1233849587 /nfs/dbraw/zinc/84/95/87/1233849587.db2.gz XTVYOMULELBIMH-UHFFFAOYSA-N 1 1 348.447 2.410 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)N1CCC(Nc2ccccc2[N+](=O)[O-])CC1 ZINC001057334904 1243339785 /nfs/dbraw/zinc/33/97/85/1243339785.db2.gz IOKHNIBPGFFKKL-UHFFFAOYSA-N 1 1 343.387 2.203 20 5 EEBDMO Cc1ccccc1C[NH+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1 ZINC001050516460 1243769404 /nfs/dbraw/zinc/76/94/04/1243769404.db2.gz CDHRWQOXCKKSBI-IAGOWNOFSA-N 1 1 343.427 2.085 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC001097190969 1243803160 /nfs/dbraw/zinc/80/31/60/1243803160.db2.gz XTBLUFSPYKDRTG-TXEJJXNPSA-N 1 1 338.383 2.133 20 5 EEBDMO CCc1ccc(C(=O)OC[C@@H]2CCC[N@H+]2CCOC)cc1[N+](=O)[O-] ZINC000861035321 1295225353 /nfs/dbraw/zinc/22/53/53/1295225353.db2.gz ZDMBCFJCDHLWME-HNNXBMFYSA-N 1 1 336.388 2.425 20 5 EEBDMO O=C(c1ccc[nH]1)N1CC2(C1)CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C2 ZINC001072463736 1295699990 /nfs/dbraw/zinc/69/99/90/1295699990.db2.gz UXVJHFXVZFMDFT-UHFFFAOYSA-N 1 1 340.383 2.271 20 5 EEBDMO Cc1cc(N2CC[NH+](CCN(C)C(=O)C(C)C)CC2)ccc1[N+](=O)[O-] ZINC001102414911 1301005715 /nfs/dbraw/zinc/00/57/15/1301005715.db2.gz GVEDUONWUMKROG-UHFFFAOYSA-N 1 1 348.447 2.140 20 5 EEBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cccc(C)c3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001225635666 1301105337 /nfs/dbraw/zinc/10/53/37/1301105337.db2.gz KXJQZGMNUNOSLU-AYDFFVQHSA-N 1 1 334.372 2.449 20 5 EEBDMO CCOCCCC(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001234318885 1304866350 /nfs/dbraw/zinc/86/63/50/1304866350.db2.gz LNOOWYQLGFNXCS-UHFFFAOYSA-N 1 1 337.420 2.350 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@@H+]2CC[C@](N)(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001246565421 1310345395 /nfs/dbraw/zinc/34/53/95/1310345395.db2.gz BVYYWSZTGLHKLW-QMTHXVAHSA-N 1 1 347.337 2.500 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@](N)(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001246565421 1310345406 /nfs/dbraw/zinc/34/54/06/1310345406.db2.gz BVYYWSZTGLHKLW-QMTHXVAHSA-N 1 1 347.337 2.500 20 5 EEBDMO [NH3+][C@H](Cc1cccc([N+](=O)[O-])c1)c1nc(-c2cc(F)ccn2)no1 ZINC001248210779 1310863205 /nfs/dbraw/zinc/86/32/05/1310863205.db2.gz JGOYUABJULBZRN-GFCCVEGCSA-N 1 1 329.291 2.421 20 5 EEBDMO C[C@]1(CO)CCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839556332 1315214955 /nfs/dbraw/zinc/21/49/55/1315214955.db2.gz KFYOKKBLJLJHQP-CQSZACIVSA-N 1 1 327.768 2.034 20 5 EEBDMO C[C@]1(CO)CCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839556332 1315214960 /nfs/dbraw/zinc/21/49/60/1315214960.db2.gz KFYOKKBLJLJHQP-CQSZACIVSA-N 1 1 327.768 2.034 20 5 EEBDMO COc1cc(Cc2noc([C@@H]([NH3+])CC(F)F)n2)ccc1[N+](=O)[O-] ZINC000843191361 1315863166 /nfs/dbraw/zinc/86/31/66/1315863166.db2.gz FOZLOVFWHWRNQF-QMMMGPOBSA-N 1 1 328.275 2.232 20 5 EEBDMO Cc1cc(Cl)c([N+](=O)[O-])c(N2CCN(c3[nH+]cccc3N)CC2)n1 ZINC001154782531 1317309102 /nfs/dbraw/zinc/30/91/02/1317309102.db2.gz QKGOTBIIJSINQT-UHFFFAOYSA-N 1 1 348.794 2.255 20 5 EEBDMO COC(=O)[C@@H]1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254473865 1318082199 /nfs/dbraw/zinc/08/21/99/1318082199.db2.gz IWNBHVWWTKRXGB-CYBMUJFWSA-N 1 1 333.388 2.059 20 5 EEBDMO Cc1cncnc1O[C@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254606116 1318142129 /nfs/dbraw/zinc/14/21/29/1318142129.db2.gz DZJCDSOXCZJPFC-IRXDYDNUSA-N 1 1 340.383 2.314 20 5 EEBDMO CCOC(=O)C1=C(Nc2nc(C)cc(Cl)c2[N+](=O)[O-])CC[NH2+]C1 ZINC001159453728 1319814754 /nfs/dbraw/zinc/81/47/54/1319814754.db2.gz ZNUCVBCQDIDQBD-UHFFFAOYSA-N 1 1 340.767 2.174 20 5 EEBDMO O=C(NCCC1(C[NH2+]C/C=C/c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164491058 1321395567 /nfs/dbraw/zinc/39/55/67/1321395567.db2.gz YSYYHJJUPUZYMR-MWRSBEEJSA-N 1 1 343.427 2.241 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)cc(N2CC[NH+](CCc3ccncc3)CC2)n1 ZINC001165060157 1321448822 /nfs/dbraw/zinc/44/88/22/1321448822.db2.gz OAEPMQNSMMSFSS-UHFFFAOYSA-N 1 1 347.806 2.403 20 5 EEBDMO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)NCCc3ccc([N+](=O)[O-])cc3)C[N@H+]2C1 ZINC001263712187 1322506673 /nfs/dbraw/zinc/50/66/73/1322506673.db2.gz XOOHHZKEMQRRTF-UNEWFSDZSA-N 1 1 331.416 2.374 20 5 EEBDMO Cc1cc(N2CCC(Nc3c(C)cncc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC001322466455 1333267831 /nfs/dbraw/zinc/26/78/31/1333267831.db2.gz QZHGHXJHKHTATG-UHFFFAOYSA-N 1 1 342.403 2.208 20 5 EEBDMO CC1(C)CN(c2ncc([N+](=O)[O-])c3ccccc32)CC[N@H+]1CCO ZINC001331160000 1334973375 /nfs/dbraw/zinc/97/33/75/1334973375.db2.gz FMILGEUFDJPFJC-UHFFFAOYSA-N 1 1 330.388 2.036 20 5 EEBDMO CC(C)c1[nH+]ccn1CC(=O)NCCN(C)c1ccccc1[N+](=O)[O-] ZINC001100352937 1338301756 /nfs/dbraw/zinc/30/17/56/1338301756.db2.gz ZHHZBUSTRPYCLF-UHFFFAOYSA-N 1 1 345.403 2.167 20 5 EEBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000848352532 1338691081 /nfs/dbraw/zinc/69/10/81/1338691081.db2.gz QIYWJVDFORJHDO-KBPBESRZSA-N 1 1 336.367 2.063 20 5 EEBDMO COC(=O)[C@]1(C)CC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848481427 1338705758 /nfs/dbraw/zinc/70/57/58/1338705758.db2.gz CWUBYKOSLBFXLT-QGZVFWFLSA-N 1 1 344.371 2.301 20 5 EEBDMO O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC001593471298 1349806930 /nfs/dbraw/zinc/80/69/30/1349806930.db2.gz QPDRLTYXBIZIOZ-ZDUSSCGKSA-N 1 1 343.391 2.204 20 5 EEBDMO CN(CC[C@H]1CCCC[N@H+]1C)c1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] ZINC001604740202 1350995060 /nfs/dbraw/zinc/99/50/60/1350995060.db2.gz SYRRAIKIPNUDIO-CYBMUJFWSA-N 1 1 345.407 2.086 20 5 EEBDMO Nc1ccc(NC(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000823921506 1368095985 /nfs/dbraw/zinc/09/59/85/1368095985.db2.gz VSRYVVLXBOCGDO-ZIAGYGMSSA-N 1 1 333.392 2.315 20 5 EEBDMO NC(=O)C1([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCOCC1 ZINC000852493428 1369276851 /nfs/dbraw/zinc/27/68/51/1369276851.db2.gz MNCIJOABWNANEW-UHFFFAOYSA-N 1 1 348.186 2.026 20 5 EEBDMO O=C(OCC[NH+]1CCC1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000861388887 1369495493 /nfs/dbraw/zinc/49/54/93/1369495493.db2.gz ZGKGAZLMJKOERW-UHFFFAOYSA-N 1 1 329.150 2.220 20 5 EEBDMO C[C@]([NH3+])(C(=O)Nc1n[nH]c2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC001576086129 1403559813 /nfs/dbraw/zinc/55/98/13/1403559813.db2.gz PNRIHFQMQZNVDJ-MRXNPFEDSA-N 1 1 343.318 2.423 20 5 EEBDMO C[C@]([NH3+])(C(=O)Nc1cc(C(F)(F)F)no1)c1cccc([N+](=O)[O-])c1 ZINC001576086391 1403560024 /nfs/dbraw/zinc/56/00/24/1403560024.db2.gz ROXKMQWTGXZGHY-GFCCVEGCSA-N 1 1 344.249 2.414 20 5 EEBDMO C[NH+](C)CC1(CNC(=O)[C@](C)(N)c2cccc([N+](=O)[O-])c2)CCCC1 ZINC001578412459 1403749042 /nfs/dbraw/zinc/74/90/42/1403749042.db2.gz MXZQUGMAPUONPK-QGZVFWFLSA-N 1 1 348.447 2.007 20 5 EEBDMO C[N@H+]1CCO[C@@H]2CN(c3cc(Cl)nc4ccc([N+](=O)[O-])cc43)C[C@@H]21 ZINC001164672379 719447719 /nfs/dbraw/zinc/44/77/19/719447719.db2.gz RCRRVLLXWPFLMA-LSDHHAIUSA-N 1 1 348.790 2.316 20 5 EEBDMO C[C@@H](NC(=O)N[C@H]1CC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000919627660 770090034 /nfs/dbraw/zinc/09/00/34/770090034.db2.gz OUOSAQRMOXWGCN-DOMZBBRYSA-N 1 1 332.404 2.439 20 5 EEBDMO C[C@@H](O)c1ncc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000809579717 783201219 /nfs/dbraw/zinc/20/12/19/783201219.db2.gz FZLWSFGJCGSOEI-MNOVXSKESA-N 1 1 349.416 2.186 20 5 EEBDMO C[C@@H](O)c1ncc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000809579717 783201222 /nfs/dbraw/zinc/20/12/22/783201222.db2.gz FZLWSFGJCGSOEI-MNOVXSKESA-N 1 1 349.416 2.186 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NC[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001091361160 790441873 /nfs/dbraw/zinc/44/18/73/790441873.db2.gz KLOBARKRTWBUKP-OKILXGFUSA-N 1 1 349.435 2.028 20 5 EEBDMO O=[N+]([O-])c1cnc(NCC[NH+]2CCC(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001160749399 790472807 /nfs/dbraw/zinc/47/28/07/790472807.db2.gz UBAHSKMEQHSAGP-UHFFFAOYSA-N 1 1 331.279 2.041 20 5 EEBDMO O=C(c1cc[nH]c1)N1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000981211394 776828887 /nfs/dbraw/zinc/82/88/87/776828887.db2.gz RMRKYCLFQONYOH-UHFFFAOYSA-N 1 1 328.372 2.271 20 5 EEBDMO O=C(c1cc[nH]c1)N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000981211394 776828896 /nfs/dbraw/zinc/82/88/96/776828896.db2.gz RMRKYCLFQONYOH-UHFFFAOYSA-N 1 1 328.372 2.271 20 5 EEBDMO C[N@H+]1C[C@H]2CCN(c3ccc(Br)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000893938182 780320441 /nfs/dbraw/zinc/32/04/41/780320441.db2.gz BXWFLHBCDIZMJF-NOZJJQNGSA-N 1 1 326.194 2.498 20 5 EEBDMO Cc1c(Br)c(N2CC[C@@H]3C[N@@H+](C)C[C@H]32)ncc1[N+](=O)[O-] ZINC000893938535 780320472 /nfs/dbraw/zinc/32/04/72/780320472.db2.gz FBJFKBAUSPJXBH-MWLCHTKSSA-N 1 1 341.209 2.201 20 5 EEBDMO Cc1c(Br)c(N2CC[C@@H]3C[N@H+](C)C[C@H]32)ncc1[N+](=O)[O-] ZINC000893938535 780320475 /nfs/dbraw/zinc/32/04/75/780320475.db2.gz FBJFKBAUSPJXBH-MWLCHTKSSA-N 1 1 341.209 2.201 20 5 EEBDMO CCC[N@H+]1CCC[C@H](C(=O)NCc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000906351967 783841124 /nfs/dbraw/zinc/84/11/24/783841124.db2.gz SSHQNNGRUWBFLA-ZDUSSCGKSA-N 1 1 335.404 2.342 20 5 EEBDMO CCCSc1nc(Cl)c([N+](=O)[O-])c(N[C@@]([NH3+])(CC)CO)n1 ZINC001170859644 784622702 /nfs/dbraw/zinc/62/27/02/784622702.db2.gz PVNNEUPXOQCLTB-NSHDSACASA-N 1 1 335.817 2.010 20 5 EEBDMO O=C(NCC[N@@H+]1CC=CCC1)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000907884883 784934463 /nfs/dbraw/zinc/93/44/63/784934463.db2.gz FODBZSOFZGQTMK-UHFFFAOYSA-N 1 1 327.743 2.379 20 5 EEBDMO O=[N+]([O-])c1cc(N[C@@H]2CCC[N@@H+](C3COC3)C2)cc2cccnc21 ZINC001168372713 786158724 /nfs/dbraw/zinc/15/87/24/786158724.db2.gz NJVOQHPNSNIUKS-CYBMUJFWSA-N 1 1 328.372 2.418 20 5 EEBDMO O=[N+]([O-])c1cc(N[C@@H]2CCC[N@H+](C3COC3)C2)cc2cccnc21 ZINC001168372713 786158729 /nfs/dbraw/zinc/15/87/29/786158729.db2.gz NJVOQHPNSNIUKS-CYBMUJFWSA-N 1 1 328.372 2.418 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)NC/C=C\CNc1ccc(F)cc1[N+](=O)[O-] ZINC001107199910 786370362 /nfs/dbraw/zinc/37/03/62/786370362.db2.gz HCZVWEAHSJGOLM-IHWYPQMZSA-N 1 1 347.350 2.023 20 5 EEBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cc(C)cc([N+](=O)[O-])c1N ZINC000171461440 791365959 /nfs/dbraw/zinc/36/59/59/791365959.db2.gz NQJPVVHEYOWCGM-LLVKDONJSA-N 1 1 331.376 2.056 20 5 EEBDMO C[C@@H](NC(=O)NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000914160697 795033299 /nfs/dbraw/zinc/03/32/99/795033299.db2.gz IYQDAHHHBJVIIN-CHWSQXEVSA-N 1 1 332.404 2.439 20 5 EEBDMO CC(=O)N1CC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C[C@@H]1C ZINC001172922208 797152876 /nfs/dbraw/zinc/15/28/76/797152876.db2.gz XHOGJYFTCNGBDM-SUMWQHHRSA-N 1 1 331.416 2.395 20 5 EEBDMO Cc1ccc(C)c(C[NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001002782601 798604597 /nfs/dbraw/zinc/60/45/97/798604597.db2.gz MECUWTTUVKNDFQ-IAGOWNOFSA-N 1 1 331.416 2.049 20 5 EEBDMO O=C(c1ccsc1)N1C[C@@H]2C[N@@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]2C1 ZINC001169026458 803592300 /nfs/dbraw/zinc/59/23/00/803592300.db2.gz XGLRYJCWWNHJAZ-DMRZNYOFSA-N 1 1 349.456 2.197 20 5 EEBDMO COc1cccc(O[C@@H]2CCC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)n1 ZINC001169050657 803595470 /nfs/dbraw/zinc/59/54/70/803595470.db2.gz CGFXXDFQKMKNSY-RRFJBIMHSA-N 1 1 335.404 2.379 20 5 EEBDMO O=C(N[C@@H]1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1)c1ccccc1F ZINC001169056359 803597790 /nfs/dbraw/zinc/59/77/90/803597790.db2.gz SJNBQJVXRSBKFD-RRFJBIMHSA-N 1 1 349.406 2.465 20 5 EEBDMO COC(=O)[C@@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)[C@@H]1C ZINC000787241849 807050245 /nfs/dbraw/zinc/05/02/45/807050245.db2.gz HJKUWLLQQSGBBM-DGCLKSJQSA-N 1 1 332.360 2.094 20 5 EEBDMO CC(C)N1CC[NH+](CCCOC(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000787570115 807155190 /nfs/dbraw/zinc/15/51/90/807155190.db2.gz FSHDKRDFIKTABA-UHFFFAOYSA-N 1 1 335.404 2.168 20 5 EEBDMO CN(CC[C@@H]1CCCC[N@H+]1C)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000173665118 529929871 /nfs/dbraw/zinc/92/98/71/529929871.db2.gz AVXBFSIMROFGDP-ZDUSSCGKSA-N 1 1 341.433 2.090 20 5 EEBDMO C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C1CC1 ZINC000069129204 215361849 /nfs/dbraw/zinc/36/18/49/215361849.db2.gz NSDOAHKSUWMLDU-SECBINFHSA-N 1 1 347.824 2.009 20 5 EEBDMO 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EEBDMO Cc1[nH+]ccn1CCCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065875061 462836108 /nfs/dbraw/zinc/83/61/08/462836108.db2.gz LLKUYCHDBDNRPY-UHFFFAOYSA-N 1 1 341.371 2.261 20 5 EEBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+](C)C2)c1[N+](=O)[O-] ZINC000091482794 462883715 /nfs/dbraw/zinc/88/37/15/462883715.db2.gz YQABAKNRRRTOJD-LLVKDONJSA-N 1 1 338.364 2.057 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000120286802 462982547 /nfs/dbraw/zinc/98/25/47/462982547.db2.gz DQMZKXHOEKOUIR-SWLSCSKDSA-N 1 1 336.392 2.052 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1 ZINC000120286802 462982549 /nfs/dbraw/zinc/98/25/49/462982549.db2.gz DQMZKXHOEKOUIR-SWLSCSKDSA-N 1 1 336.392 2.052 20 5 EEBDMO CCC1CC[NH+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000050784566 463009836 /nfs/dbraw/zinc/00/98/36/463009836.db2.gz KBKAQXLUAWOHLX-HNNXBMFYSA-N 1 1 331.372 2.349 20 5 EEBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000134882840 463089937 /nfs/dbraw/zinc/08/99/37/463089937.db2.gz NBVVKYVJNPQQCP-CYBMUJFWSA-N 1 1 344.415 2.419 20 5 EEBDMO NC(=O)[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000157081872 463096903 /nfs/dbraw/zinc/09/69/03/463096903.db2.gz FPQJYODGXHUGON-LLVKDONJSA-N 1 1 332.385 2.026 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)C[C@@H]21 ZINC000590776533 468336671 /nfs/dbraw/zinc/33/66/71/468336671.db2.gz VALFVUCCLKLPLQ-RNCFNFMXSA-N 1 1 343.305 2.390 20 5 EEBDMO CSC[C@H]1CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000135466349 463161588 /nfs/dbraw/zinc/16/15/88/463161588.db2.gz UHJFQDGPVYUUFM-CQSZACIVSA-N 1 1 335.429 2.311 20 5 EEBDMO O=C(/C=C/c1ccc(F)cc1[N+](=O)[O-])N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000491323532 468350020 /nfs/dbraw/zinc/35/00/20/468350020.db2.gz ZXZLHGKTZKWVHM-KEDPEKRHSA-N 1 1 333.363 2.444 20 5 EEBDMO O=C(/C=C\c1ccc(F)cc1[N+](=O)[O-])N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000491323539 468350355 /nfs/dbraw/zinc/35/03/55/468350355.db2.gz ZXZLHGKTZKWVHM-ZQMJAJRESA-N 1 1 333.363 2.444 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](CCO)C1CCCCC1 ZINC000071080542 463406575 /nfs/dbraw/zinc/40/65/75/463406575.db2.gz JZBOZANVBYIBGG-UHFFFAOYSA-N 1 1 335.404 2.469 20 5 EEBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000162060448 463480855 /nfs/dbraw/zinc/48/08/55/463480855.db2.gz VEQIFDAPKRYVHF-AWEZNQCLSA-N 1 1 335.404 2.068 20 5 EEBDMO C[C@@H](CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[N@H+]1CCCC[C@H]1C ZINC000351891653 465422443 /nfs/dbraw/zinc/42/24/43/465422443.db2.gz YHXUCSXJSCSBHT-NEPJUHHUSA-N 1 1 349.387 2.316 20 5 EEBDMO CCC1(O)CC[NH+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000072724192 463540534 /nfs/dbraw/zinc/54/05/34/463540534.db2.gz UQNIJEPAMBINMN-ZDUSSCGKSA-N 1 1 335.404 2.467 20 5 EEBDMO CCCC[N@@H+](C)CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000112333528 463698708 /nfs/dbraw/zinc/69/87/08/463698708.db2.gz WMZMAMMHUALLED-UHFFFAOYSA-N 1 1 329.422 2.142 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000286846990 463723614 /nfs/dbraw/zinc/72/36/14/463723614.db2.gz BDJRSKYCFZUOJW-XJKSGUPXSA-N 1 1 346.431 2.261 20 5 EEBDMO O=c1[nH]cnc2cc(NCc3c[nH+]c4n3CCCC4)c([N+](=O)[O-])cc12 ZINC000553592173 468373233 /nfs/dbraw/zinc/37/32/33/468373233.db2.gz PPSWPLUFVOVGCG-UHFFFAOYSA-N 1 1 340.343 2.389 20 5 EEBDMO COc1ccc(C[N@H+]2CCC[C@H](c3nnc(C)[nH]3)C2)cc1[N+](=O)[O-] ZINC000268513193 463774450 /nfs/dbraw/zinc/77/44/50/463774450.db2.gz VCLWCMIOIRSEMQ-ZDUSSCGKSA-N 1 1 331.376 2.410 20 5 EEBDMO COc1ccc(C[N@@H+]2CCC[C@H](c3nc(C)n[nH]3)C2)cc1[N+](=O)[O-] ZINC000268513193 463774455 /nfs/dbraw/zinc/77/44/55/463774455.db2.gz VCLWCMIOIRSEMQ-ZDUSSCGKSA-N 1 1 331.376 2.410 20 5 EEBDMO COc1ccc(C[N@H+]2CCC[C@H](c3nc(C)n[nH]3)C2)cc1[N+](=O)[O-] ZINC000268513193 463774459 /nfs/dbraw/zinc/77/44/59/463774459.db2.gz VCLWCMIOIRSEMQ-ZDUSSCGKSA-N 1 1 331.376 2.410 20 5 EEBDMO C[N@@H+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])c2ccccc2C1 ZINC000171481411 463871978 /nfs/dbraw/zinc/87/19/78/463871978.db2.gz IBMCIMJGZHQCOH-UHFFFAOYSA-N 1 1 341.367 2.452 20 5 EEBDMO C[N@H+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])c2ccccc2C1 ZINC000171481411 463871982 /nfs/dbraw/zinc/87/19/82/463871982.db2.gz IBMCIMJGZHQCOH-UHFFFAOYSA-N 1 1 341.367 2.452 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000269100325 463874392 /nfs/dbraw/zinc/87/43/92/463874392.db2.gz AHKUELMRNVHWJT-UHFFFAOYSA-N 1 1 340.811 2.485 20 5 EEBDMO C[NH+]1CCN(CCC(C)(C)NC(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000186059820 463929707 /nfs/dbraw/zinc/92/97/07/463929707.db2.gz YNHIERBPBKIAMK-UHFFFAOYSA-N 1 1 349.435 2.132 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN(c2cc(C)c([N+](=O)[O-])cc2C(=O)OC)C1 ZINC000278765056 463982944 /nfs/dbraw/zinc/98/29/44/463982944.db2.gz UEVUZSNEKGZUQY-ZDUSSCGKSA-N 1 1 335.404 2.468 20 5 EEBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)C(=O)/C=C/c1ccccc1[N+](=O)[O-] ZINC000279270667 464086242 /nfs/dbraw/zinc/08/62/42/464086242.db2.gz JMKFEUMXZTZQEY-CMDGGOBGSA-N 1 1 347.415 2.177 20 5 EEBDMO CN(CC[N@H+]1CCOC(C)(C)C1)C(=O)/C=C/c1ccccc1[N+](=O)[O-] ZINC000279270667 464086245 /nfs/dbraw/zinc/08/62/45/464086245.db2.gz JMKFEUMXZTZQEY-CMDGGOBGSA-N 1 1 347.415 2.177 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000188464917 464287710 /nfs/dbraw/zinc/28/77/10/464287710.db2.gz ITAXKGBGIKFXDM-CYBMUJFWSA-N 1 1 335.404 2.326 20 5 EEBDMO C[N@H+]1CC[C@]2(CCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000292651016 464299798 /nfs/dbraw/zinc/29/97/98/464299798.db2.gz XSJJSNAZDHDPDQ-SFHVURJKSA-N 1 1 331.416 2.427 20 5 EEBDMO CN1CC[N@@H+](C)C[C@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC000264658257 464411732 /nfs/dbraw/zinc/41/17/32/464411732.db2.gz HKHCWQJUIQEVER-MRXNPFEDSA-N 1 1 348.450 2.364 20 5 EEBDMO CC(C)(O)C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccccc1 ZINC000272078250 464471109 /nfs/dbraw/zinc/47/11/09/464471109.db2.gz LCCMEIOWCPCXCR-UHFFFAOYSA-N 1 1 345.399 2.030 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000175553764 464573856 /nfs/dbraw/zinc/57/38/56/464573856.db2.gz OVYBCFLFPLVTBY-GXTWGEPZSA-N 1 1 332.404 2.361 20 5 EEBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C1=CC[N@H+](C)CC1 ZINC000294831864 464619189 /nfs/dbraw/zinc/61/91/89/464619189.db2.gz APUBFPVGGDPSRJ-LLVKDONJSA-N 1 1 339.417 2.061 20 5 EEBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C1=CC[N@@H+](C)CC1 ZINC000294831864 464619193 /nfs/dbraw/zinc/61/91/93/464619193.db2.gz APUBFPVGGDPSRJ-LLVKDONJSA-N 1 1 339.417 2.061 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272530836 464646934 /nfs/dbraw/zinc/64/69/34/464646934.db2.gz MJZQRRGQFZHKSA-UHFFFAOYSA-N 1 1 327.331 2.241 20 5 EEBDMO COC[C@@]1(C(=O)OC)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000295137986 464718649 /nfs/dbraw/zinc/71/86/49/464718649.db2.gz ZAULZPDOUMPTHY-OAHLLOKOSA-N 1 1 342.779 2.260 20 5 EEBDMO COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 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1 339.367 2.103 20 5 EEBDMO CSCC[C@@H](C)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000126333717 205050942 /nfs/dbraw/zinc/05/09/42/205050942.db2.gz ZQJWAORQBLOEBQ-OCCSQVGLSA-N 1 1 328.434 2.408 20 5 EEBDMO C[C@H](c1ccccn1)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000127994089 205127850 /nfs/dbraw/zinc/12/78/50/205127850.db2.gz VDXXWTIJQRLGJR-HIFRSBDPSA-N 1 1 331.372 2.423 20 5 EEBDMO C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@@H]1CCCC[C@H]1O ZINC000245554276 205142448 /nfs/dbraw/zinc/14/24/48/205142448.db2.gz SBTXIIIRZABJKC-BLLLJJGKSA-N 1 1 336.388 2.444 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000159708390 206259561 /nfs/dbraw/zinc/25/95/61/206259561.db2.gz HZJFBXFIPAKWOB-MRXNPFEDSA-N 1 1 327.384 2.464 20 5 EEBDMO CC[C@H]1CN(c2cc(OC)c([N+](=O)[O-])cc2F)CC[N@H+]1C[C@@H](C)O ZINC000159898215 206269565 /nfs/dbraw/zinc/26/95/65/206269565.db2.gz NHXGGYUQZFVGFS-NEPJUHHUSA-N 1 1 341.383 2.024 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000266642782 248395083 /nfs/dbraw/zinc/39/50/83/248395083.db2.gz UXHIOSPMIFUBLD-KGLIPLIRSA-N 1 1 334.420 2.195 20 5 EEBDMO CCC[N@@H+](CC)CCNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000174639796 207039866 /nfs/dbraw/zinc/03/98/66/207039866.db2.gz PDXMCHKGHAADCA-UHFFFAOYSA-N 1 1 339.392 2.074 20 5 EEBDMO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000176288458 207211295 /nfs/dbraw/zinc/21/12/95/207211295.db2.gz OSYNDPBXHQRDBT-DAOPMYJZSA-N 1 1 336.417 2.222 20 5 EEBDMO CCC[C@H](C)[NH+]1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000177228834 207310882 /nfs/dbraw/zinc/31/08/82/207310882.db2.gz OOVCBFSNTRCHGM-ZDUSSCGKSA-N 1 1 341.433 2.090 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H](CO)[C@@H]3CCCO3)cs2)c1 ZINC000447985377 285152655 /nfs/dbraw/zinc/15/26/55/285152655.db2.gz FMQCYWJVKSIWQX-GJZGRUSLSA-N 1 1 349.412 2.348 20 5 EEBDMO COc1ccc(NC(=O)N2CC[N@H+]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000272837922 256243038 /nfs/dbraw/zinc/24/30/38/256243038.db2.gz NYGCFLOEAOPFGI-CYBMUJFWSA-N 1 1 334.376 2.305 20 5 EEBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ncc([N+](=O)[O-])cn1 ZINC000273558336 256306955 /nfs/dbraw/zinc/30/69/55/256306955.db2.gz BFZBGMKTZGCTJU-HNNXBMFYSA-N 1 1 327.388 2.343 20 5 EEBDMO Cc1cc(C(=O)N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000371993185 143677289 /nfs/dbraw/zinc/67/72/89/143677289.db2.gz SEDPGJDERXDAFX-NVXWUHKLSA-N 1 1 347.415 2.276 20 5 EEBDMO CC[C@H]1CN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000117306911 292236609 /nfs/dbraw/zinc/23/66/09/292236609.db2.gz BIMPXFORJKVIFX-WAVCKPEOSA-N 1 1 347.415 2.177 20 5 EEBDMO Cc1[nH+]cn(CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)c1C ZINC000092857015 159227266 /nfs/dbraw/zinc/22/72/66/159227266.db2.gz JDNLIUGCIRVQKV-UHFFFAOYSA-N 1 1 346.343 2.208 20 5 EEBDMO Cc1nn(C)c(C(=O)NCCC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000098097783 159249926 /nfs/dbraw/zinc/24/99/26/159249926.db2.gz ONDJQVBGWUDVPM-UHFFFAOYSA-N 1 1 337.424 2.021 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@]3(CCOC3)C2)cccc1[N+](=O)[O-] ZINC000247308516 160319401 /nfs/dbraw/zinc/31/94/01/160319401.db2.gz LUFRRACMFUMSSS-SUMWQHHRSA-N 1 1 333.388 2.343 20 5 EEBDMO COc1ccc(OCCN2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000342106111 161040092 /nfs/dbraw/zinc/04/00/92/161040092.db2.gz OUSVOUOAKKTCHB-CFVMTHIKSA-N 1 1 335.404 2.041 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCCNc2cccc(C)[nH+]2)n1 ZINC000342136134 161042505 /nfs/dbraw/zinc/04/25/05/161042505.db2.gz UMXDVPBAYVIMBK-UHFFFAOYSA-N 1 1 331.332 2.004 20 5 EEBDMO C[C@H]1C[C@H](CO)CC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000344147749 161202492 /nfs/dbraw/zinc/20/24/92/161202492.db2.gz QNPUWUKTTQHXHC-NWDGAFQWSA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@H]1C[C@H](CO)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000344147749 161202493 /nfs/dbraw/zinc/20/24/93/161202493.db2.gz QNPUWUKTTQHXHC-NWDGAFQWSA-N 1 1 332.360 2.238 20 5 EEBDMO O=C(NCC[NH+]1CCSCC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000346101789 161357235 /nfs/dbraw/zinc/35/72/35/161357235.db2.gz LZBHKNUGXZOWNS-UHFFFAOYSA-N 1 1 329.809 2.027 20 5 EEBDMO C[C@@H](CO)[N@H+]1CCCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000346645055 161388358 /nfs/dbraw/zinc/38/83/58/161388358.db2.gz NTXZRTUGWDJIGP-LBPRGKRZSA-N 1 1 327.812 2.137 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(c3nc(-c4ccc([N+](=O)[O-])cc4)no3)[C@@H]2C1 ZINC000352089991 162064902 /nfs/dbraw/zinc/06/49/02/162064902.db2.gz TXVIHPVDVWKJPC-BXUZGUMPSA-N 1 1 329.360 2.175 20 5 EEBDMO O=[N+]([O-])c1cccnc1NC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000355712615 163278457 /nfs/dbraw/zinc/27/84/57/163278457.db2.gz CTMJLZHPBWJMLJ-QGZVFWFLSA-N 1 1 328.372 2.039 20 5 EEBDMO COC(=O)COc1ccc(C[N@@H+]2CCSC[C@@H]2C)cc1[N+](=O)[O-] ZINC000355738784 163286501 /nfs/dbraw/zinc/28/65/01/163286501.db2.gz ZLMPOAYEQPNVJJ-NSHDSACASA-N 1 1 340.401 2.084 20 5 EEBDMO COC(=O)COc1ccc(C[N@H+]2CCSC[C@@H]2C)cc1[N+](=O)[O-] ZINC000355738784 163286504 /nfs/dbraw/zinc/28/65/04/163286504.db2.gz ZLMPOAYEQPNVJJ-NSHDSACASA-N 1 1 340.401 2.084 20 5 EEBDMO COc1cc(C[N@@H+]2C[C@@H](C)[C@H](O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000356276893 163390897 /nfs/dbraw/zinc/39/08/97/163390897.db2.gz HLQCUVSYRMSEHP-BXKDBHETSA-N 1 1 346.330 2.060 20 5 EEBDMO COc1cc(C[N@H+]2C[C@@H](C)[C@H](O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000356276893 163390899 /nfs/dbraw/zinc/39/08/99/163390899.db2.gz HLQCUVSYRMSEHP-BXKDBHETSA-N 1 1 346.330 2.060 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](CO)c1ccc(F)cc1 ZINC000359631420 164141133 /nfs/dbraw/zinc/14/11/33/164141133.db2.gz ZSIRBSFDJPWDFD-INIZCTEOSA-N 1 1 347.346 2.304 20 5 EEBDMO O=C(N[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC000369434525 166261236 /nfs/dbraw/zinc/26/12/36/166261236.db2.gz DGGWGHPKJQMPJS-UYTYNIKBSA-N 1 1 343.427 2.069 20 5 EEBDMO O=C(N[C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)[C@@H]1CC1[N+](=O)[O-] ZINC000369434525 166261239 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346.475 2.444 20 5 EEBDMO C[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C1=CC[N@@H+](C)CC1 ZINC000272643904 269002963 /nfs/dbraw/zinc/00/29/63/269002963.db2.gz CYKPRFZWVNBKNW-LBPRGKRZSA-N 1 1 342.399 2.385 20 5 EEBDMO CCCc1n[nH]c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-] ZINC000277624882 269164387 /nfs/dbraw/zinc/16/43/87/269164387.db2.gz WOHLGWCYWFNKHG-GFCCVEGCSA-N 1 1 335.408 2.017 20 5 EEBDMO O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCC[N@@H+]1CCCOCC1 ZINC000278304009 269222036 /nfs/dbraw/zinc/22/20/36/269222036.db2.gz GUYCBIXCOJJPJT-UHFFFAOYSA-N 1 1 334.298 2.143 20 5 EEBDMO O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCC[N@H+]1CCCOCC1 ZINC000278304009 269222037 /nfs/dbraw/zinc/22/20/37/269222037.db2.gz GUYCBIXCOJJPJT-UHFFFAOYSA-N 1 1 334.298 2.143 20 5 EEBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1NCC[N@@H+]1CC=CCC1 ZINC000280185863 269336315 /nfs/dbraw/zinc/33/63/15/269336315.db2.gz IKJGJIONIMOKFE-UHFFFAOYSA-N 1 1 332.360 2.225 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2C[N@@H+](C3CC3)C[C@H]2C)c1 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OPDIAZAWTUPPFR-GFCCVEGCSA-N 1 1 336.392 2.453 20 5 EEBDMO CN(C)/C=C/c1cc(N2C[C@H]3CCC[N@@H+](C)[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001157272359 1318536183 /nfs/dbraw/zinc/53/61/83/1318536183.db2.gz MOFRIPRDGKOTJG-UVMHCMFPSA-N 1 1 331.420 2.053 20 5 EEBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC001258018847 1319132652 /nfs/dbraw/zinc/13/26/52/1319132652.db2.gz GZQIQAFZJCIUSD-TXEJJXNPSA-N 1 1 332.360 2.297 20 5 EEBDMO CC1(C)CC(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)C1 ZINC001160106840 1320071419 /nfs/dbraw/zinc/07/14/19/1320071419.db2.gz DPGXLKDNJMAMPZ-HZPDHXFCSA-N 1 1 335.448 2.226 20 5 EEBDMO CC1(C)CC(C[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1 ZINC001160106840 1320071422 /nfs/dbraw/zinc/07/14/22/1320071422.db2.gz DPGXLKDNJMAMPZ-HZPDHXFCSA-N 1 1 335.448 2.226 20 5 EEBDMO CC1(C)CC(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1 ZINC001160106840 1320071423 /nfs/dbraw/zinc/07/14/23/1320071423.db2.gz DPGXLKDNJMAMPZ-HZPDHXFCSA-N 1 1 335.448 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COC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2 ZINC001308042127 1331559681 /nfs/dbraw/zinc/55/96/81/1331559681.db2.gz CVUGBWDRFZYBIG-GTNSWQLSSA-N 1 1 344.371 2.246 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001322194422 1333225676 /nfs/dbraw/zinc/22/56/76/1333225676.db2.gz LNKWGXRGGXFYSG-HUUCEWRRSA-N 1 1 330.388 2.247 20 5 EEBDMO Cc1nn(CCO)c(C)c1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC001325697649 1333942386 /nfs/dbraw/zinc/94/23/86/1333942386.db2.gz QAIYIFLPCYLVAD-UHFFFAOYSA-N 1 1 332.404 2.075 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H]3OCCC[C@@H]3C1)OCCO2 ZINC001337033245 1336634360 /nfs/dbraw/zinc/63/43/60/1336634360.db2.gz SBUGOVHYAGCTGI-IUODEOHRSA-N 1 1 334.372 2.367 20 5 EEBDMO C[N@@H+](CCCO)C1CCN(c2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC001337321071 1336683448 /nfs/dbraw/zinc/68/34/48/1336683448.db2.gz BFYKNJLWDBQBBZ-UHFFFAOYSA-N 1 1 344.415 2.426 20 5 EEBDMO COCC[NH+]1CCN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1 ZINC001346057410 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332.404 2.232 20 5 EEBDMO CN(CC(C)(C)C[NH2+]C/C(Cl)=C\Cl)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001755280274 1407290372 /nfs/dbraw/zinc/29/03/72/1407290372.db2.gz DUKGAVLJGLCCIN-UJQHZETGSA-N 1 1 338.235 2.045 20 5 EEBDMO C[C@]([NH3+])(C(=O)Nc1cccc2c1OCCO2)c1cccc([N+](=O)[O-])c1 ZINC001576085115 1403559888 /nfs/dbraw/zinc/55/98/88/1403559888.db2.gz IRZPDCANRAZGTO-QGZVFWFLSA-N 1 1 343.339 2.179 20 5 EEBDMO CCN(CCNC(=O)C(C)(C)[N@@H+](C)CC)c1ccc([N+](=O)[O-])cc1 ZINC001100646103 761129836 /nfs/dbraw/zinc/12/98/36/761129836.db2.gz JSVIEUWVSCHETG-UHFFFAOYSA-N 1 1 336.436 2.268 20 5 EEBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)Cn1cc([N+](=O)[O-])cn1 ZINC000173516387 765587720 /nfs/dbraw/zinc/58/77/20/765587720.db2.gz NRAVBSPQEIPQPO-INIZCTEOSA-N 1 1 329.404 2.203 20 5 EEBDMO COC(=O)Cc1ccc(NCc2ccc(N)[nH+]c2C)cc1[N+](=O)[O-] ZINC001167787390 770295935 /nfs/dbraw/zinc/29/59/35/770295935.db2.gz XQBXIWYSFNHFLK-UHFFFAOYSA-N 1 1 330.344 2.208 20 5 EEBDMO Cc1cc(C[N@H+]2CCCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c(C)s1 ZINC000981138644 776586404 /nfs/dbraw/zinc/58/64/04/776586404.db2.gz XANMDWNWOYESGP-HUUCEWRRSA-N 1 1 337.445 2.064 20 5 EEBDMO Cc1cc(C[N@@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)s1 ZINC000981138644 776586408 /nfs/dbraw/zinc/58/64/08/776586408.db2.gz XANMDWNWOYESGP-HUUCEWRRSA-N 1 1 337.445 2.064 20 5 EEBDMO Cc1cc(C[N@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)s1 ZINC000981138644 776586414 /nfs/dbraw/zinc/58/64/14/776586414.db2.gz XANMDWNWOYESGP-HUUCEWRRSA-N 1 1 337.445 2.064 20 5 EEBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000893877384 780267062 /nfs/dbraw/zinc/26/70/62/780267062.db2.gz VZDHBLJZGHRMKO-HZPDHXFCSA-N 1 1 332.404 2.015 20 5 EEBDMO Cc1ccnc(N)c1C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000893966301 780348892 /nfs/dbraw/zinc/34/88/92/780348892.db2.gz NQGGWCFKNXSTKB-UHFFFAOYSA-N 1 1 327.388 2.203 20 5 EEBDMO CCc1nocc1C(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001031955677 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O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@H](n3cc(Cl)cn3)C2)c1 ZINC000289705286 275140935 /nfs/dbraw/zinc/14/09/35/275140935.db2.gz CBIYKKPURFGHAV-GJZGRUSLSA-N 1 1 336.779 2.425 20 5 EEBDMO Cc1cnn([C@H]2CC[N@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)c1 ZINC000289855844 275155723 /nfs/dbraw/zinc/15/57/23/275155723.db2.gz KYFJCLKIVCDDAD-HNNXBMFYSA-N 1 1 344.371 2.413 20 5 EEBDMO Cc1cnn([C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)c1 ZINC000289855844 275155724 /nfs/dbraw/zinc/15/57/24/275155724.db2.gz KYFJCLKIVCDDAD-HNNXBMFYSA-N 1 1 344.371 2.413 20 5 EEBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)C2 ZINC000290026224 275172339 /nfs/dbraw/zinc/17/23/39/275172339.db2.gz RMONOXSLUZCJKX-AWEZNQCLSA-N 1 1 328.372 2.021 20 5 EEBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1 ZINC000290532909 275215829 /nfs/dbraw/zinc/21/58/29/275215829.db2.gz HOAXVULSQNWICO-LLVKDONJSA-N 1 1 335.408 2.011 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000291095351 275269798 /nfs/dbraw/zinc/26/97/98/275269798.db2.gz ILUKZPLVDWNPDG-BBWFWOEESA-N 1 1 349.431 2.162 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@](CO)(Cc3ccccc3)C2)c1 ZINC000291383083 275300014 /nfs/dbraw/zinc/30/00/14/275300014.db2.gz AWJUJKKXNBSWET-SFHVURJKSA-N 1 1 344.415 2.109 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](n2cccn2)C1 ZINC000291696305 275330958 /nfs/dbraw/zinc/33/09/58/275330958.db2.gz HSNIKLLKMAPWIB-SWLSCSKDSA-N 1 1 329.360 2.065 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](n2cccn2)C1 ZINC000291696305 275330959 /nfs/dbraw/zinc/33/09/59/275330959.db2.gz HSNIKLLKMAPWIB-SWLSCSKDSA-N 1 1 329.360 2.065 20 5 EEBDMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000291731480 275334555 /nfs/dbraw/zinc/33/45/55/275334555.db2.gz AOKSBWIVHASXSR-CYBMUJFWSA-N 1 1 345.403 2.239 20 5 EEBDMO C[C@@H]1CN(C(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000292098056 275375789 /nfs/dbraw/zinc/37/57/89/275375789.db2.gz HPMWNSKFIDVMEA-BETUJISGSA-N 1 1 335.404 2.055 20 5 EEBDMO C[C@@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000292223333 275396771 /nfs/dbraw/zinc/39/67/71/275396771.db2.gz BXDPYXXEJIXKNN-AWEZNQCLSA-N 1 1 331.416 2.470 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)[C@H]2C1 ZINC000352805655 277175120 /nfs/dbraw/zinc/17/51/20/277175120.db2.gz PVXSFIKBNCZBFW-NHYWBVRUSA-N 1 1 328.372 2.242 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](n2cc(CO)nn2)C1 ZINC000293070047 293117649 /nfs/dbraw/zinc/11/76/49/293117649.db2.gz VIRDIGBFQLNQBB-XJKSGUPXSA-N 1 1 345.403 2.385 20 5 EEBDMO C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@@H](O)Cc1ccccc1 ZINC000293234089 293157966 /nfs/dbraw/zinc/15/79/66/293157966.db2.gz HIRKKMSLKNNDDP-ROUUACIJSA-N 1 1 330.384 2.164 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+](C2CC2)C[C@@H](C)C1 ZINC000296859365 294085706 /nfs/dbraw/zinc/08/57/06/294085706.db2.gz YTFVPIQNCWFKEO-KBPBESRZSA-N 1 1 346.431 2.338 20 5 EEBDMO COC(=O)Cc1ccc(N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000297448671 294247004 /nfs/dbraw/zinc/24/70/04/294247004.db2.gz JFPQONIUENUFNQ-AAEUAGOBSA-N 1 1 333.388 2.347 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](C)OC[C@H]1C ZINC000297943071 294379279 /nfs/dbraw/zinc/37/92/79/294379279.db2.gz SCAXDENRAGRHMY-VXGBXAGGSA-N 1 1 337.376 2.041 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@@H]1c1ccncc1 ZINC000423958159 301862537 /nfs/dbraw/zinc/86/25/37/301862537.db2.gz BOPOXSOCKOQQDN-MRXNPFEDSA-N 1 1 326.356 2.085 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1C[C@@H]2CCC[N@@H+]2C[C@H]1C ZINC000332580469 312028494 /nfs/dbraw/zinc/02/84/94/312028494.db2.gz HTOJNPZYABJIHN-KGLIPLIRSA-N 1 1 332.404 2.010 20 5 EEBDMO CC[C@@H]1C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1 ZINC000439482242 315080922 /nfs/dbraw/zinc/08/09/22/315080922.db2.gz SDFVXRYWLIDHKJ-CVEARBPZSA-N 1 1 333.388 2.201 20 5 EEBDMO CC[C@@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1 ZINC000439482242 315080924 /nfs/dbraw/zinc/08/09/24/315080924.db2.gz SDFVXRYWLIDHKJ-CVEARBPZSA-N 1 1 333.388 2.201 20 5 EEBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000448726045 315381977 /nfs/dbraw/zinc/38/19/77/315381977.db2.gz RDLHIHFZMLEAFK-GJZGRUSLSA-N 1 1 345.399 2.301 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)C[C@H]1C ZINC000524879224 317033142 /nfs/dbraw/zinc/03/31/42/317033142.db2.gz HHECXOVEYORPNU-HIFRSBDPSA-N 1 1 349.431 2.477 20 5 EEBDMO CCC[N@H+](Cc1ccc(C)cc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000525271332 317052342 /nfs/dbraw/zinc/05/23/42/317052342.db2.gz ZPHKZOUPWLHTHD-QGZVFWFLSA-N 1 1 332.404 2.373 20 5 EEBDMO Cc1cc(NC(=O)NCCCCN2CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC000546035960 318242291 /nfs/dbraw/zinc/24/22/91/318242291.db2.gz BGAQVNHIGTVQPV-UHFFFAOYSA-N 1 1 349.435 2.052 20 5 EEBDMO CN(C)S(=O)(=O)c1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000326655603 465042958 /nfs/dbraw/zinc/04/29/58/465042958.db2.gz ZLNVPQWTSMDDFG-UHFFFAOYSA-N 1 1 349.412 2.135 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000337326126 465306363 /nfs/dbraw/zinc/30/63/63/465306363.db2.gz VWAZSGOJAXGXDI-KGLIPLIRSA-N 1 1 334.420 2.338 20 5 EEBDMO CCN1C[C@H](C)[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000337326126 465306369 /nfs/dbraw/zinc/30/63/69/465306369.db2.gz VWAZSGOJAXGXDI-KGLIPLIRSA-N 1 1 334.420 2.338 20 5 EEBDMO CCN1C[C@H](C)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000337326126 465306372 /nfs/dbraw/zinc/30/63/72/465306372.db2.gz VWAZSGOJAXGXDI-KGLIPLIRSA-N 1 1 334.420 2.338 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342928462 465394161 /nfs/dbraw/zinc/39/41/61/465394161.db2.gz BSTGGBBSICGRQD-OAHLLOKOSA-N 1 1 330.388 2.488 20 5 EEBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000074297250 462581287 /nfs/dbraw/zinc/58/12/87/462581287.db2.gz BRWQSFMTONWXJY-INIZCTEOSA-N 1 1 331.416 2.328 20 5 EEBDMO COC(=O)[C@H](C)C[N@@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000114063313 462624431 /nfs/dbraw/zinc/62/44/31/462624431.db2.gz NHLSEIVVVUQRSE-MNOVXSKESA-N 1 1 348.359 2.447 20 5 EEBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000063710868 462664787 /nfs/dbraw/zinc/66/47/87/462664787.db2.gz NBSWKRTYCZTGSV-CQSZACIVSA-N 1 1 334.420 2.243 20 5 EEBDMO CS(=O)(=O)c1cccc(NCC[NH+]2CCCCCC2)c1[N+](=O)[O-] ZINC000089619898 462699015 /nfs/dbraw/zinc/69/90/15/462699015.db2.gz JFWXSGWWCQIWCJ-UHFFFAOYSA-N 1 1 341.433 2.286 20 5 EEBDMO Cc1cnc(NC[C@@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000089643967 462703442 /nfs/dbraw/zinc/70/34/42/462703442.db2.gz MRLXZWXGTSTNHQ-JKSUJKDBSA-N 1 1 342.399 2.346 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@H]2C[C@@H](O)C[N@@H+]2Cc2ccccc2)nc1 ZINC000089644899 462703464 /nfs/dbraw/zinc/70/34/64/462703464.db2.gz FBHKGVVKJBOIKA-HZPDHXFCSA-N 1 1 328.372 2.037 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@]2(CCOC2)C1 ZINC000154066386 462725843 /nfs/dbraw/zinc/72/58/43/462725843.db2.gz JNTDQPWFLXGMKR-KRWDZBQOSA-N 1 1 347.371 2.005 20 5 EEBDMO C[C@@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@H](C)CO1 ZINC000117335139 462798974 /nfs/dbraw/zinc/79/89/74/462798974.db2.gz OXTDNTRWFRJRDP-VXGBXAGGSA-N 1 1 335.360 2.002 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@H](C)CO1 ZINC000117335139 462798978 /nfs/dbraw/zinc/79/89/78/462798978.db2.gz OXTDNTRWFRJRDP-VXGBXAGGSA-N 1 1 335.360 2.002 20 5 EEBDMO CCc1ccc(OC[C@@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000155304743 462872195 /nfs/dbraw/zinc/87/21/95/462872195.db2.gz IOYIPLWTCFDIAS-GUTXKFCHSA-N 1 1 338.404 2.006 20 5 EEBDMO CCc1ccc(OC[C@@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000155304743 462872200 /nfs/dbraw/zinc/87/22/00/462872200.db2.gz IOYIPLWTCFDIAS-GUTXKFCHSA-N 1 1 338.404 2.006 20 5 EEBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC[N@@H+](C)C1CC1 ZINC000066923785 462947268 /nfs/dbraw/zinc/94/72/68/462947268.db2.gz NZHXJXSQNFDWAD-SNVBAGLBSA-N 1 1 341.795 2.226 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])o1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000020462494 463027339 /nfs/dbraw/zinc/02/73/39/463027339.db2.gz WESMMQUFLCALED-UHFFFAOYSA-N 1 1 329.356 2.188 20 5 EEBDMO C[N@H+]1CC[C@H](CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000120713401 463030402 /nfs/dbraw/zinc/03/04/02/463030402.db2.gz QOOBWNXEYXAVEB-SECBINFHSA-N 1 1 342.193 2.039 20 5 EEBDMO Cc1c([C@@H](C)[NH2+]C[C@H](C)CN2CCN(C)CC2)cccc1[N+](=O)[O-] ZINC000120925301 463054637 /nfs/dbraw/zinc/05/46/37/463054637.db2.gz IISRQRZFRZYURS-GOEBONIOSA-N 1 1 334.464 2.437 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000121013621 463066572 /nfs/dbraw/zinc/06/65/72/463066572.db2.gz UQDIYSVGAHLAQB-GFCCVEGCSA-N 1 1 328.372 2.357 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000053348805 463153489 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/nfs/dbraw/zinc/42/79/66/467427966.db2.gz FBKJKDFJNJSJAP-UHFFFAOYSA-N 1 1 346.412 2.225 20 5 EEBDMO C[NH2+]C[C@@H]1CCCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000430660710 467456540 /nfs/dbraw/zinc/45/65/40/467456540.db2.gz DUXLINASPDLVDH-AWEZNQCLSA-N 1 1 334.420 2.163 20 5 EEBDMO COc1ccc(CN2CCC([C@H]3OCCC[C@@H]3[NH3+])CC2)cc1[N+](=O)[O-] ZINC000415100451 467489003 /nfs/dbraw/zinc/48/90/03/467489003.db2.gz AIYKZQLBINJBHW-MAUKXSAKSA-N 1 1 349.431 2.322 20 5 EEBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCN([C@@H]2CCC[C@@H]2O)CC1 ZINC000449191568 467622521 /nfs/dbraw/zinc/62/25/21/467622521.db2.gz PKKIMMZNFARVTM-ZMYBRWDISA-N 1 1 347.459 2.493 20 5 EEBDMO CN(CC(=O)NCCCC[N@@H+](C)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000457203233 467776694 /nfs/dbraw/zinc/77/66/94/467776694.db2.gz NPRXHYDULXLWJK-UHFFFAOYSA-N 1 1 334.420 2.022 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@H](CNc2nccc3cc([N+](=O)[O-])ccc32)C1 ZINC000450222994 467802181 /nfs/dbraw/zinc/80/21/81/467802181.db2.gz IGBASRBRDHHBPQ-MRXNPFEDSA-N 1 1 344.415 2.912 20 5 EEBDMO CN(CCCN1CC[NH+](C)CC1)c1nccc2c1cccc2[N+](=O)[O-] ZINC000450338722 467830694 /nfs/dbraw/zinc/83/06/94/467830694.db2.gz YWQFUUAWCVOANA-UHFFFAOYSA-N 1 1 343.431 2.217 20 5 EEBDMO O=[N+]([O-])c1c(NC[C@H]2CCC[N@@H+]2CCCO)ccc2ncccc21 ZINC000450596210 467876165 /nfs/dbraw/zinc/87/61/65/467876165.db2.gz NGMNRIFUTREPHZ-CYBMUJFWSA-N 1 1 330.388 2.402 20 5 EEBDMO C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000487519586 468043126 /nfs/dbraw/zinc/04/31/26/468043126.db2.gz RULKJQSNUPYOMX-RNCFNFMXSA-N 1 1 345.321 2.428 20 5 EEBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cn2C)C1 ZINC000517648884 468092287 /nfs/dbraw/zinc/09/22/87/468092287.db2.gz MFSFWVRIWXMTOP-ZFWWWQNUSA-N 1 1 342.399 2.499 20 5 EEBDMO COc1cc(C(=O)NC[C@@H]2CCCC[N@@H+](C)C2)cc([N+](=O)[O-])c1C ZINC000600315588 468530574 /nfs/dbraw/zinc/53/05/74/468530574.db2.gz VKXOCKZALAWHGH-ZDUSSCGKSA-N 1 1 335.404 2.374 20 5 EEBDMO NC(=O)C[C@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000591848885 468530712 /nfs/dbraw/zinc/53/07/12/468530712.db2.gz ICBKVZYLCCPQIB-SECBINFHSA-N 1 1 342.193 2.055 20 5 EEBDMO NC(=O)C[C@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000591848885 468530716 /nfs/dbraw/zinc/53/07/16/468530716.db2.gz ICBKVZYLCCPQIB-SECBINFHSA-N 1 1 342.193 2.055 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000556690637 468547114 /nfs/dbraw/zinc/54/71/14/468547114.db2.gz XFHHVZOHJWTZFK-NSHDSACASA-N 1 1 337.767 2.004 20 5 EEBDMO Nc1c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc(F)cc1[N+](=O)[O-] ZINC000594418560 468579782 /nfs/dbraw/zinc/57/97/82/468579782.db2.gz KDNJFASVYGAOGC-QWHCGFSZSA-N 1 1 336.367 2.063 20 5 EEBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H]3CC[C@H](O)C[C@@H]3C2)c2c(c1)COCO2 ZINC000570298473 468620095 /nfs/dbraw/zinc/62/00/95/468620095.db2.gz MYURDDYXNICBMG-OZVIIMIRSA-N 1 1 334.372 2.054 20 5 EEBDMO O=[N+]([O-])c1ccc2[nH+]ccc(NCc3nnc4n3CCCCC4)c2c1 ZINC000601100289 468740567 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2.392 20 5 EEBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000595473020 468866688 /nfs/dbraw/zinc/86/66/88/468866688.db2.gz SLSGEGJHNIUTOZ-MRXNPFEDSA-N 1 1 337.395 2.421 20 5 EEBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000595473020 468866692 /nfs/dbraw/zinc/86/66/92/468866692.db2.gz SLSGEGJHNIUTOZ-MRXNPFEDSA-N 1 1 337.395 2.421 20 5 EEBDMO CCOC(=O)c1c(C)[nH]nc1CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000595485165 468872365 /nfs/dbraw/zinc/87/23/65/468872365.db2.gz RYRMVIDKNRFWRX-UHFFFAOYSA-N 1 1 346.387 2.478 20 5 EEBDMO COC(=O)c1ccnc(NC[C@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-] ZINC000598622166 468936560 /nfs/dbraw/zinc/93/65/60/468936560.db2.gz MAIGCVBKFZDSQD-GFCCVEGCSA-N 1 1 336.392 2.309 20 5 EEBDMO C[C@H](CO)[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000595670810 468947269 /nfs/dbraw/zinc/94/72/69/468947269.db2.gz DMKGQBCKTQBLJT-CZUORRHYSA-N 1 1 335.404 2.406 20 5 EEBDMO COc1ccc(OCC[N@H+]2CCCC[C@@H]2[C@H](C)CO)c([N+](=O)[O-])c1 ZINC000595679057 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CC[N@H+]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H]1C ZINC000611155852 469176216 /nfs/dbraw/zinc/17/62/16/469176216.db2.gz GYBBHYPMDBLTDC-LBPRGKRZSA-N 1 1 330.388 2.171 20 5 EEBDMO Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000602959556 469190900 /nfs/dbraw/zinc/19/09/00/469190900.db2.gz XDEHNSCJICTBDC-CYBMUJFWSA-N 1 1 335.408 2.058 20 5 EEBDMO C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC[C@@H]1C(=O)OC(C)(C)C ZINC000599588778 469301746 /nfs/dbraw/zinc/30/17/46/469301746.db2.gz KLLKTYUHPSPGMZ-OCCSQVGLSA-N 1 1 338.408 2.091 20 5 EEBDMO Nc1c(F)cccc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000602473245 469331512 /nfs/dbraw/zinc/33/15/12/469331512.db2.gz LADRWSIISFHIEH-LBPRGKRZSA-N 1 1 331.351 2.398 20 5 EEBDMO CC(=O)NC[C@@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000599704239 469344002 /nfs/dbraw/zinc/34/40/02/469344002.db2.gz RXXBTUJTANZRTI-INIZCTEOSA-N 1 1 335.404 2.354 20 5 EEBDMO COc1cc([N+](=O)[O-])cn(CC[N@@H+](C)Cc2ccc(F)cc2)c1=O ZINC000603360399 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C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000344739577 161241832 /nfs/dbraw/zinc/24/18/32/161241832.db2.gz ZNUUTLLCLNICPJ-HNNXBMFYSA-N 1 1 335.404 2.210 20 5 EEBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)CN1CCN(C)CC1 ZINC000344791877 161246208 /nfs/dbraw/zinc/24/62/08/161246208.db2.gz LHOKOLREJUGFCG-ABPVARSCSA-N 1 1 346.475 2.471 20 5 EEBDMO C[NH+](C)Cc1cc(C(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])no1 ZINC000345805754 161333890 /nfs/dbraw/zinc/33/38/90/161333890.db2.gz MAVTWPKMIFHVTH-UHFFFAOYSA-N 1 1 332.360 2.310 20 5 EEBDMO COC(=O)[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]1C ZINC000346610899 161385784 /nfs/dbraw/zinc/38/57/84/161385784.db2.gz FEJFXFRDOOMMEJ-MFKMUULPSA-N 1 1 346.343 2.028 20 5 EEBDMO COC(=O)[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]1C ZINC000346610899 161385785 /nfs/dbraw/zinc/38/57/85/161385785.db2.gz FEJFXFRDOOMMEJ-MFKMUULPSA-N 1 1 346.343 2.028 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1CNS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000352509745 162164396 /nfs/dbraw/zinc/16/43/96/162164396.db2.gz GZYIHKJRPFULIS-ZDUSSCGKSA-N 1 1 341.433 2.056 20 5 EEBDMO O=C(CC[N@H+]1CC[C@@H](COC(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000353019330 162393501 /nfs/dbraw/zinc/39/35/01/162393501.db2.gz GGWQKHXEQNOASV-LLVKDONJSA-N 1 1 343.330 2.485 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3C[C@H]4[C@H](CO)[C@H]4C3)cs2)c1 ZINC000367779205 166002703 /nfs/dbraw/zinc/00/27/03/166002703.db2.gz MROBQOANRGMVQA-FICVDOATSA-N 1 1 331.397 2.388 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3C[C@H]4[C@H](CO)[C@H]4C3)cs2)c1 ZINC000367779205 166002704 /nfs/dbraw/zinc/00/27/04/166002704.db2.gz MROBQOANRGMVQA-FICVDOATSA-N 1 1 331.397 2.388 20 5 EEBDMO O=[N+]([O-])c1cccnc1NC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000355712614 163278497 /nfs/dbraw/zinc/27/84/97/163278497.db2.gz CTMJLZHPBWJMLJ-KRWDZBQOSA-N 1 1 328.372 2.039 20 5 EEBDMO Cc1ccc(N2CCC(NC(=O)c3ccc([N+](=O)[O-])n3C)CC2)[nH+]c1 ZINC000356191649 163363202 /nfs/dbraw/zinc/36/32/02/163363202.db2.gz KJMTZVJGNPCOIZ-UHFFFAOYSA-N 1 1 343.387 2.036 20 5 EEBDMO C[C@H]1[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCC12CCOCC2 ZINC000375245228 167095494 /nfs/dbraw/zinc/09/54/94/167095494.db2.gz LMSIEBRLWDSAMX-GFCCVEGCSA-N 1 1 333.388 2.085 20 5 EEBDMO COc1cc(CN2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000272584041 268994985 /nfs/dbraw/zinc/99/49/85/268994985.db2.gz GZWVXULBQIEBFX-WFASDCNBSA-N 1 1 335.404 2.138 20 5 EEBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000278243207 269218532 /nfs/dbraw/zinc/21/85/32/269218532.db2.gz VCPQDKUPFYXDBZ-LLVKDONJSA-N 1 1 348.407 2.001 20 5 EEBDMO Cc1c(C(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000278642522 269238626 /nfs/dbraw/zinc/23/86/26/269238626.db2.gz SITKWIBEPHHPCZ-ZDUSSCGKSA-N 1 1 335.404 2.134 20 5 EEBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000279679079 269299841 /nfs/dbraw/zinc/29/98/41/269299841.db2.gz GILLVSXAHXJULU-AWEZNQCLSA-N 1 1 337.420 2.146 20 5 EEBDMO C[C@H](Nc1ncnc2sc([N+](=O)[O-])cc21)[C@H](C)[NH+]1CCOCC1 ZINC000288141049 275028270 /nfs/dbraw/zinc/02/82/70/275028270.db2.gz YUVJJGQBRMMRAD-UWVGGRQHSA-N 1 1 337.405 2.121 20 5 EEBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)[C@H](C)C1 ZINC000288629144 275077612 /nfs/dbraw/zinc/07/76/12/275077612.db2.gz YKDCVXGFNOQPOQ-CQSZACIVSA-N 1 1 346.431 2.361 20 5 EEBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)[C@H](C)C1 ZINC000288629144 275077613 /nfs/dbraw/zinc/07/76/13/275077613.db2.gz YKDCVXGFNOQPOQ-CQSZACIVSA-N 1 1 346.431 2.361 20 5 EEBDMO CCC[C@]1(CO)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000288718531 275082196 /nfs/dbraw/zinc/08/21/96/275082196.db2.gz FRXUIYGZZXEQPK-KRWDZBQOSA-N 1 1 335.404 2.408 20 5 EEBDMO C[C@H](CS(C)(=O)=O)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290877160 275248405 /nfs/dbraw/zinc/24/84/05/275248405.db2.gz LRZKMBKFVREFQA-SSDOTTSWSA-N 1 1 341.216 2.424 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000359628346 276152959 /nfs/dbraw/zinc/15/29/59/276152959.db2.gz BIIRJJOGKSDEON-OAHLLOKOSA-N 1 1 333.388 2.190 20 5 EEBDMO C[C@H]1[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CCC[N@H+]1C ZINC000343477472 280118831 /nfs/dbraw/zinc/11/88/31/280118831.db2.gz CRHLFZIMMVWNQW-DZGCQCFKSA-N 1 1 346.431 2.408 20 5 EEBDMO COc1ccc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)nn1 ZINC000283284308 292921592 /nfs/dbraw/zinc/92/15/92/292921592.db2.gz XMBZHVNVHVQGIL-UHFFFAOYSA-N 1 1 344.371 2.437 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc(CC(=O)OC)cc2[N+](=O)[O-])C1 ZINC000296947155 294109617 /nfs/dbraw/zinc/10/96/17/294109617.db2.gz BXHGPHDSBPIQOS-HNNXBMFYSA-N 1 1 349.431 2.478 20 5 EEBDMO COC(=O)Cc1ccc(N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000297448687 294246909 /nfs/dbraw/zinc/24/69/09/294246909.db2.gz JFPQONIUENUFNQ-YPMHNXCESA-N 1 1 333.388 2.347 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](CO)C[C@@H]1C ZINC000344127977 312268393 /nfs/dbraw/zinc/26/83/93/312268393.db2.gz KQOCKHAEDZROOT-UONOGXRCSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1nccc2ccc([N+](=O)[O-])cc21 ZINC000413277439 312836424 /nfs/dbraw/zinc/83/64/24/312836424.db2.gz DUXCRYULTYHVFC-XJKSGUPXSA-N 1 1 342.399 2.442 20 5 EEBDMO COc1ccc(OCC[N@H+]2CCC[C@@H](CCO)CC2)c([N+](=O)[O-])c1 ZINC000421008956 314022620 /nfs/dbraw/zinc/02/26/20/314022620.db2.gz DWRYXKBKULDWSB-CQSZACIVSA-N 1 1 338.404 2.467 20 5 EEBDMO O=C(CC[N@@H+]1CCC[C@@H](CCO)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000421019954 314028644 /nfs/dbraw/zinc/02/86/44/314028644.db2.gz QMEVUOJLSCPAGX-CQSZACIVSA-N 1 1 335.404 2.408 20 5 EEBDMO C[C@H]1C[C@@H](C(=O)OC(C)(C)C)C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1 ZINC000421028352 314031575 /nfs/dbraw/zinc/03/15/75/314031575.db2.gz UGWVCLHJCRJQJQ-QWHCGFSZSA-N 1 1 338.408 2.091 20 5 EEBDMO Cc1nn(Cc2cccc(C[NH+]3CCOCC3)c2)c(C)c1[N+](=O)[O-] ZINC000421182491 314061458 /nfs/dbraw/zinc/06/14/58/314061458.db2.gz MOJLLGCGZIPMAX-UHFFFAOYSA-N 1 1 330.388 2.289 20 5 EEBDMO O=C(C[N@@H+]1CCSC[C@H]1C1CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000576078372 320138418 /nfs/dbraw/zinc/13/84/18/320138418.db2.gz MWXSNMYHMXDQDM-INIZCTEOSA-N 1 1 347.440 2.311 20 5 EEBDMO O=C(C[N@H+]1CCSC[C@H]1C1CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000576078372 320138420 /nfs/dbraw/zinc/13/84/20/320138420.db2.gz MWXSNMYHMXDQDM-INIZCTEOSA-N 1 1 347.440 2.311 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CC(C(F)(F)F)C1 ZINC000577349312 320250091 /nfs/dbraw/zinc/25/00/91/320250091.db2.gz RSUBJYOFHRUKHS-UHFFFAOYSA-N 1 1 347.293 2.426 20 5 EEBDMO O=c1c([N+](=O)[O-])cc(Cl)cn1Cc1[nH+]ccn1CC(F)(F)F ZINC000347745732 465202872 /nfs/dbraw/zinc/20/28/72/465202872.db2.gz IOQQGEAJQOBEHA-UHFFFAOYSA-N 1 1 336.657 2.217 20 5 EEBDMO COc1ccc(OCC[N@@H+](CCO)[C@H]2CC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000351638846 465266874 /nfs/dbraw/zinc/26/68/74/465266874.db2.gz YOBFDGRKOJAGEN-KBPBESRZSA-N 1 1 338.404 2.465 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000347927491 465314505 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CCOc1ccc(C(=O)N2CC[N@H+](C)C[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC000153947147 462711317 /nfs/dbraw/zinc/71/13/17/462711317.db2.gz FQHHGDWZSNEWET-HNNXBMFYSA-N 1 1 335.404 2.406 20 5 EEBDMO CCOc1ccc(C(=O)N2CC[N@@H+](C)C[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC000153947147 462711322 /nfs/dbraw/zinc/71/13/22/462711322.db2.gz FQHHGDWZSNEWET-HNNXBMFYSA-N 1 1 335.404 2.406 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1c1nc(C)cc(C(=O)OC)c1[N+](=O)[O-] ZINC000590723797 468317083 /nfs/dbraw/zinc/31/70/83/468317083.db2.gz RYBMDMCYZHEXHI-LBPRGKRZSA-N 1 1 336.392 2.005 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCc3ccccc3[C@H]2CO)c1 ZINC000154633120 462790932 /nfs/dbraw/zinc/79/09/32/462790932.db2.gz XLEPEMSESDCJKH-MSOLQXFVSA-N 1 1 328.368 2.220 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCOC2(C1)CCCCCC2 ZINC000090552497 462797250 /nfs/dbraw/zinc/79/72/50/462797250.db2.gz RIIBVFWRARPDNN-UHFFFAOYSA-N 1 1 335.404 2.182 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOC2(C1)CCCCCC2 ZINC000090552497 462797258 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COc1ccc(S(=O)(=O)N(C)c2cc[nH+]c(C)c2)cc1[N+](=O)[O-] ZINC000361823079 466322714 /nfs/dbraw/zinc/32/27/14/466322714.db2.gz RHVJMPXPYUIUER-UHFFFAOYSA-N 1 1 337.357 2.132 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)n1 ZINC000347344496 466580162 /nfs/dbraw/zinc/58/01/62/466580162.db2.gz QLZZBHBMBQQSCL-UONOGXRCSA-N 1 1 348.428 2.292 20 5 EEBDMO COC(=O)[C@@H](C)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000411214513 466784271 /nfs/dbraw/zinc/78/42/71/466784271.db2.gz FXKJOSGTZHEVPZ-LBPRGKRZSA-N 1 1 349.387 2.197 20 5 EEBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000411974450 466954317 /nfs/dbraw/zinc/95/43/17/466954317.db2.gz YQLXNKJWPMINAU-GOSISDBHSA-N 1 1 343.358 2.363 20 5 EEBDMO CC(C)[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000412283118 467058267 /nfs/dbraw/zinc/05/82/67/467058267.db2.gz HVTMXQYTRDYWDQ-BBWFWOEESA-N 1 1 331.416 2.497 20 5 EEBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)NCCc1ccccc1[N+](=O)[O-])C2 ZINC000377891660 467160902 /nfs/dbraw/zinc/16/09/02/467160902.db2.gz DTEKAWJOWFHIBH-CQSZACIVSA-N 1 1 328.372 2.021 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCSC[C@H]2C2CC2)c1 ZINC000451650524 467265356 /nfs/dbraw/zinc/26/53/56/467265356.db2.gz UTBDCOIDUULUNA-HOCLYGCPSA-N 1 1 338.429 2.162 20 5 EEBDMO CO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C12CCC2 ZINC000451860816 467275658 /nfs/dbraw/zinc/27/56/58/467275658.db2.gz XCNHTJIAPKKXEJ-LSDHHAIUSA-N 1 1 333.388 2.083 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000433064102 467287753 /nfs/dbraw/zinc/28/77/53/467287753.db2.gz VUPYVDZRGCSUPW-NVXWUHKLSA-N 1 1 330.388 2.032 20 5 EEBDMO Cc1ccc(S(=O)(=O)NCC[N@H+]2CCCC2(C)C)c([N+](=O)[O-])c1 ZINC000452081131 467315217 /nfs/dbraw/zinc/31/52/17/467315217.db2.gz CXNKTVFZNNVULG-UHFFFAOYSA-N 1 1 341.433 2.056 20 5 EEBDMO COC(=O)[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]1C(C)C ZINC000429363041 467329409 /nfs/dbraw/zinc/32/94/09/467329409.db2.gz OEOPORLVABDSGT-LRDDRELGSA-N 1 1 346.387 2.491 20 5 EEBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cn1 ZINC000378552144 467338749 /nfs/dbraw/zinc/33/87/49/467338749.db2.gz RNBDKSHXTRAGHH-UHFFFAOYSA-N 1 1 338.327 2.318 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000433836340 467357685 /nfs/dbraw/zinc/35/76/85/467357685.db2.gz NXWFKGWFVUTLST-RYUDHWBXSA-N 1 1 337.424 2.434 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420333760 467362577 /nfs/dbraw/zinc/36/25/77/467362577.db2.gz FRJNFNFVCOHURL-KFWWJZLASA-N 1 1 346.431 2.243 20 5 EEBDMO COc1ccc(OCCN(C)CC[C@H]([NH3+])C(C)C)c([N+](=O)[O-])c1 ZINC000430584332 467445539 /nfs/dbraw/zinc/44/55/39/467445539.db2.gz PCCKNYOXDWPQEP-AWEZNQCLSA-N 1 1 325.409 2.287 20 5 EEBDMO CC(C)[N@H+]1CCCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)CC1 ZINC000453434003 467488928 /nfs/dbraw/zinc/48/89/28/467488928.db2.gz XAVQICROPHUWBE-UHFFFAOYSA-N 1 1 344.419 2.311 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)C[C@@H]21 ZINC000454539937 467599682 /nfs/dbraw/zinc/59/96/82/467599682.db2.gz ASUXKUZMNOMJNG-WBVHZDCISA-N 1 1 346.431 2.263 20 5 EEBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)CN1CCC(C)CC1 ZINC000449122425 467619748 /nfs/dbraw/zinc/61/97/48/467619748.db2.gz LIJNJNHYPMYUQJ-WBVHZDCISA-N 1 1 335.448 2.208 20 5 EEBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])NC[C@H](O)C[NH+]1CCC(C)CC1 ZINC000449122425 467619749 /nfs/dbraw/zinc/61/97/49/467619749.db2.gz LIJNJNHYPMYUQJ-WBVHZDCISA-N 1 1 335.448 2.208 20 5 EEBDMO Cc1nc(N2CCC[N@@H+](Cc3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC000450228207 467803784 /nfs/dbraw/zinc/80/37/84/467803784.db2.gz AVBCMKNKYGOFKR-UHFFFAOYSA-N 1 1 327.388 2.406 20 5 EEBDMO CC(C)[C@@H]1CN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000487956546 468062876 /nfs/dbraw/zinc/06/28/76/468062876.db2.gz LTPLRJJNDNSSPB-BBRMVZONSA-N 1 1 334.420 2.194 20 5 EEBDMO COCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCC[C@H]1C ZINC000488036517 468068830 /nfs/dbraw/zinc/06/88/30/468068830.db2.gz RPBNPIIPGMOKHK-IUODEOHRSA-N 1 1 335.404 2.331 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@@H](n3cccn3)C1)OCCO2 ZINC000589737419 468180786 /nfs/dbraw/zinc/18/07/86/468180786.db2.gz ZIXQSNWGCUSUNA-CYBMUJFWSA-N 1 1 330.344 2.010 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@H](n3cccn3)C1)OCCO2 ZINC000589737419 468180788 /nfs/dbraw/zinc/18/07/88/468180788.db2.gz ZIXQSNWGCUSUNA-CYBMUJFWSA-N 1 1 330.344 2.010 20 5 EEBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000533454000 468200872 /nfs/dbraw/zinc/20/08/72/468200872.db2.gz FTMRQPUFRLJMPI-SWLSCSKDSA-N 1 1 332.404 2.022 20 5 EEBDMO CC(C)(C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000590033663 468206418 /nfs/dbraw/zinc/20/64/18/468206418.db2.gz WNFWWURXKGTZME-AWEZNQCLSA-N 1 1 331.416 2.473 20 5 EEBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594212102 468514538 /nfs/dbraw/zinc/51/45/38/468514538.db2.gz SLPRQSBTQPRKHW-HZPDHXFCSA-N 1 1 332.404 2.411 20 5 EEBDMO Nc1c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc(F)cc1[N+](=O)[O-] ZINC000594418557 468579135 /nfs/dbraw/zinc/57/91/35/468579135.db2.gz KDNJFASVYGAOGC-CHWSQXEVSA-N 1 1 336.367 2.063 20 5 EEBDMO COc1ccc(CC(=O)N2CCC[C@]3(CC[N@@H+](C)C3)C2)cc1[N+](=O)[O-] ZINC000597714163 468649404 /nfs/dbraw/zinc/64/94/04/468649404.db2.gz GWEFSZMQNQNVKI-GOSISDBHSA-N 1 1 347.415 2.090 20 5 EEBDMO COc1c(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000597859918 468696018 /nfs/dbraw/zinc/69/60/18/468696018.db2.gz IAGAEXBIUBVOMJ-LBPRGKRZSA-N 1 1 335.404 2.454 20 5 EEBDMO O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000598221920 468797688 /nfs/dbraw/zinc/79/76/88/468797688.db2.gz YOFIWVQHPMXSGD-AWEZNQCLSA-N 1 1 347.415 2.497 20 5 EEBDMO COC(=O)c1ccnc(NC[C@@H](C)[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000598589789 468924916 /nfs/dbraw/zinc/92/49/16/468924916.db2.gz JNIWZUKAJSJIQH-VXGBXAGGSA-N 1 1 336.392 2.451 20 5 EEBDMO COc1ccc(OCC[N@@H+]2CCOC[C@H]2C2CCC2)c([N+](=O)[O-])c1 ZINC000572518457 468945171 /nfs/dbraw/zinc/94/51/71/468945171.db2.gz UDPHEKBSIMNGSL-INIZCTEOSA-N 1 1 336.388 2.483 20 5 EEBDMO COc1ccc(OCC[N@H+]2CCOC[C@H]2C2CCC2)c([N+](=O)[O-])c1 ZINC000572518457 468945175 /nfs/dbraw/zinc/94/51/75/468945175.db2.gz UDPHEKBSIMNGSL-INIZCTEOSA-N 1 1 336.388 2.483 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@@H]1[C@H](C)CO ZINC000595672348 468948271 /nfs/dbraw/zinc/94/82/71/468948271.db2.gz ICBSKGXPPJQNHC-CZUORRHYSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCC[C@H]1[C@H](C)CO ZINC000595677550 468950718 /nfs/dbraw/zinc/95/07/18/468950718.db2.gz OWFPEAKTLYGAFE-KGLIPLIRSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCCC[C@H]1[C@H](C)CO ZINC000595677550 468950719 /nfs/dbraw/zinc/95/07/19/468950719.db2.gz OWFPEAKTLYGAFE-KGLIPLIRSA-N 1 1 335.404 2.325 20 5 EEBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](CCN2CCOCC2)CC2CC2)c1 ZINC000595806778 469020125 /nfs/dbraw/zinc/02/01/25/469020125.db2.gz GFWZOMRGVRXVDT-UHFFFAOYSA-N 1 1 349.431 2.018 20 5 EEBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1 ZINC000602800520 469084481 /nfs/dbraw/zinc/08/44/81/469084481.db2.gz XMZVJKLLPFNSJH-CYBMUJFWSA-N 1 1 338.408 2.011 20 5 EEBDMO COCc1cccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1 ZINC000610991306 469132028 /nfs/dbraw/zinc/13/20/28/469132028.db2.gz JBMJIIQNIGNYNC-UHFFFAOYSA-N 1 1 342.399 2.458 20 5 EEBDMO CC[N@H+]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C[C@@H]1C ZINC000611084527 469156130 /nfs/dbraw/zinc/15/61/30/469156130.db2.gz CIBWXBDJSWACOW-ZDUSSCGKSA-N 1 1 334.420 2.263 20 5 EEBDMO CC[N@@H+](CCNc1ccc([N+](=O)[O-])c(C(N)=O)c1)CCC(F)(F)F ZINC000596210181 469203222 /nfs/dbraw/zinc/20/32/22/469203222.db2.gz LIEPFHZHDNZWBJ-UHFFFAOYSA-N 1 1 348.325 2.380 20 5 EEBDMO O=C(C[N@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21)Nc1ccccc1[N+](=O)[O-] ZINC000602997840 469212925 /nfs/dbraw/zinc/21/29/25/469212925.db2.gz RXCYABVMMSYMQZ-NOLJZWGESA-N 1 1 333.388 2.159 20 5 EEBDMO O=C(C[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21)Nc1ccccc1[N+](=O)[O-] ZINC000602997840 469212929 /nfs/dbraw/zinc/21/29/29/469212929.db2.gz RXCYABVMMSYMQZ-NOLJZWGESA-N 1 1 333.388 2.159 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCC(F)(F)CC1 ZINC000599552028 469290814 /nfs/dbraw/zinc/29/08/14/469290814.db2.gz CUBTURWUJZNGCT-LBPRGKRZSA-N 1 1 330.331 2.456 20 5 EEBDMO CCn1nc(C)c([N+](=O)[O-])c1N(C)CCC[N@@H+](C)Cc1ccncc1 ZINC000603398537 469377158 /nfs/dbraw/zinc/37/71/58/469377158.db2.gz ASMRFHAWMMVUBM-UHFFFAOYSA-N 1 1 346.435 2.473 20 5 EEBDMO O=C(CC[N@H+]1CCC[C@H](n2ccnc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000609157460 469898815 /nfs/dbraw/zinc/89/88/15/469898815.db2.gz RUIBLBADMCYVER-AWEZNQCLSA-N 1 1 343.387 2.457 20 5 EEBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)[C@@H]2C1 ZINC000425059879 536488305 /nfs/dbraw/zinc/48/83/05/536488305.db2.gz SXWSWVBAWIWVBW-SWLSCSKDSA-N 1 1 328.372 2.242 20 5 EEBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3F)CC2)c1 ZINC000769717637 577583047 /nfs/dbraw/zinc/58/30/47/577583047.db2.gz PNAGGAJQDVGXOM-UHFFFAOYSA-N 1 1 344.346 2.400 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCNc2nc3ccccn3c2[N+](=O)[O-])CCCO1 ZINC000763053817 577713589 /nfs/dbraw/zinc/71/35/89/577713589.db2.gz GCAHTZXTUBBUNS-CYBMUJFWSA-N 1 1 333.392 2.155 20 5 EEBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000891190730 676150935 /nfs/dbraw/zinc/15/09/35/676150935.db2.gz CPHLSXYTAFJTIE-ZDUSSCGKSA-N 1 1 342.399 2.496 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000891190730 676150936 /nfs/dbraw/zinc/15/09/36/676150936.db2.gz CPHLSXYTAFJTIE-ZDUSSCGKSA-N 1 1 342.399 2.496 20 5 EEBDMO CCOc1ccc(C[NH+]2CCN(c3c([N+](=O)[O-])cnn3C)CC2)cc1 ZINC000891620281 676728219 /nfs/dbraw/zinc/72/82/19/676728219.db2.gz UUOPHBXVEUITHD-UHFFFAOYSA-N 1 1 345.403 2.049 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)N[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC001059229935 683423811 /nfs/dbraw/zinc/42/38/11/683423811.db2.gz ZDKONTXJGJDUHV-SHTZXODSSA-N 1 1 343.387 2.167 20 5 EEBDMO CCc1ccc(C[NH+]2CCN(c3c([N+](=O)[O-])cnn3C)CC2)cc1 ZINC000895137348 684085282 /nfs/dbraw/zinc/08/52/82/684085282.db2.gz ZYGZMXOQWYFNLX-UHFFFAOYSA-N 1 1 329.404 2.213 20 5 EEBDMO CC(C)c1ccc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)cc1[N+](=O)[O-] ZINC000896542069 685038456 /nfs/dbraw/zinc/03/84/56/685038456.db2.gz BEOJDQVNHDQZKU-SUMWQHHRSA-N 1 1 348.447 2.082 20 5 EEBDMO Cc1ccc(F)cc1C[N@H+](C)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985429618 686684112 /nfs/dbraw/zinc/68/41/12/686684112.db2.gz AZIHDQLUDZRAEF-IAGOWNOFSA-N 1 1 349.406 2.222 20 5 EEBDMO Cc1ccc(F)cc1C[N@@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985429618 686684115 /nfs/dbraw/zinc/68/41/15/686684115.db2.gz AZIHDQLUDZRAEF-IAGOWNOFSA-N 1 1 349.406 2.222 20 5 EEBDMO Cc1ccc(F)cc1C[N@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985429618 686684119 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ITCCHJUAZZPJOX-GDBMZVCRSA-N 1 1 343.387 2.312 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N(C)CCN(C)c1ccc([N+](=O)[O-])c(C)c1 ZINC001105441686 1187158709 /nfs/dbraw/zinc/15/87/09/1187158709.db2.gz DUJMUGYWBHVFKL-UHFFFAOYSA-N 1 1 336.436 2.140 20 5 EEBDMO CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](CCC2=CCCCC2)CC1 ZINC001005381508 1195314080 /nfs/dbraw/zinc/31/40/80/1195314080.db2.gz MHBUKQRHVWCKQX-IAGOWNOFSA-N 1 1 335.448 2.465 20 5 EEBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2cccc(F)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034642822 1196463742 /nfs/dbraw/zinc/46/37/42/1196463742.db2.gz GFTMHWINPBXMBW-KLHDSHLOSA-N 1 1 335.379 2.008 20 5 EEBDMO O=C(NC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1)C(F)(F)F ZINC000810066272 1199255995 /nfs/dbraw/zinc/25/59/95/1199255995.db2.gz JBARCHOPTHSPGB-GFCCVEGCSA-N 1 1 345.321 2.485 20 5 EEBDMO CCOC(=O)Cc1ccc(N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000826108692 1201043401 /nfs/dbraw/zinc/04/34/01/1201043401.db2.gz MWHYBXJHJUBAPM-BETUJISGSA-N 1 1 335.404 2.229 20 5 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CC(=O)N(C)[C@@H]1CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172913546 797172312 /nfs/dbraw/zinc/17/23/12/797172312.db2.gz RORGHEZIZJXKJO-FUHWJXTLSA-N 1 1 331.416 2.395 20 5 EEBDMO Cc1nc(NC2CCN(C(=O)C[N@H+](C)C(C)C)CC2)ccc1[N+](=O)[O-] ZINC001095228642 797551941 /nfs/dbraw/zinc/55/19/41/797551941.db2.gz OLBCGTFFYYIIFT-UHFFFAOYSA-N 1 1 349.435 2.041 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)N1CCC(Nc2ccccc2[N+](=O)[O-])CC1 ZINC001095229640 797560663 /nfs/dbraw/zinc/56/06/63/797560663.db2.gz RLAJVVANRSAKLF-UHFFFAOYSA-N 1 1 334.420 2.338 20 5 EEBDMO O=C(NC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1)c1ccsn1 ZINC001003121801 799255699 /nfs/dbraw/zinc/25/56/99/799255699.db2.gz STMFBXJZEIHIOP-UHFFFAOYSA-N 1 1 346.412 2.446 20 5 EEBDMO O=[N+]([O-])c1ccccc1CN1CC[NH+](CCc2ccncc2)CC1 ZINC000829056349 800920752 /nfs/dbraw/zinc/92/07/52/800920752.db2.gz KETVYBZZNLOYFN-UHFFFAOYSA-N 1 1 326.400 2.350 20 5 EEBDMO CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)[N@@H+]2[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169013966 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KKAGXWTUVNNTKH-NSHDSACASA-N 1 1 340.811 2.248 20 5 EEBDMO CN1CCC([N@@H+]2CC[C@H](Nc3c([N+](=O)[O-])cccc3[N+](=O)[O-])C2)CC1 ZINC000804450279 810875972 /nfs/dbraw/zinc/87/59/72/810875972.db2.gz JJAHBXMVMAMGHX-LBPRGKRZSA-N 1 1 349.391 2.083 20 5 EEBDMO CN1CCC([N@H+]2CC[C@H](Nc3c([N+](=O)[O-])cccc3[N+](=O)[O-])C2)CC1 ZINC000804450279 810875979 /nfs/dbraw/zinc/87/59/79/810875979.db2.gz JJAHBXMVMAMGHX-LBPRGKRZSA-N 1 1 349.391 2.083 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000807987778 812403961 /nfs/dbraw/zinc/40/39/61/812403961.db2.gz NNOGHVPYDDHARO-LLVKDONJSA-N 1 1 349.416 2.156 20 5 EEBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CCC(C[N@@H+](C)C(C)C)CC1 ZINC001520820132 1119195952 /nfs/dbraw/zinc/19/59/52/1119195952.db2.gz FQDYZETZRWLJMB-ZDUSSCGKSA-N 1 1 338.456 2.192 20 5 EEBDMO Nc1c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000267193068 201230040 /nfs/dbraw/zinc/23/00/40/201230040.db2.gz LMDDBUVGJWHXMW-AWEZNQCLSA-N 1 1 340.383 2.181 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@@H+](C)Cc2ccccc2)n1 ZINC000286511238 201335337 /nfs/dbraw/zinc/33/53/37/201335337.db2.gz WRFAJMSYOICYPX-UHFFFAOYSA-N 1 1 344.371 2.320 20 5 EEBDMO COc1ccc(OCCN[C@@H](C[NH3+])C2CCCCC2)c([N+](=O)[O-])c1 ZINC000420354360 239774670 /nfs/dbraw/zinc/77/46/70/239774670.db2.gz BFFNPZMSILPMOW-HNNXBMFYSA-N 1 1 337.420 2.479 20 5 EEBDMO C[C@H](NC[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000423382271 240461752 /nfs/dbraw/zinc/46/17/52/240461752.db2.gz IJUYLDMCDYQUCH-FZMZJTMJSA-N 1 1 346.353 2.082 20 5 EEBDMO C[C@H](c1cccc(S(N)(=O)=O)c1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000069561894 203018829 /nfs/dbraw/zinc/01/88/29/203018829.db2.gz PNCBGYMRTIVWAV-GFCCVEGCSA-N 1 1 349.412 2.435 20 5 EEBDMO C[C@H](c1cccc(S(N)(=O)=O)c1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000069561894 203018833 /nfs/dbraw/zinc/01/88/33/203018833.db2.gz PNCBGYMRTIVWAV-GFCCVEGCSA-N 1 1 349.412 2.435 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)[C@@H](C)C1 ZINC000245521094 205139055 /nfs/dbraw/zinc/13/90/55/205139055.db2.gz KLFBWCJFGXGUAE-WCQYABFASA-N 1 1 349.387 2.126 20 5 EEBDMO CCC1(CO)CC[NH+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000128278250 205141026 /nfs/dbraw/zinc/14/10/26/205141026.db2.gz KFCPUUQMVMWREL-CYBMUJFWSA-N 1 1 335.404 2.406 20 5 EEBDMO CC[C@@H]1C[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCO1 ZINC000128271209 205142348 /nfs/dbraw/zinc/14/23/48/205142348.db2.gz WTLRXBDHHGLVSW-GFCCVEGCSA-N 1 1 325.340 2.173 20 5 EEBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCO1 ZINC000128271209 205142352 /nfs/dbraw/zinc/14/23/52/205142352.db2.gz WTLRXBDHHGLVSW-GFCCVEGCSA-N 1 1 325.340 2.173 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@H]2CCC[N@@H+]2C[C@H]1C ZINC000247409327 205286605 /nfs/dbraw/zinc/28/66/05/205286605.db2.gz PZPXTAXWRJZVAZ-UKRRQHHQSA-N 1 1 332.404 2.010 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000492072063 246288517 /nfs/dbraw/zinc/28/85/17/246288517.db2.gz HZPPUFXCSKGLSX-RIEIZIRISA-N 1 1 333.363 2.489 20 5 EEBDMO CCCc1n[nH]c(C(=O)NCC[N@H+]2CCCC[C@@H]2CC)c1[N+](=O)[O-] ZINC000265094664 247198941 /nfs/dbraw/zinc/19/89/41/247198941.db2.gz VEWZUXVANUAQLX-LBPRGKRZSA-N 1 1 337.424 2.265 20 5 EEBDMO C[N@@H+](CCCCc1ccccc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174737880 207053188 /nfs/dbraw/zinc/05/31/88/207053188.db2.gz XMIXCXLZKMSERV-KRWDZBQOSA-N 1 1 332.404 2.107 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCN(Cc3ccc(F)cc3)CC2)n1 ZINC000176201542 207200767 /nfs/dbraw/zinc/20/07/67/207200767.db2.gz XLGVFKMFCLVHHU-UHFFFAOYSA-N 1 1 347.394 2.138 20 5 EEBDMO O=[N+]([O-])c1ccn(CCN2CCC[N@H+](Cc3ccc(F)cc3)CC2)n1 ZINC000176201542 207200772 /nfs/dbraw/zinc/20/07/72/207200772.db2.gz XLGVFKMFCLVHHU-UHFFFAOYSA-N 1 1 347.394 2.138 20 5 EEBDMO O=[N+]([O-])c1ccn(CCN2CCC[N@@H+](Cc3ccc(F)cc3)CC2)n1 ZINC000176201542 207200774 /nfs/dbraw/zinc/20/07/74/207200774.db2.gz XLGVFKMFCLVHHU-UHFFFAOYSA-N 1 1 347.394 2.138 20 5 EEBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000267166806 256033997 /nfs/dbraw/zinc/03/39/97/256033997.db2.gz BDTRBWLNVUPRPT-KRWDZBQOSA-N 1 1 342.399 2.129 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1[C@H](C)CCC[C@@H]1CO ZINC000270408851 256132352 /nfs/dbraw/zinc/13/23/52/256132352.db2.gz DLYXGTJSRPOBEL-UKRRQHHQSA-N 1 1 335.404 2.467 20 5 EEBDMO Cc1cc([N+](=O)[O-])cnc1N1CCC([NH+]2CCN(C(C)C)CC2)CC1 ZINC000270509351 256142659 /nfs/dbraw/zinc/14/26/59/256142659.db2.gz WHHFSYXIIDXUJW-UHFFFAOYSA-N 1 1 347.463 2.293 20 5 EEBDMO C[C@H]([NH2+]CC(=O)N1CCO[C@@H]2CCCC[C@H]21)c1ccccc1[N+](=O)[O-] ZINC000271733659 256238852 /nfs/dbraw/zinc/23/88/52/256238852.db2.gz NKKMJJZKAUTURV-IAOVAPTHSA-N 1 1 347.415 2.415 20 5 EEBDMO O=[N+]([O-])c1cccnc1NCc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000273233435 256278726 /nfs/dbraw/zinc/27/87/26/256278726.db2.gz SAGKNBCRDZDLOL-OAHLLOKOSA-N 1 1 328.372 2.169 20 5 EEBDMO O=[N+]([O-])c1cccc(Cl)c1N1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1 ZINC000368639512 296510896 /nfs/dbraw/zinc/51/08/96/296510896.db2.gz VTIYBNVYXXYGDM-OCCSQVGLSA-N 1 1 325.796 2.284 20 5 EEBDMO O=[N+]([O-])c1cnn(CCN2CC[NH+](C/C=C\c3ccccc3)CC2)c1 ZINC000255395324 160397295 /nfs/dbraw/zinc/39/72/95/160397295.db2.gz HMDLMWVOHGGMLC-DAXSKMNVSA-N 1 1 341.415 2.122 20 5 EEBDMO COc1ccc(OCC[N@@H+](C)C[C@@H]2CCCC[C@H]2O)c([N+](=O)[O-])c1 ZINC000245556134 160241602 /nfs/dbraw/zinc/24/16/02/160241602.db2.gz UFKCVBIMXPIRJB-XJKSGUPXSA-N 1 1 338.404 2.465 20 5 EEBDMO Cn1ccnc1C[C@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000245829093 160253160 /nfs/dbraw/zinc/25/31/60/160253160.db2.gz GBDUSUFFBYCNEE-RHSMWYFYSA-N 1 1 344.415 2.316 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]2OCCC[C@@H]2C1 ZINC000246442542 160278851 /nfs/dbraw/zinc/27/88/51/160278851.db2.gz BLLQKWVXHCBWGO-IOASZLSFSA-N 1 1 333.388 2.423 20 5 EEBDMO C[C@@H](c1cccnc1)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248450355 160346678 /nfs/dbraw/zinc/34/66/78/160346678.db2.gz IPUQKLQUPDVAOP-DZGCQCFKSA-N 1 1 331.372 2.423 20 5 EEBDMO CC[N@@H+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000341771904 161012102 /nfs/dbraw/zinc/01/21/02/161012102.db2.gz JLMWNVMWXQSNOQ-LBPRGKRZSA-N 1 1 332.404 2.335 20 5 EEBDMO CC[N@H+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000341771904 161012103 /nfs/dbraw/zinc/01/21/03/161012103.db2.gz JLMWNVMWXQSNOQ-LBPRGKRZSA-N 1 1 332.404 2.335 20 5 EEBDMO COC1(C)CC[NH+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000342152905 161043618 /nfs/dbraw/zinc/04/36/18/161043618.db2.gz LIPZQHAFJNWOEN-OAHLLOKOSA-N 1 1 333.388 2.201 20 5 EEBDMO CC[N@@H+](CCNc1cccc(C(N)=O)c1[N+](=O)[O-])CCC(F)(F)F ZINC000343205917 161112837 /nfs/dbraw/zinc/11/28/37/161112837.db2.gz MTYJWPWQAIQRMA-UHFFFAOYSA-N 1 1 348.325 2.380 20 5 EEBDMO CCn1cc(C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CCO)cn1 ZINC000355494519 163210230 /nfs/dbraw/zinc/21/02/30/163210230.db2.gz KRLATPNVTIOHDN-FNORWQNLSA-N 1 1 330.388 2.319 20 5 EEBDMO CCn1cc(C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CCO)cn1 ZINC000355494519 163210233 /nfs/dbraw/zinc/21/02/33/163210233.db2.gz KRLATPNVTIOHDN-FNORWQNLSA-N 1 1 330.388 2.319 20 5 EEBDMO Cc1ccnc(NC[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000355723622 163281568 /nfs/dbraw/zinc/28/15/68/163281568.db2.gz UAQNSQJEUNYTIS-GOSISDBHSA-N 1 1 342.399 2.347 20 5 EEBDMO C[N@H+](CC(=O)NCCc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000358908937 164013679 /nfs/dbraw/zinc/01/36/79/164013679.db2.gz UKXNQICCKSOCRM-UHFFFAOYSA-N 1 1 327.384 2.386 20 5 EEBDMO C[N@@H+](CC(=O)NCCc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000358908937 164013681 /nfs/dbraw/zinc/01/36/81/164013681.db2.gz UKXNQICCKSOCRM-UHFFFAOYSA-N 1 1 327.384 2.386 20 5 EEBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1 ZINC000364063022 165013301 /nfs/dbraw/zinc/01/33/01/165013301.db2.gz HMIBVPUPRPSDTN-AWEZNQCLSA-N 1 1 333.388 2.060 20 5 EEBDMO CC1(C)C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@@H]1O ZINC000275467012 269118818 /nfs/dbraw/zinc/11/88/18/269118818.db2.gz OAHXMBJEXGFBLL-ZDUSSCGKSA-N 1 1 332.360 2.238 20 5 EEBDMO CC1(C)C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@@H]1O ZINC000275467012 269118819 /nfs/dbraw/zinc/11/88/19/269118819.db2.gz OAHXMBJEXGFBLL-ZDUSSCGKSA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@]1(C(N)=O)CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000280310810 269349588 /nfs/dbraw/zinc/34/95/88/269349588.db2.gz POWBXPAVIWHJMB-INIZCTEOSA-N 1 1 346.412 2.416 20 5 EEBDMO O=C(COc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000277404452 274290700 /nfs/dbraw/zinc/29/07/00/274290700.db2.gz BNYBNUGARWYVBA-HNNXBMFYSA-N 1 1 333.388 2.107 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000277597814 274318305 /nfs/dbraw/zinc/31/83/05/274318305.db2.gz OGNLHGOXTYVCBA-DOMZBBRYSA-N 1 1 333.388 2.160 20 5 EEBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[N@@H+](C)CCOC ZINC000289603209 275131693 /nfs/dbraw/zinc/13/16/93/275131693.db2.gz ABRPZDFABHWFMK-UHFFFAOYSA-N 1 1 338.408 2.247 20 5 EEBDMO Cc1cc(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)cc(N2CCCC2)[nH+]1 ZINC000290892292 275249976 /nfs/dbraw/zinc/24/99/76/275249976.db2.gz FZXYOZJHBTZCKL-UHFFFAOYSA-N 1 1 329.360 2.157 20 5 EEBDMO CCOc1ccc(NC(=O)C[N@H+](CC)C[C@@H](C)OC)c([N+](=O)[O-])c1 ZINC000291299547 275291800 /nfs/dbraw/zinc/29/18/00/275291800.db2.gz RYLWYUGZFXPRGT-GFCCVEGCSA-N 1 1 339.392 2.289 20 5 EEBDMO CCOc1ccc(NC(=O)C[N@@H+](CC)C[C@@H](C)OC)c([N+](=O)[O-])c1 ZINC000291299547 275291802 /nfs/dbraw/zinc/29/18/02/275291802.db2.gz RYLWYUGZFXPRGT-GFCCVEGCSA-N 1 1 339.392 2.289 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c4cccnc34)C2)C1 ZINC000292168737 275387444 /nfs/dbraw/zinc/38/74/44/275387444.db2.gz JTYUFKMGWYXSKW-GOSISDBHSA-N 1 1 340.383 2.311 20 5 EEBDMO C[N@H+]1CC[C@@H]2OCCN(Cc3c(Cl)cccc3[N+](=O)[O-])[C@H]2C1 ZINC000344980744 277153799 /nfs/dbraw/zinc/15/37/99/277153799.db2.gz WLYGBNMQVPYTOJ-GJZGRUSLSA-N 1 1 325.796 2.153 20 5 EEBDMO CN(C(=O)/C=C\c1cccc([N+](=O)[O-])c1)C(C)(C)C[NH+]1CCOCC1 ZINC000493778047 288775854 /nfs/dbraw/zinc/77/58/54/288775854.db2.gz BKBMDWHLZUQGTQ-FPLPWBNLSA-N 1 1 347.415 2.177 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2C[C@@H](C)OC[C@H]2C)c([N+](=O)[O-])c1 ZINC000297985140 294389489 /nfs/dbraw/zinc/38/94/89/294389489.db2.gz WNNHZKFSSUVMBR-VXGBXAGGSA-N 1 1 337.376 2.041 20 5 EEBDMO COc1cccc(C(=O)N2C[C@@H]3CCCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-] ZINC000332523172 312019405 /nfs/dbraw/zinc/01/94/05/312019405.db2.gz ATZYVCJMPXTYAN-STQMWFEESA-N 1 1 333.388 2.302 20 5 EEBDMO C[C@H]1C[C@H](C(=O)OC(C)(C)C)C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC000421025492 314029560 /nfs/dbraw/zinc/02/95/60/314029560.db2.gz QXZLJVCZDCRGRN-STQMWFEESA-N 1 1 338.408 2.091 20 5 EEBDMO CC[N@@H+](CCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000444162877 315277779 /nfs/dbraw/zinc/27/77/79/315277779.db2.gz CBCHGQGTAPIACW-UHFFFAOYSA-N 1 1 349.840 2.257 20 5 EEBDMO COc1ccccc1C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000507218031 316375951 /nfs/dbraw/zinc/37/59/51/316375951.db2.gz ZCXQHJOZUSRGKM-UHFFFAOYSA-N 1 1 328.372 2.321 20 5 EEBDMO C[C@@H]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000548090597 318353684 /nfs/dbraw/zinc/35/36/84/318353684.db2.gz DHYWNTGWBPTQCX-CYBMUJFWSA-N 1 1 343.387 2.055 20 5 EEBDMO Cc1[nH+]cc2n1C[C@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)CC2 ZINC000553212121 318526200 /nfs/dbraw/zinc/52/62/00/318526200.db2.gz QBCSZGHWWNNBGK-CQSZACIVSA-N 1 1 328.372 2.021 20 5 EEBDMO COCC1(C)CC[NH+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000358738119 465293858 /nfs/dbraw/zinc/29/38/58/465293858.db2.gz BYJHRZZTBYHOIK-UHFFFAOYSA-N 1 1 335.404 2.306 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+](CCCCO)C1CC1 ZINC000152546641 462545784 /nfs/dbraw/zinc/54/57/84/462545784.db2.gz AVEKFSUSACNJTI-UHFFFAOYSA-N 1 1 349.387 2.130 20 5 EEBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000074326571 462587435 /nfs/dbraw/zinc/58/74/35/462587435.db2.gz XRGGEKDTZDPNQN-OAHLLOKOSA-N 1 1 347.415 2.164 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)COc1ccccc1[N+](=O)[O-] ZINC000061525309 462587954 /nfs/dbraw/zinc/58/79/54/462587954.db2.gz FPMSRBCSGOUIIT-AWEZNQCLSA-N 1 1 335.404 2.354 20 5 EEBDMO CNS(=O)(=O)c1cccc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000089512189 462688138 /nfs/dbraw/zinc/68/81/38/462688138.db2.gz FQYYVHARWNUILW-LBPRGKRZSA-N 1 1 349.412 2.354 20 5 EEBDMO CC[N@@H+](C)CCNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116763308 462771331 /nfs/dbraw/zinc/77/13/31/462771331.db2.gz YGWLIWRPMSEQQI-UHFFFAOYSA-N 1 1 329.784 2.085 20 5 EEBDMO O=C(NC[C@H]1CCC[N@H+]1CC1CCCCC1)c1[nH]ncc1[N+](=O)[O-] ZINC000154462145 462771812 /nfs/dbraw/zinc/77/18/12/462771812.db2.gz CKKGQMMZOFAVOC-CYBMUJFWSA-N 1 1 335.408 2.092 20 5 EEBDMO O=C(NC[C@H]1CCC[N@@H+]1CC1CCCCC1)c1n[nH]cc1[N+](=O)[O-] ZINC000154462145 462771815 /nfs/dbraw/zinc/77/18/15/462771815.db2.gz CKKGQMMZOFAVOC-CYBMUJFWSA-N 1 1 335.408 2.092 20 5 EEBDMO O=C(NC[C@H]1CCC[N@H+]1CC1CCCCC1)c1n[nH]cc1[N+](=O)[O-] ZINC000154462145 462771816 /nfs/dbraw/zinc/77/18/16/462771816.db2.gz CKKGQMMZOFAVOC-CYBMUJFWSA-N 1 1 335.408 2.092 20 5 EEBDMO COCC[N@@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@@H]1C ZINC000117436413 462803207 /nfs/dbraw/zinc/80/32/07/462803207.db2.gz YAHHVBVJWLPNSL-LBPRGKRZSA-N 1 1 336.392 2.088 20 5 EEBDMO COCC[N@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@@H]1C ZINC000117436413 462803208 /nfs/dbraw/zinc/80/32/08/462803208.db2.gz YAHHVBVJWLPNSL-LBPRGKRZSA-N 1 1 336.392 2.088 20 5 EEBDMO Cc1nn(C)c(C)c1C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000154887639 462819801 /nfs/dbraw/zinc/81/98/01/462819801.db2.gz VNKVZLOOFGAFRE-UHFFFAOYSA-N 1 1 329.404 2.267 20 5 EEBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000066125541 462853993 /nfs/dbraw/zinc/85/39/93/462853993.db2.gz CMXBCGBYMXAEEE-CYBMUJFWSA-N 1 1 345.403 2.241 20 5 EEBDMO Cc1c(NC(=O)N2CC[C@H](C[NH+]3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000119738025 462924988 /nfs/dbraw/zinc/92/49/88/462924988.db2.gz TZUYYGPUDFAMCD-CQSZACIVSA-N 1 1 348.403 2.089 20 5 EEBDMO Cn1cnnc1[C@@H]1CCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000156608664 463046896 /nfs/dbraw/zinc/04/68/96/463046896.db2.gz QPSZQWVSTYSKLP-HNNXBMFYSA-N 1 1 331.376 2.329 20 5 EEBDMO Cn1cnnc1[C@@H]1CCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000156608664 463046900 /nfs/dbraw/zinc/04/69/00/463046900.db2.gz QPSZQWVSTYSKLP-HNNXBMFYSA-N 1 1 331.376 2.329 20 5 EEBDMO CNC(=O)[C@H](C)C[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000093898934 463052815 /nfs/dbraw/zinc/05/28/15/463052815.db2.gz CZJCLCNGCOKGTI-SECBINFHSA-N 1 1 344.209 2.171 20 5 EEBDMO C[N@H+]1CCC[C@H](CNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000568471946 468340471 /nfs/dbraw/zinc/34/04/71/468340471.db2.gz DZMBJRDMGLWUKG-MRXNPFEDSA-N 1 1 348.447 2.181 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000135635670 463187334 /nfs/dbraw/zinc/18/73/34/463187334.db2.gz CEJVRMOLBNWXOX-SJCJKPOMSA-N 1 1 344.415 2.417 20 5 EEBDMO CN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@@H+](C)C1 ZINC000151127246 463481298 /nfs/dbraw/zinc/48/12/98/463481298.db2.gz RPOUDDJPWCEMOZ-MRXNPFEDSA-N 1 1 334.420 2.340 20 5 EEBDMO C[N@H+]1CCC[C@H](CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000108332683 463598595 /nfs/dbraw/zinc/59/85/95/463598595.db2.gz OCAQXLWQZVZNHD-GFCCVEGCSA-N 1 1 332.404 2.241 20 5 EEBDMO CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccs1 ZINC000286983863 463762619 /nfs/dbraw/zinc/76/26/19/463762619.db2.gz OXXNMGPSQCFFND-JSGCOSHPSA-N 1 1 336.417 2.297 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000177805962 463796008 /nfs/dbraw/zinc/79/60/08/463796008.db2.gz CETWTTZFZRFIHP-CABCVRRESA-N 1 1 347.415 2.449 20 5 EEBDMO CCOc1cc(C[N@@H+]2CC[C@@H](NC(=O)NC3CC3)C2)ccc1[N+](=O)[O-] ZINC000276942772 463815075 /nfs/dbraw/zinc/81/50/75/463815075.db2.gz SLMBHEOZSVZBQA-CQSZACIVSA-N 1 1 348.403 2.029 20 5 EEBDMO CCOc1cc(C[N@H+]2CC[C@@H](NC(=O)NC3CC3)C2)ccc1[N+](=O)[O-] ZINC000276942772 463815082 /nfs/dbraw/zinc/81/50/82/463815082.db2.gz SLMBHEOZSVZBQA-CQSZACIVSA-N 1 1 348.403 2.029 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000262069099 463939242 /nfs/dbraw/zinc/93/92/42/463939242.db2.gz WQRAHAQIEFYENY-MRXNPFEDSA-N 1 1 326.356 2.085 20 5 EEBDMO O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172417065 464074961 /nfs/dbraw/zinc/07/49/61/464074961.db2.gz WQLIMHDETGXXQW-UHFFFAOYSA-N 1 1 347.415 2.451 20 5 EEBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000279270221 464085970 /nfs/dbraw/zinc/08/59/70/464085970.db2.gz JCBIIQIJRYWLGS-STQMWFEESA-N 1 1 333.388 2.350 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCSC[C@H]1C ZINC000172591365 464112706 /nfs/dbraw/zinc/11/27/06/464112706.db2.gz LKXWTCACZNUFCC-LLVKDONJSA-N 1 1 339.417 2.369 20 5 EEBDMO O=C([O-])C[N@@H+](CC1CC1)C1CC(NCc2cccc([N+](=O)[O-])c2)C1 ZINC000263478613 464112944 /nfs/dbraw/zinc/11/29/44/464112944.db2.gz FTQOYBPLZIGCRL-UHFFFAOYSA-N 1 1 333.388 2.012 20 5 EEBDMO 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333.432 2.387 20 5 EEBDMO COc1cc(C[N@@H+](C)C[C@H]2C[C@@H](O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000599674010 469334096 /nfs/dbraw/zinc/33/40/96/469334096.db2.gz VXIVMOBGHFPOAL-JGZJWPJOSA-N 1 1 346.330 2.408 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC2(CCC[N@@H+]2C)CC1 ZINC000612117471 469398727 /nfs/dbraw/zinc/39/87/27/469398727.db2.gz QIBRXOJKHZRBON-UHFFFAOYSA-N 1 1 346.431 2.402 20 5 EEBDMO O=[N+]([O-])c1ccc(OCCN2CCC[N@@H+](C[C@@H]3CCCO3)CC2)cc1 ZINC000604475001 469481395 /nfs/dbraw/zinc/48/13/95/469481395.db2.gz SFYPCMWELQJKHN-SFHVURJKSA-N 1 1 349.431 2.160 20 5 EEBDMO CCn1ccc(C[N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000616785220 469501409 /nfs/dbraw/zinc/50/14/09/469501409.db2.gz CPFJCBUDOOCWOY-UHFFFAOYSA-N 1 1 342.399 2.437 20 5 EEBDMO CCn1ccc(C[N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000616785220 469501414 /nfs/dbraw/zinc/50/14/14/469501414.db2.gz CPFJCBUDOOCWOY-UHFFFAOYSA-N 1 1 342.399 2.437 20 5 EEBDMO 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CCC[N@H+]1CCCC[C@H]1C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC001318058816 1332466369 /nfs/dbraw/zinc/46/63/69/1332466369.db2.gz ANPSRZGXTIBMOL-AWEZNQCLSA-N 1 1 335.404 2.484 20 5 EEBDMO CC1(C)CCC[N@H+]1CCNc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-] ZINC001609145162 1351860579 /nfs/dbraw/zinc/86/05/79/1351860579.db2.gz CPXMORGBEMTCFJ-UHFFFAOYSA-N 1 1 331.380 2.061 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001335837571 1336435398 /nfs/dbraw/zinc/43/53/98/1336435398.db2.gz CZAUAXKITCECJK-SRABZTEZSA-N 1 1 329.400 2.441 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])CCCO1 ZINC001589518973 1349000159 /nfs/dbraw/zinc/00/01/59/1349000159.db2.gz WDARPRMWTILYIW-HNNXBMFYSA-N 1 1 346.391 2.022 20 5 EEBDMO CC(C)C[N@H+]1CC[C@H](CNc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])C1 ZINC001589629457 1349013857 /nfs/dbraw/zinc/01/38/57/1349013857.db2.gz AZFVHMZCDCBLMJ-GFCCVEGCSA-N 1 1 345.407 2.165 20 5 EEBDMO C[C@H]1CSCCC[N@H+]1Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001603949164 1350812071 /nfs/dbraw/zinc/81/20/71/1350812071.db2.gz YBHMVWAHJXMOSF-JTQLQIEISA-N 1 1 334.405 2.102 20 5 EEBDMO CC[C@@H]([NH2+]Cc1ccc(-c2nn[nH]n2)cn1)c1cccc([N+](=O)[O-])c1 ZINC001604061736 1350843211 /nfs/dbraw/zinc/84/32/11/1350843211.db2.gz NXLDXQWUWAEPBO-OAHLLOKOSA-N 1 1 339.359 2.411 20 5 EEBDMO C[N@@H+](C[C@H]1CC1(C)C)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000853628183 1369361108 /nfs/dbraw/zinc/36/11/08/1369361108.db2.gz OXBDCWLSKOHOFT-GFCCVEGCSA-N 1 1 346.387 2.299 20 5 EEBDMO Cn1c[nH+]cc1CCOc1cc(Br)cc([N+](=O)[O-])c1N ZINC000853700517 1369369517 /nfs/dbraw/zinc/36/95/17/1369369517.db2.gz LVJIAQYMXBBHDW-UHFFFAOYSA-N 1 1 341.165 2.295 20 5 EEBDMO [NH3+][C@H]1C[C@@H](NCCc2ccc(Cl)cc2[N+](=O)[O-])C12CCOCC2 ZINC001580162779 1403840260 /nfs/dbraw/zinc/84/02/60/1403840260.db2.gz FPICKKIEKGRUCA-LSDHHAIUSA-N 1 1 339.823 2.277 20 5 EEBDMO N[C@H]1C[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C12CCOCC2 ZINC001580162779 1403840271 /nfs/dbraw/zinc/84/02/71/1403840271.db2.gz FPICKKIEKGRUCA-LSDHHAIUSA-N 1 1 339.823 2.277 20 5 EEBDMO CCn1ccnc1C(=O)NCCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001751987713 1406164251 /nfs/dbraw/zinc/16/42/51/1406164251.db2.gz NOEYYMIYLDBWLN-UHFFFAOYSA-N 1 1 345.403 2.063 20 5 EEBDMO O=C(C1=COCCC1)N1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000980819515 775721601 /nfs/dbraw/zinc/72/16/01/775721601.db2.gz VBCVFPRXRIMMTP-UHFFFAOYSA-N 1 1 345.399 2.323 20 5 EEBDMO O=C(C1=COCCC1)N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000980819515 775721610 /nfs/dbraw/zinc/72/16/10/775721610.db2.gz VBCVFPRXRIMMTP-UHFFFAOYSA-N 1 1 345.399 2.323 20 5 EEBDMO Cc1c(Br)c(N2CC[C@H]3C[N@@H+](C)C[C@H]32)ncc1[N+](=O)[O-] ZINC000893938533 780320419 /nfs/dbraw/zinc/32/04/19/780320419.db2.gz FBJFKBAUSPJXBH-GXSJLCMTSA-N 1 1 341.209 2.201 20 5 EEBDMO Cc1c(Br)c(N2CC[C@H]3C[N@H+](C)C[C@H]32)ncc1[N+](=O)[O-] ZINC000893938533 780320422 /nfs/dbraw/zinc/32/04/22/780320422.db2.gz FBJFKBAUSPJXBH-GXSJLCMTSA-N 1 1 341.209 2.201 20 5 EEBDMO C[C@H]1C[C@H](CO)C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000817277776 784655687 /nfs/dbraw/zinc/65/56/87/784655687.db2.gz MLVFVLNKMCUTSM-RYUDHWBXSA-N 1 1 339.367 2.013 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NC/C=C/CNc1nccc(C)c1[N+](=O)[O-] ZINC001107275242 786686147 /nfs/dbraw/zinc/68/61/47/786686147.db2.gz QZTYOLXLEAWPLQ-AATRIKPKSA-N 1 1 349.435 2.114 20 5 EEBDMO Cc1ccc(CC[NH+]2CCC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001001400574 796820421 /nfs/dbraw/zinc/82/04/21/796820421.db2.gz VBIHXUOTKJBUPA-QZTJIDSGSA-N 1 1 345.443 2.031 20 5 EEBDMO COC(=O)C1([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCOCC1 ZINC001172898475 797128316 /nfs/dbraw/zinc/12/83/16/797128316.db2.gz BJHDDCZDKPVSJW-HNNXBMFYSA-N 1 1 348.399 2.154 20 5 EEBDMO COC(=O)C1([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCOCC1 ZINC001172898476 797128369 /nfs/dbraw/zinc/12/83/69/797128369.db2.gz BJHDDCZDKPVSJW-OAHLLOKOSA-N 1 1 348.399 2.154 20 5 EEBDMO O=C1CC[C@@H]2C[N@@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CCN12 ZINC001172912548 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EEBDMO O=C(NC1CC[NH+](Cc2cc3ccccc3o2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001002782708 798604709 /nfs/dbraw/zinc/60/47/09/798604709.db2.gz OCVOARMCUBMHDC-HZPDHXFCSA-N 1 1 343.383 2.179 20 5 EEBDMO CCCc1ccc(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC001086363382 802829548 /nfs/dbraw/zinc/82/95/48/802829548.db2.gz QUFLPLLZLMIDJD-BRSBDYLESA-N 1 1 345.443 2.289 20 5 EEBDMO O=C1C[C@@H]2[C@H](CC[N@@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)N1c1ccsc1 ZINC001169026952 803592332 /nfs/dbraw/zinc/59/23/32/803592332.db2.gz ZJAFVKHNKNKCIC-NZBPQXDJSA-N 1 1 335.429 2.373 20 5 EEBDMO COC(=O)[C@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C[C@@H]1c1ccccc1 ZINC001169057875 803598255 /nfs/dbraw/zinc/59/82/55/803598255.db2.gz YNQKHLSZLPKPLN-DZUCGIPZSA-N 1 1 332.400 2.320 20 5 EEBDMO C[C@@H]1CN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000790785919 808918348 /nfs/dbraw/zinc/91/83/48/808918348.db2.gz ADLBOLANSRLBQN-SECBINFHSA-N 1 1 329.759 2.092 20 5 EEBDMO 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529761243 /nfs/dbraw/zinc/76/12/43/529761243.db2.gz PRUCGPAETYOONS-LBPRGKRZSA-N 1 1 346.391 2.047 20 5 EEBDMO C[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(C1CC1)C1CC1 ZINC000181644886 529928093 /nfs/dbraw/zinc/92/80/93/529928093.db2.gz WYJQZWLCMFGQBA-UHFFFAOYSA-N 1 1 338.429 2.489 20 5 EEBDMO CN(C)S(=O)(=O)c1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000237109406 201149590 /nfs/dbraw/zinc/14/95/90/201149590.db2.gz OPLYGDOSWKNSMF-UHFFFAOYSA-N 1 1 349.412 2.135 20 5 EEBDMO Cc1cc(NC(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)n(C)n1 ZINC000067458492 201160700 /nfs/dbraw/zinc/16/07/00/201160700.db2.gz BUVRWJLUSQFAHF-UHFFFAOYSA-N 1 1 345.403 2.486 20 5 EEBDMO Cc1cc(NC(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)n(C)n1 ZINC000067458492 201160703 /nfs/dbraw/zinc/16/07/03/201160703.db2.gz BUVRWJLUSQFAHF-UHFFFAOYSA-N 1 1 345.403 2.486 20 5 EEBDMO CN1CC[N@@H+](C)C[C@@H]1CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000264701460 201212442 /nfs/dbraw/zinc/21/24/42/201212442.db2.gz FBHPOKQFMUJDID-NSHDSACASA-N 1 1 332.326 2.271 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000193723219 240283203 /nfs/dbraw/zinc/28/32/03/240283203.db2.gz HLLDQYOXOWBOLH-LLVKDONJSA-N 1 1 347.824 2.011 20 5 EEBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000426141862 241224983 /nfs/dbraw/zinc/22/49/83/241224983.db2.gz XKUNKLIQMJTULJ-SECBINFHSA-N 1 1 349.284 2.234 20 5 EEBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000426141862 241224988 /nfs/dbraw/zinc/22/49/88/241224988.db2.gz XKUNKLIQMJTULJ-SECBINFHSA-N 1 1 349.284 2.234 20 5 EEBDMO COC[C@@]1(CO)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000449695683 242605727 /nfs/dbraw/zinc/60/57/27/242605727.db2.gz JGDBDHHSTFCMLM-HNNXBMFYSA-N 1 1 346.330 2.027 20 5 EEBDMO COC[C@@]1(CO)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000449695683 242605732 /nfs/dbraw/zinc/60/57/32/242605732.db2.gz JGDBDHHSTFCMLM-HNNXBMFYSA-N 1 1 346.330 2.027 20 5 EEBDMO 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COc1ccc(OCC[N@H+]2C[C@@H](C)O[C@H](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000279201514 464061503 /nfs/dbraw/zinc/06/15/03/464061503.db2.gz AWAVZQZWTBVLKI-PXAZEXFGSA-N 1 1 336.388 2.482 20 5 EEBDMO COc1cc(C[N@@H+]2CC[C@H](O)[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000186927104 464082119 /nfs/dbraw/zinc/08/21/19/464082119.db2.gz KHOPJRFDQTVXNK-SKDRFNHKSA-N 1 1 346.330 2.408 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@H](O)[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000186927104 464082123 /nfs/dbraw/zinc/08/21/23/464082123.db2.gz KHOPJRFDQTVXNK-SKDRFNHKSA-N 1 1 346.330 2.408 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H]1C[C@H](C)O ZINC000269783487 464092346 /nfs/dbraw/zinc/09/23/46/464092346.db2.gz HDAQIDQQBYGMTD-UONOGXRCSA-N 1 1 335.404 2.467 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CCC[C@@H]1O ZINC000270202329 464218517 /nfs/dbraw/zinc/21/85/17/464218517.db2.gz XJOCLAZHNKNZFS-YGRLFVJLSA-N 1 1 341.795 2.280 20 5 EEBDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CCC[C@@H]1O ZINC000270202329 464218522 /nfs/dbraw/zinc/21/85/22/464218522.db2.gz XJOCLAZHNKNZFS-YGRLFVJLSA-N 1 1 341.795 2.280 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000284685003 464293359 /nfs/dbraw/zinc/29/33/59/464293359.db2.gz HOYQGAMHXIBDLI-CABCVRRESA-N 1 1 349.387 2.185 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000284685003 464293362 /nfs/dbraw/zinc/29/33/62/464293362.db2.gz HOYQGAMHXIBDLI-CABCVRRESA-N 1 1 349.387 2.185 20 5 EEBDMO CC[NH+](CC)[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000174167515 464371197 /nfs/dbraw/zinc/37/11/97/464371197.db2.gz XZARPRDEHMFJOO-LBPRGKRZSA-N 1 1 331.376 2.027 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000281336864 464417875 /nfs/dbraw/zinc/41/78/75/464417875.db2.gz ULFYKORLUFSXEQ-UHFFFAOYSA-N 1 1 346.387 2.384 20 5 EEBDMO C[C@@H]([NH2+]CCCN1CCCO[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285032201 464433251 /nfs/dbraw/zinc/43/32/51/464433251.db2.gz HUOSWOOBVWLCNE-ZIAGYGMSSA-N 1 1 336.436 2.329 20 5 EEBDMO C[C@@H](NCCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285032201 464433256 /nfs/dbraw/zinc/43/32/56/464433256.db2.gz HUOSWOOBVWLCNE-ZIAGYGMSSA-N 1 1 336.436 2.329 20 5 EEBDMO C[C@@H](NCCC[N@H+]1CCCO[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285032201 464433261 /nfs/dbraw/zinc/43/32/61/464433261.db2.gz HUOSWOOBVWLCNE-ZIAGYGMSSA-N 1 1 336.436 2.329 20 5 EEBDMO Cc1nn(C)c(C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000181629417 464515386 /nfs/dbraw/zinc/51/53/86/464515386.db2.gz VRNNLPOAHXRTFZ-WCQYABFASA-N 1 1 349.435 2.020 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(c3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])[C@H]2C1 ZINC000272208090 464518261 /nfs/dbraw/zinc/51/82/61/464518261.db2.gz PTRNUODGJDRUNL-PXAZEXFGSA-N 1 1 344.415 2.017 20 5 EEBDMO C[C@@H]1CC[N@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1C ZINC000245947440 464530153 /nfs/dbraw/zinc/53/01/53/464530153.db2.gz RZFNHBORBBDEAE-XUJVJEKNSA-N 1 1 331.372 2.205 20 5 EEBDMO CN(C)CC[NH+]1CCC(Nc2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000265522500 464591274 /nfs/dbraw/zinc/59/12/74/464591274.db2.gz MHOBKOAEFDSQDM-UHFFFAOYSA-N 1 1 327.816 2.081 20 5 EEBDMO CSCC[C@@H](C)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182179881 464591808 /nfs/dbraw/zinc/59/18/08/464591808.db2.gz PZCHCIDKDJUVPM-OLZOCXBDSA-N 1 1 328.434 2.408 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H](C)[C@H](CO)C1 ZINC000190861573 464735414 /nfs/dbraw/zinc/73/54/14/464735414.db2.gz XLVOCWLLTKDHPC-WZRBSPASSA-N 1 1 332.360 2.266 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C3CC3)C[C@@H](C)C2)c1 ZINC000295255431 464763406 /nfs/dbraw/zinc/76/34/06/464763406.db2.gz FNWKPIWVHHCLJO-GFCCVEGCSA-N 1 1 333.388 2.160 20 5 EEBDMO C[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)c2ccccc2C1 ZINC000176482267 464783526 /nfs/dbraw/zinc/78/35/26/464783526.db2.gz RCTCWTGDSBEFGG-UHFFFAOYSA-N 1 1 326.356 2.269 20 5 EEBDMO C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)c2ccccc2C1 ZINC000176482267 464783533 /nfs/dbraw/zinc/78/35/33/464783533.db2.gz RCTCWTGDSBEFGG-UHFFFAOYSA-N 1 1 326.356 2.269 20 5 EEBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CC[C@H](C)O ZINC000266759706 464813353 /nfs/dbraw/zinc/81/33/53/464813353.db2.gz SOSSEBXDWNARCD-VHSXEESVSA-N 1 1 329.784 2.278 20 5 EEBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CC[C@H](C)O ZINC000266759706 464813361 /nfs/dbraw/zinc/81/33/61/464813361.db2.gz SOSSEBXDWNARCD-VHSXEESVSA-N 1 1 329.784 2.278 20 5 EEBDMO C[N@H+](CCN1CCOC(C)(C)C1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000282498518 464841548 /nfs/dbraw/zinc/84/15/48/464841548.db2.gz NFRULWYUBJUUNN-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO C[N@@H+](CCN1CCOC(C)(C)C1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000282498518 464841555 /nfs/dbraw/zinc/84/15/55/464841555.db2.gz NFRULWYUBJUUNN-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000282498518 464841562 /nfs/dbraw/zinc/84/15/62/464841562.db2.gz NFRULWYUBJUUNN-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO CN(CC[N@H+]1CCOC(C)(C)C1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000282498518 464841568 /nfs/dbraw/zinc/84/15/68/464841568.db2.gz NFRULWYUBJUUNN-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO COc1cc(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)cc([N+](=O)[O-])c1C ZINC000249712589 464905676 /nfs/dbraw/zinc/90/56/76/464905676.db2.gz YZHSBIIIBLSJHZ-BXUZGUMPSA-N 1 1 335.404 2.324 20 5 EEBDMO C[C@@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000282927756 465004258 /nfs/dbraw/zinc/00/42/58/465004258.db2.gz ZRGLSVOUDAYDAC-ZDUSSCGKSA-N 1 1 334.420 2.261 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCCO1 ZINC000339824291 465534197 /nfs/dbraw/zinc/53/41/97/465534197.db2.gz FKNUUSQBHZYHBW-NVXWUHKLSA-N 1 1 338.404 2.081 20 5 EEBDMO C[C@@H]1C[N@@H+](C[C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000299277743 465679043 /nfs/dbraw/zinc/67/90/43/465679043.db2.gz ARGKPVWMDHOVOP-VBQJREDUSA-N 1 1 347.415 2.309 20 5 EEBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000299277743 465679046 /nfs/dbraw/zinc/67/90/46/465679046.db2.gz ARGKPVWMDHOVOP-VBQJREDUSA-N 1 1 347.415 2.309 20 5 EEBDMO Cn1cc([C@@H](O)C[C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)cn1 ZINC000371335466 465724427 /nfs/dbraw/zinc/72/44/27/465724427.db2.gz LFBSKENRBRUMOE-RDJZCZTQSA-N 1 1 330.388 2.416 20 5 EEBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H](N3CCOCC3)C2)cc1 ZINC000593995828 468455533 /nfs/dbraw/zinc/45/55/33/468455533.db2.gz AHQZAXSIJKDULN-KRWDZBQOSA-N 1 1 349.431 2.160 20 5 EEBDMO Cn1ccnc1[C@H](N[C@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000353498048 465932586 /nfs/dbraw/zinc/93/25/86/465932586.db2.gz RDIBCNSIHPHDEO-WMLDXEAASA-N 1 1 341.415 2.244 20 5 EEBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000346176629 465963845 /nfs/dbraw/zinc/96/38/45/465963845.db2.gz KDXZHWCYMHLWEZ-VBQJREDUSA-N 1 1 347.415 2.162 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]CC1(CO)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000353675751 466059341 /nfs/dbraw/zinc/05/93/41/466059341.db2.gz VOANQOVNGRBHLU-OAHLLOKOSA-N 1 1 330.388 2.170 20 5 EEBDMO COC(=O)c1cnc(NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000302660403 466162964 /nfs/dbraw/zinc/16/29/64/466162964.db2.gz AVYFQNQEYVMYDK-NWDGAFQWSA-N 1 1 336.392 2.309 20 5 EEBDMO CCC[N@@H+](CC)C[C@H](C)Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000357808501 466228819 /nfs/dbraw/zinc/22/88/19/466228819.db2.gz OYCOZCJPAAZFJM-NSHDSACASA-N 1 1 333.392 2.776 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@H](CCO)C3)o2)c1 ZINC000357813956 466233083 /nfs/dbraw/zinc/23/30/83/466233083.db2.gz JBWKZWBHMQPPHW-CYBMUJFWSA-N 1 1 331.372 2.497 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](N2CCCC2)C1 ZINC000363122805 466233053 /nfs/dbraw/zinc/23/30/53/466233053.db2.gz SZEQJLGOVLSSEZ-MRXNPFEDSA-N 1 1 346.431 2.402 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](N2CCCC2)C1 ZINC000363122805 466233058 /nfs/dbraw/zinc/23/30/58/466233058.db2.gz SZEQJLGOVLSSEZ-MRXNPFEDSA-N 1 1 346.431 2.402 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000331911010 466303148 /nfs/dbraw/zinc/30/31/48/466303148.db2.gz GCSGGHWYIIXBTN-INIZCTEOSA-N 1 1 330.388 2.488 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C ZINC000332051131 466362497 /nfs/dbraw/zinc/36/24/97/466362497.db2.gz NAGXOGBRMZNQCX-TZMCWYRMSA-N 1 1 330.388 2.148 20 5 EEBDMO Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000363922304 466656121 /nfs/dbraw/zinc/65/61/21/466656121.db2.gz OCYZPBPBKBHAKY-OAHLLOKOSA-N 1 1 343.387 2.073 20 5 EEBDMO Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000363922304 466656126 /nfs/dbraw/zinc/65/61/26/466656126.db2.gz OCYZPBPBKBHAKY-OAHLLOKOSA-N 1 1 343.387 2.073 20 5 EEBDMO Cn1cc(C[C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)cn1 ZINC000375712184 466868918 /nfs/dbraw/zinc/86/89/18/466868918.db2.gz RCFHVORWMVLKSL-GFCCVEGCSA-N 1 1 345.359 2.301 20 5 EEBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000411973257 466953093 /nfs/dbraw/zinc/95/30/93/466953093.db2.gz WZTNOFMIODDKLQ-MRXNPFEDSA-N 1 1 331.397 2.285 20 5 EEBDMO O=[N+]([O-])c1cccc(Cl)c1N1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000432328047 467231614 /nfs/dbraw/zinc/23/16/14/467231614.db2.gz VMSOQPWGPQUGLG-LBPRGKRZSA-N 1 1 325.796 2.407 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@H]1[C@@H](C)NCC[C@@H]1C ZINC000420380220 467386250 /nfs/dbraw/zinc/38/62/50/467386250.db2.gz YFISKGNJRAODNO-OGHNNQOOSA-N 1 1 334.420 2.208 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000449939119 467748058 /nfs/dbraw/zinc/74/80/58/467748058.db2.gz IDRHNMQJOXTJTD-JSGCOSHPSA-N 1 1 333.388 2.157 20 5 EEBDMO CC(C)OC1CC([NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000459372939 467956267 /nfs/dbraw/zinc/95/62/67/467956267.db2.gz IBGGTIDLLIIFMB-UHFFFAOYSA-N 1 1 347.415 2.309 20 5 EEBDMO CC(C)[C@@H]1CN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[N@H+]1C ZINC000487059102 468020116 /nfs/dbraw/zinc/02/01/16/468020116.db2.gz IKEBPWTYKSSRLN-AWEZNQCLSA-N 1 1 331.376 2.421 20 5 EEBDMO C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000487519584 468043034 /nfs/dbraw/zinc/04/30/34/468043034.db2.gz RULKJQSNUPYOMX-NOZJJQNGSA-N 1 1 345.321 2.428 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@@H+](C)[C@H](C(C)C)C1 ZINC000488037780 468068770 /nfs/dbraw/zinc/06/87/70/468068770.db2.gz GYVQOXVNWZJLTP-INIZCTEOSA-N 1 1 334.420 2.114 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1CN1CCC([N@H+]2CCOC[C@@H]2C)CC1 ZINC000518394776 468114826 /nfs/dbraw/zinc/11/48/26/468114826.db2.gz YUSZITYAUBCLRF-AWEZNQCLSA-N 1 1 349.431 2.289 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)C[C@H]1C ZINC000534293677 468245236 /nfs/dbraw/zinc/24/52/36/468245236.db2.gz YKPOLIZRCCPREL-CHWSQXEVSA-N 1 1 335.404 2.087 20 5 EEBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594195153 468507723 /nfs/dbraw/zinc/50/77/23/468507723.db2.gz CMDRULAZNYWQNF-HUUCEWRRSA-N 1 1 335.379 2.410 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000597603941 468613231 /nfs/dbraw/zinc/61/32/31/468613231.db2.gz GHBITEGTCGJVPZ-OAHLLOKOSA-N 1 1 344.415 2.492 20 5 EEBDMO Cc1cc(OCC(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000597920414 468711279 /nfs/dbraw/zinc/71/12/79/468711279.db2.gz BPXHVGZUKZMREH-ZDUSSCGKSA-N 1 1 335.404 2.271 20 5 EEBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000561617584 468904086 /nfs/dbraw/zinc/90/40/86/468904086.db2.gz ZQJDGKIIVSVZNR-CQSZACIVSA-N 1 1 332.404 2.335 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000561617584 468904091 /nfs/dbraw/zinc/90/40/91/468904091.db2.gz ZQJDGKIIVSVZNR-CQSZACIVSA-N 1 1 332.404 2.335 20 5 EEBDMO COC(=O)c1ccnc(N(C)CC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000598601761 468928180 /nfs/dbraw/zinc/92/81/80/468928180.db2.gz VXALPTVUCHGRHW-GFCCVEGCSA-N 1 1 336.392 2.087 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCCC[C@H]1[C@H](C)CO ZINC000595674536 468949692 /nfs/dbraw/zinc/94/96/92/468949692.db2.gz LDYOUVAVFIVRNL-CJNGLKHVSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC000562477085 468965757 /nfs/dbraw/zinc/96/57/57/468965757.db2.gz BPPYCZOYXQIDDN-DUVNUKRYSA-N 1 1 332.404 2.090 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCc1ccccc1)[C@@H]1CCOC1 ZINC000602787016 469074514 /nfs/dbraw/zinc/07/45/14/469074514.db2.gz FWUQJVMGENWWNO-QGZVFWFLSA-N 1 1 344.415 2.433 20 5 EEBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC([N@H+]3CC[C@@H](O)C3)C2)o1 ZINC000593680575 469092882 /nfs/dbraw/zinc/09/28/82/469092882.db2.gz YENWFGDYPYDEED-CQSZACIVSA-N 1 1 343.383 2.106 20 5 EEBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(c2cc[nH]c(=O)c2[N+](=O)[O-])C1 ZINC000596140976 469172761 /nfs/dbraw/zinc/17/27/61/469172761.db2.gz VRPZPKPHCVKOOG-CQSZACIVSA-N 1 1 328.372 2.406 20 5 EEBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1c(Cl)cncc1[N+](=O)[O-] ZINC000596167225 469182770 /nfs/dbraw/zinc/18/27/70/469182770.db2.gz FOHVPKIUPHLSCK-UHFFFAOYSA-N 1 1 349.778 2.349 20 5 EEBDMO CC(C)C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1 ZINC000596170239 469184356 /nfs/dbraw/zinc/18/43/56/469184356.db2.gz OQHAOOWLMNHZGZ-CYBMUJFWSA-N 1 1 334.420 2.474 20 5 EEBDMO O=C1NCCN1[C@@H]1CCC[N@@H+](CC=Cc2ccccc2[N+](=O)[O-])C1 ZINC000611262759 469212724 /nfs/dbraw/zinc/21/27/24/469212724.db2.gz XLXRBGQWBQNEHO-OMVNSRBRSA-N 1 1 330.388 2.098 20 5 EEBDMO O=C1NCCN1[C@@H]1CCC[N@H+](CC=Cc2ccccc2[N+](=O)[O-])C1 ZINC000611262759 469212733 /nfs/dbraw/zinc/21/27/33/469212733.db2.gz XLXRBGQWBQNEHO-OMVNSRBRSA-N 1 1 330.388 2.098 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2ncnc3cccc([N+](=O)[O-])c32)C1 ZINC000596307878 469239471 /nfs/dbraw/zinc/23/94/71/469239471.db2.gz PWSZYOVDYPZXCA-LBPRGKRZSA-N 1 1 329.404 3.070 20 5 EEBDMO C[C@@H]1C[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H](C)C1(F)F ZINC000599514740 469281352 /nfs/dbraw/zinc/28/13/52/469281352.db2.gz ZGGDOWUNLLPYOY-NXEZZACHSA-N 1 1 327.331 2.417 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000616118378 469373816 /nfs/dbraw/zinc/37/38/16/469373816.db2.gz KWGJMZJPEFXLDK-IUODEOHRSA-N 1 1 336.392 2.052 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1 ZINC000616118378 469373824 /nfs/dbraw/zinc/37/38/24/469373824.db2.gz KWGJMZJPEFXLDK-IUODEOHRSA-N 1 1 336.392 2.052 20 5 EEBDMO Cc1nn(C)c(N2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)c1[N+](=O)[O-] ZINC000603415908 469386987 /nfs/dbraw/zinc/38/69/87/469386987.db2.gz NXXMEMMSBKOUOJ-GJZGRUSLSA-N 1 1 327.388 2.100 20 5 EEBDMO CCn1nc(C)c([N+](=O)[O-])c1N1CCN(c2cc(C)cc[nH+]2)CC1 ZINC000619485686 469621963 /nfs/dbraw/zinc/62/19/63/469621963.db2.gz WQWSVAIUJBORBV-UHFFFAOYSA-N 1 1 330.392 2.150 20 5 EEBDMO CC[C@H]1c2ccccc2CC[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000610369681 470008450 /nfs/dbraw/zinc/00/84/50/470008450.db2.gz WBJMTHOEPFXNDK-RDJZCZTQSA-N 1 1 330.388 2.162 20 5 EEBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000610369680 470008681 /nfs/dbraw/zinc/00/86/81/470008681.db2.gz WBJMTHOEPFXNDK-NVXWUHKLSA-N 1 1 330.388 2.162 20 5 EEBDMO CCC[N@H+](CC)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000727822090 576451039 /nfs/dbraw/zinc/45/10/39/576451039.db2.gz VPVGBXNYFVANHA-INIZCTEOSA-N 1 1 334.376 2.051 20 5 EEBDMO CCC[N@@H+](CC)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000727822090 576451041 /nfs/dbraw/zinc/45/10/41/576451041.db2.gz VPVGBXNYFVANHA-INIZCTEOSA-N 1 1 334.376 2.051 20 5 EEBDMO Cn1ccnc1[C@H](O)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000769943350 577587583 /nfs/dbraw/zinc/58/75/83/577587583.db2.gz PKBAJGYUQIFGQU-CZUORRHYSA-N 1 1 348.378 2.413 20 5 EEBDMO Cn1ccnc1[C@H](O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000769943350 577587584 /nfs/dbraw/zinc/58/75/84/577587584.db2.gz PKBAJGYUQIFGQU-CZUORRHYSA-N 1 1 348.378 2.413 20 5 EEBDMO C[N@H+]1CCN(CC[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CC1(C)C ZINC000894253429 681633577 /nfs/dbraw/zinc/63/35/77/681633577.db2.gz JKQRNFNFBCOPNI-UHFFFAOYSA-N 1 1 340.855 2.364 20 5 EEBDMO C[N@@H+]1CCN(CCNCc2ccc(Cl)cc2[N+](=O)[O-])CC1(C)C ZINC000894253429 681633578 /nfs/dbraw/zinc/63/35/78/681633578.db2.gz JKQRNFNFBCOPNI-UHFFFAOYSA-N 1 1 340.855 2.364 20 5 EEBDMO C[N@H+]1CCN(CCNCc2ccc(Cl)cc2[N+](=O)[O-])CC1(C)C ZINC000894253429 681633579 /nfs/dbraw/zinc/63/35/79/681633579.db2.gz JKQRNFNFBCOPNI-UHFFFAOYSA-N 1 1 340.855 2.364 20 5 EEBDMO COc1c(O)ccc(CN2CC[C@]3(C2)CCC[N@@H+](C)C3)c1[N+](=O)[O-] ZINC000894622882 683001334 /nfs/dbraw/zinc/00/13/34/683001334.db2.gz LMKVICSFMVUFJA-QGZVFWFLSA-N 1 1 335.404 2.227 20 5 EEBDMO C[N@@H+](Cc1ccccc1)C1CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000794749775 1197929722 /nfs/dbraw/zinc/92/97/22/1197929722.db2.gz BEKGMNSRQANRDE-IBGZPJMESA-N 1 1 341.411 2.444 20 5 EEBDMO CCOC(=O)N1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000865400946 1198197950 /nfs/dbraw/zinc/19/79/50/1198197950.db2.gz FFGKRDRKHJNUPQ-UHFFFAOYSA-N 1 1 330.344 2.422 20 5 EEBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000810847320 1199778750 /nfs/dbraw/zinc/77/87/50/1199778750.db2.gz MKTKQUFDECAJHY-NEPJUHHUSA-N 1 1 334.328 2.107 20 5 EEBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000811600651 1200166442 /nfs/dbraw/zinc/16/64/42/1200166442.db2.gz KONLXYGOQNZGJK-CYBMUJFWSA-N 1 1 347.419 2.181 20 5 EEBDMO Cc1nn(C[N@@H+]2CCCN3c4ccccc4C[C@@H]3C2)cc1[N+](=O)[O-] ZINC000811782798 1200294407 /nfs/dbraw/zinc/29/44/07/1200294407.db2.gz RXFOVBIQBIJGGX-OAHLLOKOSA-N 1 1 327.388 2.194 20 5 EEBDMO Cc1nn(C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)cc1[N+](=O)[O-] ZINC000811782798 1200294414 /nfs/dbraw/zinc/29/44/14/1200294414.db2.gz RXFOVBIQBIJGGX-OAHLLOKOSA-N 1 1 327.388 2.194 20 5 EEBDMO C[C@@]([NH3+])(C(=O)N1CCc2c(F)cccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000870909572 1200945698 /nfs/dbraw/zinc/94/56/98/1200945698.db2.gz HBBDXEMQNOFBLN-SFHVURJKSA-N 1 1 343.358 2.493 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@H](CF)C1 ZINC000880293970 1201449462 /nfs/dbraw/zinc/44/94/62/1201449462.db2.gz GKVFFYGZHQYGDH-GHMZBOCLSA-N 1 1 325.340 2.222 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@H](CF)C1 ZINC000880293970 1201449464 /nfs/dbraw/zinc/44/94/64/1201449464.db2.gz GKVFFYGZHQYGDH-GHMZBOCLSA-N 1 1 325.340 2.222 20 5 EEBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2Cc2cccnc2[N+](=O)[O-])C[C@H](C)O1 ZINC000885966814 1202460254 /nfs/dbraw/zinc/46/02/54/1202460254.db2.gz DTJKKEUETMNYFD-IJEWVQPXSA-N 1 1 334.420 2.063 20 5 EEBDMO CC(C)(C)C(=O)NC[C@@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886008166 1202462742 /nfs/dbraw/zinc/46/27/42/1202462742.db2.gz HTDLYTLRKHJUCK-ZDUSSCGKSA-N 1 1 334.420 2.364 20 5 EEBDMO CC(C)(C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886008166 1202462743 /nfs/dbraw/zinc/46/27/43/1202462743.db2.gz HTDLYTLRKHJUCK-ZDUSSCGKSA-N 1 1 334.420 2.364 20 5 EEBDMO COc1cccc(C[NH+]2CCN(Cc3cccnc3[N+](=O)[O-])CC2)c1 ZINC000886308436 1202490847 /nfs/dbraw/zinc/49/08/47/1202490847.db2.gz CWZUSJBHQCUZKG-UHFFFAOYSA-N 1 1 342.399 2.316 20 5 EEBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000930369123 1206552903 /nfs/dbraw/zinc/55/29/03/1206552903.db2.gz YMZXLCVBZKCRMZ-AFAVFJNCSA-N 1 1 329.400 2.299 20 5 EEBDMO O=C(CC[N@H+]1CCn2cccc2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000932526164 1207623545 /nfs/dbraw/zinc/62/35/45/1207623545.db2.gz RCGJWYIKKHYNLH-UHFFFAOYSA-N 1 1 332.335 2.380 20 5 EEBDMO CCCNC(=O)C1CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000042674935 1208311190 /nfs/dbraw/zinc/31/11/90/1208311190.db2.gz UAYSDHCTOHTYRP-UHFFFAOYSA-N 1 1 345.403 2.140 20 5 EEBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000247074944 1213598503 /nfs/dbraw/zinc/59/85/03/1213598503.db2.gz WDJKSNUTAHGBSF-GOEBONIOSA-N 1 1 329.404 2.318 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(N[C@H]2C[C@@H](NC(=O)C[N@H+](C)C(C)C)C2)c1 ZINC001097191286 1243805621 /nfs/dbraw/zinc/80/56/21/1243805621.db2.gz FIEQCMWIBRYIQZ-OKILXGFUSA-N 1 1 334.420 2.303 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCS(=O)(=O)C(C)(C)C ZINC000850444658 1277225428 /nfs/dbraw/zinc/22/54/28/1277225428.db2.gz YUGWBEHRPUMVKD-LLVKDONJSA-N 1 1 344.433 2.467 20 5 EEBDMO COCC(C)(C)C(=O)N1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001196516028 1284104739 /nfs/dbraw/zinc/10/47/39/1284104739.db2.gz RTSXMTNZMFUPBC-UHFFFAOYSA-N 1 1 349.431 2.302 20 5 EEBDMO COCC(C)(C)C(=O)N1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001196516028 1284104743 /nfs/dbraw/zinc/10/47/43/1284104743.db2.gz RTSXMTNZMFUPBC-UHFFFAOYSA-N 1 1 349.431 2.302 20 5 EEBDMO CO[C@@H]1CC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C[C@@H]1C ZINC000853516688 1292406110 /nfs/dbraw/zinc/40/61/10/1292406110.db2.gz NTUWVXHIFAAPLD-SWLSCSKDSA-N 1 1 331.376 2.168 20 5 EEBDMO CO[C@@H]1CC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C[C@@H]1C ZINC000853516688 1292406112 /nfs/dbraw/zinc/40/61/12/1292406112.db2.gz NTUWVXHIFAAPLD-SWLSCSKDSA-N 1 1 331.376 2.168 20 5 EEBDMO O=[N+]([O-])c1cc(Br)cnc1O[C@H]1CCc2[nH+]ccn2C1 ZINC001225751271 1301145540 /nfs/dbraw/zinc/14/55/40/1301145540.db2.gz XWHNVZRSZMFUCV-VIFPVBQESA-N 1 1 339.149 2.343 20 5 EEBDMO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](Oc1[nH]c(=O)nc3ccc([N+](=O)[O-])cc31)C2 ZINC001227091747 1301682024 /nfs/dbraw/zinc/68/20/24/1301682024.db2.gz MNDPTFYSNCJSMQ-PEGIJTEDSA-N 1 1 330.344 2.248 20 5 EEBDMO O=[N+]([O-])c1cncnc1OC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC001228655345 1302362348 /nfs/dbraw/zinc/36/23/48/1302362348.db2.gz QXCHCPZSFRTJJF-HNNXBMFYSA-N 1 1 344.371 2.055 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H](Oc2n[nH]c(=O)c3cccc([N+](=O)[O-])c32)C1 ZINC001229367085 1302748842 /nfs/dbraw/zinc/74/88/42/1302748842.db2.gz HPBLEJRRECCEGL-LLVKDONJSA-N 1 1 332.360 2.495 20 5 EEBDMO C[N@@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CCCC1 ZINC000798191806 1304941992 /nfs/dbraw/zinc/94/19/92/1304941992.db2.gz MVHLYOXPVQIPTQ-KRWDZBQOSA-N 1 1 346.387 2.194 20 5 EEBDMO N[C@@H]1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC[C@H]1F ZINC001246582131 1310348846 /nfs/dbraw/zinc/34/88/46/1310348846.db2.gz FXFCYIXHRLNEAB-IAGOWNOFSA-N 1 1 336.411 2.325 20 5 EEBDMO [NH3+][C@@H](Cc1ccc(O)cc1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001247669586 1310672818 /nfs/dbraw/zinc/67/28/18/1310672818.db2.gz MSNRCPZSKHMNLO-NSHDSACASA-N 1 1 345.290 2.127 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2nnc(C)[nH]2)C1 ZINC000839660545 1315227014 /nfs/dbraw/zinc/22/70/14/1315227014.db2.gz WKNIFJHSHCDDIR-GFCCVEGCSA-N 1 1 331.376 2.410 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000840185069 1315320261 /nfs/dbraw/zinc/32/02/61/1315320261.db2.gz OAPGZSLLPCACEZ-QGZVFWFLSA-N 1 1 346.387 2.486 20 5 EEBDMO C[C@H]([NH2+]Cc1ccccc1S(C)(=O)=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000840864462 1315423804 /nfs/dbraw/zinc/42/38/04/1315423804.db2.gz CGSHZEIYUIGXKS-NSHDSACASA-N 1 1 349.412 2.431 20 5 EEBDMO COC(=O)[C@H](CC1CC1)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000840957312 1315445993 /nfs/dbraw/zinc/44/59/93/1315445993.db2.gz KWVQYCPCILZEQU-KRWDZBQOSA-N 1 1 347.415 2.495 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000842617881 1315733748 /nfs/dbraw/zinc/73/37/48/1315733748.db2.gz RIPLMOATPGBXEF-TZMCWYRMSA-N 1 1 347.371 2.351 20 5 EEBDMO Cc1cncnc1O[C@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254606119 1318142681 /nfs/dbraw/zinc/14/26/81/1318142681.db2.gz DZJCDSOXCZJPFC-SJORKVTESA-N 1 1 340.383 2.314 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CC[C@H](Oc3ncccn3)C1)C2 ZINC001254606586 1318142796 /nfs/dbraw/zinc/14/27/96/1318142796.db2.gz GRUNVOFYSKVLSS-HOTGVXAUSA-N 1 1 326.356 2.005 20 5 EEBDMO COc1nc(-n2ccc(C[NH2+]Cc3ccccc3)n2)ccc1[N+](=O)[O-] ZINC001157609937 1318744918 /nfs/dbraw/zinc/74/49/18/1318744918.db2.gz XHVAIWSHLBWTRJ-UHFFFAOYSA-N 1 1 339.355 2.474 20 5 EEBDMO O=C(NCCC[NH2+]Cc1c(Cl)cccc1Cl)[C@@H]1CC1[N+](=O)[O-] ZINC001157775594 1318852641 /nfs/dbraw/zinc/85/26/41/1318852641.db2.gz RKEFFBOARDSTQU-NOZJJQNGSA-N 1 1 346.214 2.255 20 5 EEBDMO Nc1nc(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)ccc1[N+](=O)[O-] ZINC001165082023 1321452138 /nfs/dbraw/zinc/45/21/38/1321452138.db2.gz CHYSOKTZJUJWRX-GDBMZVCRSA-N 1 1 339.399 2.283 20 5 EEBDMO CC[N@@H+](C)[C@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC001308176618 1331569176 /nfs/dbraw/zinc/56/91/76/1331569176.db2.gz MJLMJIDPUSHGFN-HNNXBMFYSA-N 1 1 334.420 2.258 20 5 EEBDMO CCN(C)[C@H]1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC001308176618 1331569181 /nfs/dbraw/zinc/56/91/81/1331569181.db2.gz MJLMJIDPUSHGFN-HNNXBMFYSA-N 1 1 334.420 2.258 20 5 EEBDMO CCN(C)[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC001308176618 1331569184 /nfs/dbraw/zinc/56/91/84/1331569184.db2.gz MJLMJIDPUSHGFN-HNNXBMFYSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@]1(CO)c1ccccc1 ZINC001308161274 1331569264 /nfs/dbraw/zinc/56/92/64/1331569264.db2.gz BHVBXPXEVSOIIM-QGZVFWFLSA-N 1 1 330.388 2.083 20 5 EEBDMO C[C@H](NC(=O)N1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1)c1cccc([N+](=O)[O-])c1 ZINC001311609406 1331776168 /nfs/dbraw/zinc/77/61/68/1331776168.db2.gz MLYUAHOWNDDVDV-QEORTHHSSA-N 1 1 332.404 2.249 20 5 EEBDMO O=[N+]([O-])c1ccccc1OCc1nnc([C@@H]2CCn3c[nH+]cc3C2)o1 ZINC001325798839 1333963208 /nfs/dbraw/zinc/96/32/08/1333963208.db2.gz UHDCMOSODOFGAY-LLVKDONJSA-N 1 1 341.327 2.483 20 5 EEBDMO O=[N+]([O-])c1ccccc1OCc1nnc([C@H]2CCn3c[nH+]cc3C2)o1 ZINC001325798841 1333963525 /nfs/dbraw/zinc/96/35/25/1333963525.db2.gz UHDCMOSODOFGAY-NSHDSACASA-N 1 1 341.327 2.483 20 5 EEBDMO C[NH+](C)Cc1nnc(-c2cc(Br)cc([N+](=O)[O-])c2)o1 ZINC001327808154 1334349073 /nfs/dbraw/zinc/34/90/73/1334349073.db2.gz KBNDBHDWLOEKMR-UHFFFAOYSA-N 1 1 327.138 2.469 20 5 EEBDMO COC[C@H]1CCCC[N@@H+](Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001609320046 1351931841 /nfs/dbraw/zinc/93/18/41/1351931841.db2.gz VFDCFYWHAJMVEI-LBPRGKRZSA-N 1 1 346.391 2.023 20 5 EEBDMO C[N@@H+]1CCC[C@H]1c1cc(C(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)n[nH]1 ZINC001353626417 1338307188 /nfs/dbraw/zinc/30/71/88/1338307188.db2.gz OOXWCMYOHLZTBI-INIZCTEOSA-N 1 1 341.371 2.241 20 5 EEBDMO C[N@H+]1CCC[C@H]1c1cc(C(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)n[nH]1 ZINC001353626417 1338307192 /nfs/dbraw/zinc/30/71/92/1338307192.db2.gz OOXWCMYOHLZTBI-INIZCTEOSA-N 1 1 341.371 2.241 20 5 EEBDMO CC1(C)CCC[N@@H+](CCNc2ccc([N+](=O)[O-])c(-c3nn[nH]n3)c2)C1 ZINC001590096378 1349153162 /nfs/dbraw/zinc/15/31/62/1349153162.db2.gz HAHGFCOLBKTCRE-UHFFFAOYSA-N 1 1 345.407 2.309 20 5 EEBDMO C[C@@H]([NH2+]Cc1cc(-c2nn[nH]n2)ccn1)c1ccccc1[N+](=O)[O-] ZINC001591730374 1349536457 /nfs/dbraw/zinc/53/64/57/1349536457.db2.gz JUCHNZRXXJZPEI-SNVBAGLBSA-N 1 1 325.332 2.021 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H]2C[C@@H]([NH3+])C[C@]2(C(=O)[O-])C1 ZINC001600488514 1350063756 /nfs/dbraw/zinc/06/37/56/1350063756.db2.gz UOIOWYXNIRCVMX-JRATXPSKSA-N 1 1 333.388 2.088 20 5 EEBDMO C[C@@H](CNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC001603893744 1350796744 /nfs/dbraw/zinc/79/67/44/1350796744.db2.gz AMVSXJJSFJGPIN-RYUDHWBXSA-N 1 1 345.407 2.450 20 5 EEBDMO C[C@]1(CO)C[C@@H](O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000888091500 1371272960 /nfs/dbraw/zinc/27/29/60/1371272960.db2.gz JVFVLWFLNQALDD-RHSMWYFYSA-N 1 1 332.356 2.172 20 5 EEBDMO CC1([C@H]2CCC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)OCCO1 ZINC000784570251 1371419680 /nfs/dbraw/zinc/41/96/80/1371419680.db2.gz DBWJWCQSOVXLFE-GOEBONIOSA-N 1 1 336.388 2.103 20 5 EEBDMO O=C(NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)c1cc(Cl)c[nH]1 ZINC001031543202 769507183 /nfs/dbraw/zinc/50/71/83/769507183.db2.gz YWELKWCWCFCRRA-UHFFFAOYSA-N 1 1 348.790 2.438 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCC1=CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC001127683826 778761018 /nfs/dbraw/zinc/76/10/18/778761018.db2.gz BDPYIEVEWISEQK-UHFFFAOYSA-N 1 1 346.431 2.189 20 5 EEBDMO Cn1cc([C@H]2C[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC2(C)C)cn1 ZINC000846933179 790737107 /nfs/dbraw/zinc/73/71/07/790737107.db2.gz WDCUIAAAMYHGCW-IAGOWNOFSA-N 1 1 344.415 2.487 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NC/C=C\CNc1ccc(F)cc1[N+](=O)[O-] ZINC001107279713 786698321 /nfs/dbraw/zinc/69/83/21/786698321.db2.gz AYYJYOSGXVTBCY-PLNGDYQASA-N 1 1 338.383 2.160 20 5 EEBDMO CC(C)(CCC(=O)N1CC2(CC[N@@H+]2Cc2ccccc2)C1)[N+](=O)[O-] ZINC000910778132 787040483 /nfs/dbraw/zinc/04/04/83/787040483.db2.gz SZAQTFFBTPBKBK-UHFFFAOYSA-N 1 1 331.416 2.309 20 5 EEBDMO CC(C)(CCC(=O)N1CC2(CC[N@H+]2Cc2ccccc2)C1)[N+](=O)[O-] ZINC000910778132 787040490 /nfs/dbraw/zinc/04/04/90/787040490.db2.gz SZAQTFFBTPBKBK-UHFFFAOYSA-N 1 1 331.416 2.309 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NC/C=C/CNc1nc(C)ccc1[N+](=O)[O-] ZINC001107391654 787105962 /nfs/dbraw/zinc/10/59/62/787105962.db2.gz LACZFUYRCHCKCB-BQYQJAHWSA-N 1 1 349.435 2.113 20 5 EEBDMO CC1(C)CC[N@@H+](CC(=O)NC/C=C/CNc2ccccc2[N+](=O)[O-])C1 ZINC001107514283 787486497 /nfs/dbraw/zinc/48/64/97/787486497.db2.gz ZVRUWWZNNHANKQ-AATRIKPKSA-N 1 1 346.431 2.411 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Nc3ccc(N)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000823974132 788004759 /nfs/dbraw/zinc/00/47/59/788004759.db2.gz PRHKUJBCDKQQRR-BXUZGUMPSA-N 1 1 333.392 2.125 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CCC([NH+]2CCOCC2)CC1 ZINC000824608427 788240750 /nfs/dbraw/zinc/24/07/50/788240750.db2.gz XWBAIKLIEQKZAS-UHFFFAOYSA-N 1 1 347.415 2.148 20 5 EEBDMO C[N@@H+](CC(=O)NCCCNc1ccc(F)cc1[N+](=O)[O-])C1CCC1 ZINC001094853455 796781837 /nfs/dbraw/zinc/78/18/37/796781837.db2.gz NEILGEUAVSUHPL-UHFFFAOYSA-N 1 1 338.383 2.136 20 5 EEBDMO COC(=O)C[C@H]1COCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921767 797152153 /nfs/dbraw/zinc/15/21/53/797152153.db2.gz SKUAAOCYWRNKFW-WBVHZDCISA-N 1 1 348.399 2.106 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCc3ncn(C)c3C2)c1F ZINC001173191071 797280939 /nfs/dbraw/zinc/28/09/39/797280939.db2.gz ABYHITVPQAMXGX-LLVKDONJSA-N 1 1 348.378 2.465 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCc3ncn(C)c3C2)c1F ZINC001173191071 797280947 /nfs/dbraw/zinc/28/09/47/797280947.db2.gz ABYHITVPQAMXGX-LLVKDONJSA-N 1 1 348.378 2.465 20 5 EEBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]2[C@@H](CCC(=O)N2C)C1 ZINC001173237164 797321419 /nfs/dbraw/zinc/32/14/19/797321419.db2.gz INUSATZKKXLXTL-KMFMINBZSA-N 1 1 331.416 2.469 20 5 EEBDMO Cc1cc(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)s1 ZINC001086084631 802116352 /nfs/dbraw/zinc/11/63/52/802116352.db2.gz ZGKDGLOTZDQTME-FAAHXZRKSA-N 1 1 337.445 2.015 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790912080 808995144 /nfs/dbraw/zinc/99/51/44/808995144.db2.gz NGWUSXFBIPPGSW-NXEZZACHSA-N 1 1 343.786 2.481 20 5 EEBDMO COc1ccc(C[C@H](C)[N@@H+]2CCCC3(C2)OCCO3)c([N+](=O)[O-])c1 ZINC001170353086 809902181 /nfs/dbraw/zinc/90/21/81/809902181.db2.gz VMOKVAZPCQGLIA-ZDUSSCGKSA-N 1 1 336.388 2.373 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CCCC3(C2)OCCO3)c([N+](=O)[O-])c1 ZINC001170353086 809902184 /nfs/dbraw/zinc/90/21/84/809902184.db2.gz VMOKVAZPCQGLIA-ZDUSSCGKSA-N 1 1 336.388 2.373 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@H+]2CCc3nn(C)cc3C2)c([N+](=O)[O-])c1 ZINC001170344573 809916394 /nfs/dbraw/zinc/91/63/94/809916394.db2.gz CGTONONXIQBPNQ-GFCCVEGCSA-N 1 1 330.388 2.326 20 5 EEBDMO O=C(CC[N@@H+]1CCCC[C@@H]1CCO)Nc1cc([N+](=O)[O-])ccc1F ZINC000181683259 234284526 /nfs/dbraw/zinc/28/45/26/234284526.db2.gz GBPSFAWTDFZTHT-GFCCVEGCSA-N 1 1 339.367 2.299 20 5 EEBDMO CC[C@H]1C[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)CCO1 ZINC000027117257 202153119 /nfs/dbraw/zinc/15/31/19/202153119.db2.gz QVQJLASWIMVSEO-ZDUSSCGKSA-N 1 1 337.376 2.043 20 5 EEBDMO CC[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)CCO1 ZINC000027117257 202153121 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CCCc1[nH]nc(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1[N+](=O)[O-] ZINC000074321511 462585323 /nfs/dbraw/zinc/58/53/23/462585323.db2.gz QOQMGAFEOIVBGP-CYBMUJFWSA-N 1 1 349.435 2.074 20 5 EEBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000153433764 462650055 /nfs/dbraw/zinc/65/00/55/462650055.db2.gz OQWPVKDGIBFKJG-ZDUSSCGKSA-N 1 1 340.383 2.357 20 5 EEBDMO CC1(C)CN(c2nccc3c2cccc3[N+](=O)[O-])CC[N@H+]1CCO ZINC000590698686 468311140 /nfs/dbraw/zinc/31/11/40/468311140.db2.gz PHRQBUIDXFLQHR-UHFFFAOYSA-N 1 1 330.388 2.036 20 5 EEBDMO CC(C)[C@H](CNc1ncc(Cl)cc1[N+](=O)[O-])N1CC[NH+](C)CC1 ZINC000129771958 462723960 /nfs/dbraw/zinc/72/39/60/462723960.db2.gz UNSUEUJMKIUGKE-AWEZNQCLSA-N 1 1 341.843 2.327 20 5 EEBDMO CC(=O)NC1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000089891299 462734860 /nfs/dbraw/zinc/73/48/60/462734860.db2.gz BMJYZFOBGCDDQX-UHFFFAOYSA-N 1 1 344.371 2.350 20 5 EEBDMO C[C@@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC000065867131 462835301 /nfs/dbraw/zinc/83/53/01/462835301.db2.gz XLYHLMFAUNPEHZ-KGLIPLIRSA-N 1 1 334.420 2.386 20 5 EEBDMO COc1ccc(C[N@H+]2CCC[C@H](Cn3ccnn3)C2)cc1[N+](=O)[O-] ZINC000119194183 462880640 /nfs/dbraw/zinc/88/06/40/462880640.db2.gz UMGFMDZZDXWBHF-AWEZNQCLSA-N 1 1 331.376 2.107 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000067283432 462988201 /nfs/dbraw/zinc/98/82/01/462988201.db2.gz YCAOSMGSIZZHND-CYBMUJFWSA-N 1 1 330.388 2.136 20 5 EEBDMO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)CN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000120897494 463052219 /nfs/dbraw/zinc/05/22/19/463052219.db2.gz NZQNIVADCCNIHS-ZBFHGGJFSA-N 1 1 334.464 2.437 20 5 EEBDMO C[C@@H]1COC[C@H](C)[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000120901825 463053439 /nfs/dbraw/zinc/05/34/39/463053439.db2.gz PRVUBQNBCMWWEJ-TXEJJXNPSA-N 1 1 335.360 2.002 20 5 EEBDMO C[C@@H]1COC[C@H](C)[N@@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000120901825 463053443 /nfs/dbraw/zinc/05/34/43/463053443.db2.gz PRVUBQNBCMWWEJ-TXEJJXNPSA-N 1 1 335.360 2.002 20 5 EEBDMO COc1ccc(CC(=O)NC[C@@H](c2ccco2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000069365939 463235981 /nfs/dbraw/zinc/23/59/81/463235981.db2.gz KAUCMSWFZBHCOL-AWEZNQCLSA-N 1 1 347.371 2.158 20 5 EEBDMO CCC(CC)[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000029208128 463247569 /nfs/dbraw/zinc/24/75/69/463247569.db2.gz KRDGEEJFFYFRCZ-KRWDZBQOSA-N 1 1 349.431 2.462 20 5 EEBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 ZINC000122411740 463261989 /nfs/dbraw/zinc/26/19/89/463261989.db2.gz AQWZKHSBTDQAEA-KBPBESRZSA-N 1 1 349.435 2.055 20 5 EEBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000080474288 463322026 /nfs/dbraw/zinc/32/20/26/463322026.db2.gz VCHHZVMRXVVAAU-INIZCTEOSA-N 1 1 331.416 2.328 20 5 EEBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000124186628 463397129 /nfs/dbraw/zinc/39/71/29/463397129.db2.gz LYTDLCROEOFKSC-HNNXBMFYSA-N 1 1 348.447 2.491 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC000081364767 463424925 /nfs/dbraw/zinc/42/49/25/463424925.db2.gz XFZYWONIMQIXAF-HNNXBMFYSA-N 1 1 348.447 2.221 20 5 EEBDMO C[C@H](CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000057719918 463513681 /nfs/dbraw/zinc/51/36/81/463513681.db2.gz PQMDQVOYXIVCEO-CYBMUJFWSA-N 1 1 346.431 2.408 20 5 EEBDMO Cc1nn(C)c(C(=O)NCCCC[N@@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000126461986 463637889 /nfs/dbraw/zinc/63/78/89/463637889.db2.gz XZOFDXKLVSVGRK-GFCCVEGCSA-N 1 1 337.424 2.021 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000177793363 463792683 /nfs/dbraw/zinc/79/26/83/463792683.db2.gz ZAKIUOCMCUUBEQ-HIFRSBDPSA-N 1 1 333.388 2.059 20 5 EEBDMO CN(C[C@H]1CCC[N@@H+](C)C1)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000287233606 463842310 /nfs/dbraw/zinc/84/23/10/463842310.db2.gz JLQRUTXHJQUOKE-NSHDSACASA-N 1 1 331.376 2.022 20 5 EEBDMO CCOC(=O)CC[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000178558189 463921024 /nfs/dbraw/zinc/92/10/24/463921024.db2.gz ZLGCHFFRLIGIIM-UHFFFAOYSA-N 1 1 337.376 2.117 20 5 EEBDMO Nc1ccc(NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000283609793 463942679 /nfs/dbraw/zinc/94/26/79/463942679.db2.gz RPOPENNCVSCNAA-MRXNPFEDSA-N 1 1 342.399 2.008 20 5 EEBDMO O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+]2CCCC[C@H]2C1 ZINC000195095419 463990248 /nfs/dbraw/zinc/99/02/48/463990248.db2.gz SLFDEXFXCPOSQH-AWEZNQCLSA-N 1 1 335.429 2.384 20 5 EEBDMO O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000195095419 463990253 /nfs/dbraw/zinc/99/02/53/463990253.db2.gz SLFDEXFXCPOSQH-AWEZNQCLSA-N 1 1 335.429 2.384 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000198354978 464088629 /nfs/dbraw/zinc/08/86/29/464088629.db2.gz GKMHDRFFMUGVME-CYBMUJFWSA-N 1 1 333.344 2.229 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@H]1CCC[C@H]1O ZINC000270117191 464191881 /nfs/dbraw/zinc/19/18/81/464191881.db2.gz NFPIXXGAMMTBSB-QMTHXVAHSA-N 1 1 341.795 2.280 20 5 EEBDMO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@H]1CCC[C@H]1O ZINC000270117191 464191882 /nfs/dbraw/zinc/19/18/82/464191882.db2.gz NFPIXXGAMMTBSB-QMTHXVAHSA-N 1 1 341.795 2.280 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](CO)C1 ZINC000263850596 464215013 /nfs/dbraw/zinc/21/50/13/464215013.db2.gz GMYISJQXRGXGRO-NEPJUHHUSA-N 1 1 332.360 2.410 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000173923649 464332153 /nfs/dbraw/zinc/33/21/53/464332153.db2.gz DNTTYVRVMKYHDR-ZDUSSCGKSA-N 1 1 345.403 2.418 20 5 EEBDMO CSc1ccc([C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000294230817 464439655 /nfs/dbraw/zinc/43/96/55/464439655.db2.gz AQONBOGYFGQAFK-LBPRGKRZSA-N 1 1 349.416 2.073 20 5 EEBDMO CC(C)[C@@H](CO)[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1 ZINC000174865863 464459465 /nfs/dbraw/zinc/45/94/65/464459465.db2.gz YWFOYYXCYIPZIK-QGZVFWFLSA-N 1 1 332.404 2.310 20 5 EEBDMO C[C@@H]1CC[N@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1C ZINC000245947426 464529839 /nfs/dbraw/zinc/52/98/39/464529839.db2.gz RZFNHBORBBDEAE-JMSVASOKSA-N 1 1 331.372 2.205 20 5 EEBDMO CSCC[C@H](C)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182179864 464591106 /nfs/dbraw/zinc/59/11/06/464591106.db2.gz PZCHCIDKDJUVPM-STQMWFEESA-N 1 1 328.434 2.408 20 5 EEBDMO CN(CC[NH+]1CCCCC1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000593884970 468419587 /nfs/dbraw/zinc/41/95/87/468419587.db2.gz YTXGPHQIMPLACU-UHFFFAOYSA-N 1 1 331.376 2.029 20 5 EEBDMO CC[N@H+]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000286319494 464879135 /nfs/dbraw/zinc/87/91/35/464879135.db2.gz DGDCWTOCTMOODI-LBPRGKRZSA-N 1 1 331.376 2.171 20 5 EEBDMO CCCn1cc[nH+]c1CCCN(C)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000192235760 464891644 /nfs/dbraw/zinc/89/16/44/464891644.db2.gz WFRSWYKFXXUAET-UHFFFAOYSA-N 1 1 345.403 2.369 20 5 EEBDMO COc1cccc(C(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000192739795 464988661 /nfs/dbraw/zinc/98/86/61/464988661.db2.gz BPCCPLBKFMEUBZ-ZDUSSCGKSA-N 1 1 335.404 2.311 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C[C@@H]1C ZINC000342483236 465324924 /nfs/dbraw/zinc/32/49/24/465324924.db2.gz YTUVEQVEBHFBPC-QWRGUYRKSA-N 1 1 331.376 2.163 20 5 EEBDMO CCOC(=O)c1ccnc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-] ZINC000348164380 465460905 /nfs/dbraw/zinc/46/09/05/465460905.db2.gz SRSYZCHMYKNBKE-OLZOCXBDSA-N 1 1 334.376 2.205 20 5 EEBDMO Cc1cc(N2C[C@@H]3[C@H](C2)OCC[N@@H+]3C)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000359967841 465512647 /nfs/dbraw/zinc/51/26/47/465512647.db2.gz ZYAUGTDFYDVYLW-KGLIPLIRSA-N 1 1 345.321 2.441 20 5 EEBDMO CC(C)[N@H+](C)C[C@H](C)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000356754557 465521946 /nfs/dbraw/zinc/52/19/46/465521946.db2.gz YPXCHSNCHJRFGH-ZDUSSCGKSA-N 1 1 345.403 2.239 20 5 EEBDMO CCN1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H]1c1ncc[nH]1 ZINC000348408253 465586673 /nfs/dbraw/zinc/58/66/73/465586673.db2.gz MCWWLBFLRIVGEB-INIZCTEOSA-N 1 1 345.403 2.076 20 5 EEBDMO CCN1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H]1c1ncc[nH]1 ZINC000348408253 465586682 /nfs/dbraw/zinc/58/66/82/465586682.db2.gz MCWWLBFLRIVGEB-INIZCTEOSA-N 1 1 345.403 2.076 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000299106498 465606272 /nfs/dbraw/zinc/60/62/72/465606272.db2.gz VWHMCGQEHKWCBA-KBPBESRZSA-N 1 1 335.404 2.210 20 5 EEBDMO Cn1c(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000348787831 465792896 /nfs/dbraw/zinc/79/28/96/465792896.db2.gz SYSVVAPEPUZGTB-OAHLLOKOSA-N 1 1 342.399 2.185 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000371546030 465867959 /nfs/dbraw/zinc/86/79/59/465867959.db2.gz XVVMEPQSFQRXMV-GXTWGEPZSA-N 1 1 339.342 2.430 20 5 EEBDMO Cc1ccc(S(=O)(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000331026937 465903186 /nfs/dbraw/zinc/90/31/86/465903186.db2.gz BWPBFDPOEMMYIW-CYBMUJFWSA-N 1 1 341.433 2.054 20 5 EEBDMO C[C@@H]1C[C@H](N[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000353523866 465952164 /nfs/dbraw/zinc/95/21/64/465952164.db2.gz CIDQFVBLCCZPNH-UNEWFSDZSA-N 1 1 343.431 2.490 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H](C)c1ccon1 ZINC000349245517 466034330 /nfs/dbraw/zinc/03/43/30/466034330.db2.gz RRIIDNMOAWRTAN-JTQLQIEISA-N 1 1 334.332 2.271 20 5 EEBDMO COc1cccc(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000346258671 466036486 /nfs/dbraw/zinc/03/64/86/466036486.db2.gz IQOHHUKRDYWKMP-KCQAQPDRSA-N 1 1 347.415 2.406 20 5 EEBDMO O=C([C@@H]1CCC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1)N1CCCC1 ZINC000331374781 466054792 /nfs/dbraw/zinc/05/47/92/466054792.db2.gz KIAABOKMNMZPAD-OAHLLOKOSA-N 1 1 347.415 2.308 20 5 EEBDMO C[N@H+]1CCO[C@H]2CN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)C[C@H]21 ZINC000301902482 466057287 /nfs/dbraw/zinc/05/72/87/466057287.db2.gz ODILAEYPWBLVJR-ZBFHGGJFSA-N 1 1 335.404 2.291 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]C[C@H]1CC[C@H](O)C1)c1ccc([N+](=O)[O-])cc1 ZINC000353692625 466073387 /nfs/dbraw/zinc/07/33/87/466073387.db2.gz WDHZABQNLZAJMY-VBNZEHGJSA-N 1 1 330.388 2.168 20 5 EEBDMO C[C@@H](CNC(=O)CN(C)c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC000361534243 466082842 /nfs/dbraw/zinc/08/28/42/466082842.db2.gz WSACCULKAZYDQY-CABCVRRESA-N 1 1 348.447 2.410 20 5 EEBDMO CCOc1cc(N2CC[N@@H+](CC(C)(C)O)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000302534324 466151646 /nfs/dbraw/zinc/15/16/46/466151646.db2.gz MDBIEJVPERQPRA-ZDUSSCGKSA-N 1 1 337.420 2.275 20 5 EEBDMO C[C@H](O)[C@H]1CCCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000304241682 466266537 /nfs/dbraw/zinc/26/65/37/466266537.db2.gz SKTBMLIWQSDQQS-GXTWGEPZSA-N 1 1 349.387 2.128 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@H+](CCO)[C@H]2CCCc3ccccc32)c1 ZINC000304553618 466306392 /nfs/dbraw/zinc/30/63/92/466306392.db2.gz VXPLFQVFVKFRAY-KRWDZBQOSA-N 1 1 330.388 2.163 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](n2cccn2)C1 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XKNDHDGBDUBGPW-GFCCVEGCSA-N 1 1 342.359 2.314 20 5 EEBDMO CCC[N@H+]1CC[C@@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000598343021 468837964 /nfs/dbraw/zinc/83/79/64/468837964.db2.gz PGVMGFFZVXHJAB-OAHLLOKOSA-N 1 1 334.420 2.387 20 5 EEBDMO CC[N@@H+]1CCCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)[C@H](C)C1 ZINC000601439643 468874980 /nfs/dbraw/zinc/87/49/80/468874980.db2.gz HQVGPCPQASCYHA-SNVBAGLBSA-N 1 1 347.462 2.070 20 5 EEBDMO CC[N@H+]1CCCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)[C@H](C)C1 ZINC000601439643 468874983 /nfs/dbraw/zinc/87/49/83/468874983.db2.gz HQVGPCPQASCYHA-SNVBAGLBSA-N 1 1 347.462 2.070 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H](C)[C@@H]1CCO ZINC000595706953 468963546 /nfs/dbraw/zinc/96/35/46/468963546.db2.gz ZOWFLAHAXGMLBM-BBRMVZONSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCCO)[C@H]1CCc2ccccc21 ZINC000602775901 469066209 /nfs/dbraw/zinc/06/62/09/469066209.db2.gz CUIXQBPMQYPGCV-KRWDZBQOSA-N 1 1 344.415 2.472 20 5 EEBDMO 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336.348 2.256 20 5 EEBDMO CCC[N@H+]1CC[C@@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000856072449 1293397185 /nfs/dbraw/zinc/39/71/85/1293397185.db2.gz AIOAQGMDTJTLTJ-GFCCVEGCSA-N 1 1 327.331 2.287 20 5 EEBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@H]1C[C@@H](O)C1 ZINC000859967967 1294729851 /nfs/dbraw/zinc/72/98/51/1294729851.db2.gz QPLTXPGTGDGOQS-JBLDHEPKSA-N 1 1 341.795 2.278 20 5 EEBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](OCc3ccccc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001222761320 1299835860 /nfs/dbraw/zinc/83/58/60/1299835860.db2.gz MXWUQJXJAAFTOA-XJNFMUPTSA-N 1 1 334.372 2.278 20 5 EEBDMO COC(=O)Cc1ccc(O[C@@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c([N+](=O)[O-])c1 ZINC001226215970 1301303674 /nfs/dbraw/zinc/30/36/74/1301303674.db2.gz FWKAXCKZQZVYIE-ZSBFGKGUSA-N 1 1 348.399 2.419 20 5 EEBDMO COC(=O)c1cc(O[C@H]2CCC[N@@H+](C)CC2)c(OC)cc1[N+](=O)[O-] ZINC001226440827 1301413357 /nfs/dbraw/zinc/41/33/57/1301413357.db2.gz GGWVBGBJKLEDTH-NSHDSACASA-N 1 1 338.360 2.253 20 5 EEBDMO CC[N@H+]1CC[C@H](Oc2ccc3c(c2)oc2cc(=O)ccc-2[n+]3[O-])C1 ZINC001227448053 1301832546 /nfs/dbraw/zinc/83/25/46/1301832546.db2.gz AARKPDYRNIBFCO-AWEZNQCLSA-N 1 1 326.352 2.004 20 5 EEBDMO C[N@H+]1CC[C@@H](Oc2ccccc2C(=O)Nc2ncc([N+](=O)[O-])s2)C1 ZINC001227515388 1301860928 /nfs/dbraw/zinc/86/09/28/1301860928.db2.gz ITMMJJFXFFISGW-SNVBAGLBSA-N 1 1 348.384 2.387 20 5 EEBDMO O=[N+]([O-])c1ncc(Br)cc1O[C@@H]1CCc2[nH+]ccn2C1 ZINC001229559379 1302855699 /nfs/dbraw/zinc/85/56/99/1302855699.db2.gz FIKIDUCEENATOQ-SECBINFHSA-N 1 1 339.149 2.343 20 5 EEBDMO CN(C(=O)C[N@@H+]1CC[C@@H](c2ccccn2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000799190121 1305180575 /nfs/dbraw/zinc/18/05/75/1305180575.db2.gz KKPSJJDLJCWPGT-CQSZACIVSA-N 1 1 340.383 2.442 20 5 EEBDMO CN(C(=O)C[N@H+]1CC[C@@H](c2ccccn2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000799190121 1305180578 /nfs/dbraw/zinc/18/05/78/1305180578.db2.gz KKPSJJDLJCWPGT-CQSZACIVSA-N 1 1 340.383 2.442 20 5 EEBDMO CC(C)[C@]1(CO)CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC001117682120 1306143182 /nfs/dbraw/zinc/14/31/82/1306143182.db2.gz ATOZEPGTNZQSTI-QGZVFWFLSA-N 1 1 336.388 2.206 20 5 EEBDMO CC1CC[NH+]([C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])c2ccccc2)CC1 ZINC000839568988 1315216147 /nfs/dbraw/zinc/21/61/47/1315216147.db2.gz PUCYTOGAFJLKQA-ZACQAIPSSA-N 1 1 331.416 2.241 20 5 EEBDMO C[C@@H]1[C@@H](CO)CCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000839668615 1315228759 /nfs/dbraw/zinc/22/87/59/1315228759.db2.gz DEBAEYVOHFRXGV-GHMZBOCLSA-N 1 1 341.795 2.280 20 5 EEBDMO C[C@@H]1[C@@H](CO)CCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000839668615 1315228762 /nfs/dbraw/zinc/22/87/62/1315228762.db2.gz DEBAEYVOHFRXGV-GHMZBOCLSA-N 1 1 341.795 2.280 20 5 EEBDMO CC(C)(C)[C@@H](C[NH3+])NCCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000842475369 1315712305 /nfs/dbraw/zinc/71/23/05/1315712305.db2.gz OKCXICDQSIXZFZ-CYBMUJFWSA-N 1 1 326.372 2.026 20 5 EEBDMO COc1cc(N2CC[N@@H+]3CCc4ccccc4[C@H]3C2)ncc1[N+](=O)[O-] ZINC001155089248 1317451295 /nfs/dbraw/zinc/45/12/95/1317451295.db2.gz CCHPNSAEPIIRKX-MRXNPFEDSA-N 1 1 340.383 2.418 20 5 EEBDMO COc1cc(N2CC[N@H+]3CCc4ccccc4[C@H]3C2)ncc1[N+](=O)[O-] ZINC001155089248 1317451299 /nfs/dbraw/zinc/45/12/99/1317451299.db2.gz CCHPNSAEPIIRKX-MRXNPFEDSA-N 1 1 340.383 2.418 20 5 EEBDMO COC(=O)[C@]1(C)CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254482985 1318085076 /nfs/dbraw/zinc/08/50/76/1318085076.db2.gz NYCIIZHZSYXZSQ-GOSISDBHSA-N 1 1 347.415 2.449 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCN(c3ncccc3F)CC1)C2 ZINC001254605735 1318141893 /nfs/dbraw/zinc/14/18/93/1318141893.db2.gz DDDWSPCIZUJCHO-INIZCTEOSA-N 1 1 342.374 2.418 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CC[C@@H](Oc3ncc(F)cn3)C1)C2 ZINC001254610292 1318144222 /nfs/dbraw/zinc/14/42/22/1318144222.db2.gz JHYMWHSBDNGTFE-HZPDHXFCSA-N 1 1 344.346 2.144 20 5 EEBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2nccc(C)c2[N+](=O)[O-])CC1 ZINC001165107609 1321455476 /nfs/dbraw/zinc/45/54/76/1321455476.db2.gz JNFKBPVSFPCIQY-OAHLLOKOSA-N 1 1 334.420 2.378 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCCC2(CC[NH2+]CC2)C1 ZINC001261492502 1322114399 /nfs/dbraw/zinc/11/43/99/1322114399.db2.gz HUXOYQQDXBRWQN-UHFFFAOYSA-N 1 1 346.431 2.307 20 5 EEBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CC1=NOCC1)[C@H]1CC[C@H](O)CC1 ZINC001307875425 1331553846 /nfs/dbraw/zinc/55/38/46/1331553846.db2.gz MFZOZBDVXSGYBN-WKILWMFISA-N 1 1 333.388 2.477 20 5 EEBDMO O=[N+]([O-])c1ccccc1C[N@H+](CC1=NOCC1)[C@H]1CC[C@H](O)CC1 ZINC001307875425 1331553848 /nfs/dbraw/zinc/55/38/48/1331553848.db2.gz MFZOZBDVXSGYBN-WKILWMFISA-N 1 1 333.388 2.477 20 5 EEBDMO Cc1nccnc1[C@@H](C)[NH2+][C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC001308054406 1331561537 /nfs/dbraw/zinc/56/15/37/1331561537.db2.gz IDNXVLGEABDZTN-IUODEOHRSA-N 1 1 341.371 2.149 20 5 EEBDMO CC[N@@H+](C)[C@@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC001308176619 1331569615 /nfs/dbraw/zinc/56/96/15/1331569615.db2.gz MJLMJIDPUSHGFN-OAHLLOKOSA-N 1 1 334.420 2.258 20 5 EEBDMO CCN(C)[C@@H]1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC001308176619 1331569617 /nfs/dbraw/zinc/56/96/17/1331569617.db2.gz MJLMJIDPUSHGFN-OAHLLOKOSA-N 1 1 334.420 2.258 20 5 EEBDMO CCN(C)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC001308176619 1331569623 /nfs/dbraw/zinc/56/96/23/1331569623.db2.gz MJLMJIDPUSHGFN-OAHLLOKOSA-N 1 1 334.420 2.258 20 5 EEBDMO COc1c(O)ccc(C[NH2+]Cc2ccc3oc(=O)[nH]c3c2)c1[N+](=O)[O-] ZINC001308931520 1331609582 /nfs/dbraw/zinc/60/95/82/1331609582.db2.gz SSHRIERINOFBLA-UHFFFAOYSA-N 1 1 345.311 2.446 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)nc1-c1ccccn1 ZINC001330042654 1334767229 /nfs/dbraw/zinc/76/72/29/1334767229.db2.gz NDOJFROBSFVJEV-CJNGLKHVSA-N 1 1 343.387 2.312 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)nc1-c1ccccn1 ZINC001330042654 1334767230 /nfs/dbraw/zinc/76/72/30/1334767230.db2.gz NDOJFROBSFVJEV-CJNGLKHVSA-N 1 1 343.387 2.312 20 5 EEBDMO Cc1cc(NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)cc(C)[nH+]1 ZINC001330888272 1334921584 /nfs/dbraw/zinc/92/15/84/1334921584.db2.gz RUXOQVZTJSCYFZ-UHFFFAOYSA-N 1 1 332.335 2.486 20 5 EEBDMO C[N@H+]1CCCC[C@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC001336744790 1336589054 /nfs/dbraw/zinc/58/90/54/1336589054.db2.gz JNIIJFXSJKVTQV-HNNXBMFYSA-N 1 1 330.388 2.150 20 5 EEBDMO O=C(CC[NH+]1CCOCC1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001344507691 1337398730 /nfs/dbraw/zinc/39/87/30/1337398730.db2.gz WNZULLFFSBCYOJ-INIZCTEOSA-N 1 1 347.415 2.023 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000848583945 1338725511 /nfs/dbraw/zinc/72/55/11/1338725511.db2.gz JOQBTRFYWSINBH-QWRGUYRKSA-N 1 1 343.330 2.165 20 5 EEBDMO Cc1ccoc1C[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001592282161 1349616373 /nfs/dbraw/zinc/61/63/73/1349616373.db2.gz OQCQFOYJXAVGAZ-UHFFFAOYSA-N 1 1 328.332 2.308 20 5 EEBDMO Cc1ccoc1C[N@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001592282161 1349616374 /nfs/dbraw/zinc/61/63/74/1349616374.db2.gz OQCQFOYJXAVGAZ-UHFFFAOYSA-N 1 1 328.332 2.308 20 5 EEBDMO CC1(C)C[N@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])C(C)(C)CO1 ZINC001603785490 1350767431 /nfs/dbraw/zinc/76/74/31/1350767431.db2.gz BPPVQMBROOHGEU-UHFFFAOYSA-N 1 1 346.391 2.164 20 5 EEBDMO CC1(C)C[N@@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])C(C)(C)CO1 ZINC001603785490 1350767436 /nfs/dbraw/zinc/76/74/36/1350767436.db2.gz BPPVQMBROOHGEU-UHFFFAOYSA-N 1 1 346.391 2.164 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000850433627 1367142757 /nfs/dbraw/zinc/14/27/57/1367142757.db2.gz OXNMDFVLIIVVIM-QEJZJMRPSA-N 1 1 335.404 2.117 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)N1CCC(C)(Nc2ncccc2[N+](=O)[O-])CC1 ZINC001112352879 1371408961 /nfs/dbraw/zinc/40/89/61/1371408961.db2.gz HNZGAOLBVXGBGJ-UHFFFAOYSA-N 1 1 349.435 2.123 20 5 EEBDMO COCCC[N@@H+](C)CCNC(=O)c1cc(Cl)c(C)cc1[N+](=O)[O-] ZINC000836713250 1372744092 /nfs/dbraw/zinc/74/40/92/1372744092.db2.gz OIJKTHWIEJYZIX-UHFFFAOYSA-N 1 1 343.811 2.255 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCN1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000840090764 1372921850 /nfs/dbraw/zinc/92/18/50/1372921850.db2.gz GNEFUWXXYMAOCV-MRXNPFEDSA-N 1 1 329.404 2.442 20 5 EEBDMO O=[N+]([O-])c1ccc2ccnc(NC[C@H]3C[N@H+]4CCC[C@H]4CO3)c2c1 ZINC000840252763 782458161 /nfs/dbraw/zinc/45/81/61/782458161.db2.gz YHRBTIUKHHCXKM-GJZGRUSLSA-N 1 1 328.372 2.418 20 5 EEBDMO C[N@@H+]1C[C@H]2[C@@H](CCN2c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000893938147 780320401 /nfs/dbraw/zinc/32/04/01/780320401.db2.gz BSBWYUOBKAWLJJ-ZANVPECISA-N 1 1 326.194 2.498 20 5 EEBDMO CC(C)[N@H+]1CCCN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC1 ZINC000906545542 783985350 /nfs/dbraw/zinc/98/53/50/783985350.db2.gz LTEBXXWMIQZUNJ-UHFFFAOYSA-N 1 1 340.811 2.387 20 5 EEBDMO CCCSc1nc(Cl)c([N+](=O)[O-])c(N[C@]([NH3+])(CC)CO)n1 ZINC001170859637 784622891 /nfs/dbraw/zinc/62/28/91/784622891.db2.gz PVNNEUPXOQCLTB-LLVKDONJSA-N 1 1 335.817 2.010 20 5 EEBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000817677603 784914683 /nfs/dbraw/zinc/91/46/83/784914683.db2.gz ZSFSBWPUYSSJQK-OAHLLOKOSA-N 1 1 346.431 2.361 20 5 EEBDMO CNc1nccc(C(=O)N2CC[N@@H+](C)C3(CCCCC3)C2)c1[N+](=O)[O-] ZINC000908571532 785535452 /nfs/dbraw/zinc/53/54/52/785535452.db2.gz WRNRUDQFEUWVMI-UHFFFAOYSA-N 1 1 347.419 2.122 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NC/C=C\CNc1ccc(C)cc1[N+](=O)[O-] ZINC001107280692 786701263 /nfs/dbraw/zinc/70/12/63/786701263.db2.gz RRDHGQJJLWXSER-WAYWQWQTSA-N 1 1 334.420 2.329 20 5 EEBDMO C[C@H](O)[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000129317259 786888878 /nfs/dbraw/zinc/88/88/78/786888878.db2.gz ABSKDRDAYZWDPF-NWDGAFQWSA-N 1 1 339.367 2.155 20 5 EEBDMO C[C@@H]1CC(=O)N(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000173435651 791856247 /nfs/dbraw/zinc/85/62/47/791856247.db2.gz YNCUKWGHTRLIQM-CYBMUJFWSA-N 1 1 333.388 2.264 20 5 EEBDMO CC(C)(CCC(=O)N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1)[N+](=O)[O-] ZINC000913686200 794103502 /nfs/dbraw/zinc/10/35/02/794103502.db2.gz FZRSUTUQYYFYSA-HOTGVXAUSA-N 1 1 331.416 2.307 20 5 EEBDMO CCNC(=O)CO[C@H]1CCC[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173235736 797313548 /nfs/dbraw/zinc/31/35/48/797313548.db2.gz YXEMZRXAWBQZQX-YOEHRIQHSA-N 1 1 349.431 2.143 20 5 EEBDMO O=C(NC1CC[NH+](CC2CCC3(CC3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001002787420 798609394 /nfs/dbraw/zinc/60/93/94/798609394.db2.gz KKCMNYULVVYABM-HZPDHXFCSA-N 1 1 335.448 2.203 20 5 EEBDMO O=C(NCCCCCC[NH2+]Cc1ccccc1F)[C@@H]1CC1[N+](=O)[O-] ZINC001178458709 799484246 /nfs/dbraw/zinc/48/42/46/799484246.db2.gz UCUNNZHZKNWAMS-GDBMZVCRSA-N 1 1 337.395 2.257 20 5 EEBDMO Cc1conc1C(=O)NC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001003913992 800508352 /nfs/dbraw/zinc/50/83/52/800508352.db2.gz BKVVMBVJWMIUHY-UHFFFAOYSA-N 1 1 344.371 2.286 20 5 EEBDMO CC(C)(C)OC(=O)N1C[C@@H]2CC[N@@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)[C@@H]2C1 ZINC001169011073 803570720 /nfs/dbraw/zinc/57/07/20/803570720.db2.gz IBSACRGAGJDCHJ-LXTVHRRPSA-N 1 1 339.436 2.373 20 5 EEBDMO C[C@H]1CN(C(=O)OC(C)(C)C)CC[N@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169011542 803571560 /nfs/dbraw/zinc/57/15/60/803571560.db2.gz KTZWKGBDSJLFPI-MJBXVCDLSA-N 1 1 327.425 2.373 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)nc1-c1ccncc1 ZINC000789512332 808035988 /nfs/dbraw/zinc/03/59/88/808035988.db2.gz GRPDMSWTBWSKCR-HOCLYGCPSA-N 1 1 343.387 2.454 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)nc1-c1ccncc1 ZINC000789512332 808035992 /nfs/dbraw/zinc/03/59/92/808035992.db2.gz GRPDMSWTBWSKCR-HOCLYGCPSA-N 1 1 343.387 2.454 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H](n3cncn3)C2)c([N+](=O)[O-])c1 ZINC001170344411 809916138 /nfs/dbraw/zinc/91/61/38/809916138.db2.gz BUZABINFALJLBQ-HIFRSBDPSA-N 1 1 345.403 2.463 20 5 EEBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000794258612 810734280 /nfs/dbraw/zinc/73/42/80/810734280.db2.gz UEXSUCJDLQPIBP-JTQLQIEISA-N 1 1 326.372 2.166 20 5 EEBDMO CCc1ccc([C@@H]2C[N@H+](CCn3ccc([N+](=O)[O-])n3)CCO2)cc1 ZINC000190330565 529716684 /nfs/dbraw/zinc/71/66/84/529716684.db2.gz WUMVKIYKYHSOHU-INIZCTEOSA-N 1 1 330.388 2.427 20 5 EEBDMO CCc1ccc([C@@H]2C[N@@H+](CCn3ccc([N+](=O)[O-])n3)CCO2)cc1 ZINC000190330565 529716685 /nfs/dbraw/zinc/71/66/85/529716685.db2.gz WUMVKIYKYHSOHU-INIZCTEOSA-N 1 1 330.388 2.427 20 5 EEBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000426141863 241223972 /nfs/dbraw/zinc/22/39/72/241223972.db2.gz XKUNKLIQMJTULJ-VIFPVBQESA-N 1 1 349.284 2.234 20 5 EEBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000426141863 241223977 /nfs/dbraw/zinc/22/39/77/241223977.db2.gz XKUNKLIQMJTULJ-VIFPVBQESA-N 1 1 349.284 2.234 20 5 EEBDMO C[C@@H](c1c(F)cccc1F)[N@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000438835439 242053330 /nfs/dbraw/zinc/05/33/30/242053330.db2.gz NFHUIFQJQBYQSV-JQWIXIFHSA-N 1 1 340.330 2.123 20 5 EEBDMO C[C@@H](c1c(F)cccc1F)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000438835439 242053336 /nfs/dbraw/zinc/05/33/36/242053336.db2.gz NFHUIFQJQBYQSV-JQWIXIFHSA-N 1 1 340.330 2.123 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000442795693 242115997 /nfs/dbraw/zinc/11/59/97/242115997.db2.gz VEYRPPZAOUBARI-MZBDJJRSSA-N 1 1 346.431 2.447 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]CCC(C)(C)CO)c1ccc([N+](=O)[O-])cc1 ZINC000449409722 242536367 /nfs/dbraw/zinc/53/63/67/242536367.db2.gz VPBUPFGPDAWYHI-HNNXBMFYSA-N 1 1 332.404 2.416 20 5 EEBDMO CCO[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000451524368 243144536 /nfs/dbraw/zinc/14/45/36/243144536.db2.gz DVUKVUSULHGYQW-XJKSGUPXSA-N 1 1 335.404 2.305 20 5 EEBDMO CCO[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000451524368 243144540 /nfs/dbraw/zinc/14/45/40/243144540.db2.gz DVUKVUSULHGYQW-XJKSGUPXSA-N 1 1 335.404 2.305 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCSC[C@@H]2C2CC2)c1 ZINC000451650522 243189195 /nfs/dbraw/zinc/18/91/95/243189195.db2.gz UTBDCOIDUULUNA-GDBMZVCRSA-N 1 1 338.429 2.162 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCCC[C@@H]1[C@H](C)O ZINC000246403296 243243114 /nfs/dbraw/zinc/24/31/14/243243114.db2.gz XZMCELJAGZYRJG-XJKSGUPXSA-N 1 1 335.404 2.467 20 5 EEBDMO COc1cc(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000101627247 204014283 /nfs/dbraw/zinc/01/42/83/204014283.db2.gz YDWRIDSPIYBWNJ-ZDUSSCGKSA-N 1 1 333.344 2.229 20 5 EEBDMO CN(C(=O)C[NH+]1CCC(n2ccnc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000109793173 204293894 /nfs/dbraw/zinc/29/38/94/204293894.db2.gz MMOKZXHLNZLKHK-UHFFFAOYSA-N 1 1 343.387 2.091 20 5 EEBDMO CCC[C@@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000127912753 205123470 /nfs/dbraw/zinc/12/34/70/205123470.db2.gz WKMKAAJANNACRX-QGZVFWFLSA-N 1 1 349.431 2.097 20 5 EEBDMO CCC1(CO)CC[NH+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000128278005 205142251 /nfs/dbraw/zinc/14/22/51/205142251.db2.gz KFCPUUQMVMWREL-ZDUSSCGKSA-N 1 1 335.404 2.406 20 5 EEBDMO COc1ccc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000155447069 206007105 /nfs/dbraw/zinc/00/71/05/206007105.db2.gz KRAQDTUWZQTWCQ-KBPBESRZSA-N 1 1 333.388 2.160 20 5 EEBDMO COc1ccc(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)cc1[N+](=O)[O-] ZINC000157066113 206114511 /nfs/dbraw/zinc/11/45/11/206114511.db2.gz HBOPLMMANKZYHT-ZIAGYGMSSA-N 1 1 333.388 2.160 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000261910296 296226701 /nfs/dbraw/zinc/22/67/01/296226701.db2.gz HMRSQPDKAVUJDJ-OAHLLOKOSA-N 1 1 346.774 2.430 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000177042772 207287481 /nfs/dbraw/zinc/28/74/81/207287481.db2.gz INTQHNFRXAIWOM-OLZOCXBDSA-N 1 1 332.404 2.138 20 5 EEBDMO COC(=O)[C@@]1(C)CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000177460421 207341105 /nfs/dbraw/zinc/34/11/05/207341105.db2.gz LLXDEFSKMPZNAB-INIZCTEOSA-N 1 1 346.343 2.030 20 5 EEBDMO COC(=O)[C@@]1(C)CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000177460421 207341110 /nfs/dbraw/zinc/34/11/10/207341110.db2.gz LLXDEFSKMPZNAB-INIZCTEOSA-N 1 1 346.343 2.030 20 5 EEBDMO CC(C)N1CCC[C@H]([NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)C1=O ZINC000177686639 207377800 /nfs/dbraw/zinc/37/78/00/207377800.db2.gz HBYJRVMGOLAQKG-KRWDZBQOSA-N 1 1 346.431 2.116 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCn3cc(Cl)cn3)C2)nc1 ZINC000459385204 285136181 /nfs/dbraw/zinc/13/61/81/285136181.db2.gz WOEPGILLHYFNTD-LBPRGKRZSA-N 1 1 336.783 2.026 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C[N@H+]1C1CC1 ZINC000267991562 256103489 /nfs/dbraw/zinc/10/34/89/256103489.db2.gz QDSILANTCNOITP-MNOVXSKESA-N 1 1 328.372 2.431 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000270334193 256124459 /nfs/dbraw/zinc/12/44/59/256124459.db2.gz IVYLMOHQBKDQDE-CVEARBPZSA-N 1 1 332.404 2.063 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000270528723 256144831 /nfs/dbraw/zinc/14/48/31/256144831.db2.gz NWYWAZZGXUDLRZ-HNNXBMFYSA-N 1 1 334.420 2.121 20 5 EEBDMO C[C@H]([NH2+]CC(=O)N1CCO[C@@H]2CCCC[C@@H]21)c1ccccc1[N+](=O)[O-] ZINC000271733666 256238803 /nfs/dbraw/zinc/23/88/03/256238803.db2.gz NKKMJJZKAUTURV-RRQGHBQHSA-N 1 1 347.415 2.415 20 5 EEBDMO COc1ccc(NC(=O)N2CC[N@H+]3CCCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000272837926 256242884 /nfs/dbraw/zinc/24/28/84/256242884.db2.gz NYGCFLOEAOPFGI-ZDUSSCGKSA-N 1 1 334.376 2.305 20 5 EEBDMO CC[C@@H]1CN(c2c([N+](=O)[O-])ncn2C)CC[N@H+]1Cc1ccccc1 ZINC000273519537 256303129 /nfs/dbraw/zinc/30/31/29/256303129.db2.gz RUTKHCQJCRMDQS-OAHLLOKOSA-N 1 1 329.404 2.429 20 5 EEBDMO Cc1ccc([C@@H](C)NCCC[N@H+]2CCC[C@H](C(N)=O)C2)cc1[N+](=O)[O-] ZINC000128041455 292335215 /nfs/dbraw/zinc/33/52/15/292335215.db2.gz APUSDRMRUOBGQT-ZBFHGGJFSA-N 1 1 348.447 2.141 20 5 EEBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)[C@H]1CCSC1 ZINC000089935882 159188978 /nfs/dbraw/zinc/18/89/78/159188978.db2.gz QJTOWTWVNBDUOP-LBPRGKRZSA-N 1 1 337.401 2.330 20 5 EEBDMO CC[C@@H]1CCCC[N@H+]1CCNc1ncc(C(=O)OC)cc1[N+](=O)[O-] ZINC000189298006 160138835 /nfs/dbraw/zinc/13/88/35/160138835.db2.gz MJLPUFYOODKXHH-CYBMUJFWSA-N 1 1 336.392 2.453 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000248176743 160339823 /nfs/dbraw/zinc/33/98/23/160339823.db2.gz VSERYMNLWVUBTM-SWLSCSKDSA-N 1 1 333.388 2.160 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000342039951 161034531 /nfs/dbraw/zinc/03/45/31/161034531.db2.gz AEUPLPIZTQXZBZ-JKSUJKDBSA-N 1 1 333.388 2.485 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000342039951 161034532 /nfs/dbraw/zinc/03/45/32/161034532.db2.gz AEUPLPIZTQXZBZ-JKSUJKDBSA-N 1 1 333.388 2.485 20 5 EEBDMO C[N@@H+](CCNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000342652003 161080907 /nfs/dbraw/zinc/08/09/07/161080907.db2.gz JSQSUFZJJDMLDK-UHFFFAOYSA-N 1 1 326.784 2.142 20 5 EEBDMO COC[C@H]1CCCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000342699451 161083953 /nfs/dbraw/zinc/08/39/53/161083953.db2.gz IQTTVUJYVHOFNE-GJZGRUSLSA-N 1 1 338.404 2.083 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000343557442 161146479 /nfs/dbraw/zinc/14/64/79/161146479.db2.gz CCQKBYDNCCVUEQ-AWEZNQCLSA-N 1 1 335.404 2.354 20 5 EEBDMO CCC[N@H+]1CCC[C@@H]1CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000343644202 161154086 /nfs/dbraw/zinc/15/40/86/161154086.db2.gz RKFOLEIMJWDUCY-GFCCVEGCSA-N 1 1 331.376 2.075 20 5 EEBDMO CCC[N@@H+]1CCC[C@@H]1CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000343644202 161154087 /nfs/dbraw/zinc/15/40/87/161154087.db2.gz RKFOLEIMJWDUCY-GFCCVEGCSA-N 1 1 331.376 2.075 20 5 EEBDMO CCC[N@H+]1CCC[C@@H]1CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000343644202 161154088 /nfs/dbraw/zinc/15/40/88/161154088.db2.gz RKFOLEIMJWDUCY-GFCCVEGCSA-N 1 1 331.376 2.075 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCO[C@H]2CCC[C@@H]21 ZINC000343909494 161179371 /nfs/dbraw/zinc/17/93/71/161179371.db2.gz OVTMEWIKFLVEMT-ZFWWWQNUSA-N 1 1 347.371 2.146 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCO[C@H]2CCC[C@@H]21 ZINC000343909494 161179372 /nfs/dbraw/zinc/17/93/72/161179372.db2.gz OVTMEWIKFLVEMT-ZFWWWQNUSA-N 1 1 347.371 2.146 20 5 EEBDMO CCC[C@]1(CO)CC[N@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000344244580 161210771 /nfs/dbraw/zinc/21/07/71/161210771.db2.gz GBDXFMXYZGYOGL-KRWDZBQOSA-N 1 1 335.404 2.326 20 5 EEBDMO CCC[C@]1(CO)CC[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000344244580 161210772 /nfs/dbraw/zinc/21/07/72/161210772.db2.gz GBDXFMXYZGYOGL-KRWDZBQOSA-N 1 1 335.404 2.326 20 5 EEBDMO C[C@@H]1C[N@H+](CC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C[C@H](C)O1 ZINC000344425191 161226296 /nfs/dbraw/zinc/22/62/96/161226296.db2.gz VIFWDFHUWALKAW-OKILXGFUSA-N 1 1 334.420 2.315 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@H]1C ZINC000345166012 161278085 /nfs/dbraw/zinc/27/80/85/161278085.db2.gz VKTMQEWNSPIPAD-CHWSQXEVSA-N 1 1 346.431 2.406 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)NCCc2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000345518797 161308171 /nfs/dbraw/zinc/30/81/71/161308171.db2.gz KKSVGXPQPJIMNU-ZIAGYGMSSA-N 1 1 334.420 2.261 20 5 EEBDMO C[C@H]1[C@H](NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])CCC[N@H+]1C ZINC000345957857 161345468 /nfs/dbraw/zinc/34/54/68/161345468.db2.gz VXALENRHRQUGIR-DZGCQCFKSA-N 1 1 334.420 2.261 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@H](C)c1ccon1 ZINC000349238538 161536178 /nfs/dbraw/zinc/53/61/78/161536178.db2.gz KGQBIWUNFSMSFM-SNVBAGLBSA-N 1 1 334.332 2.271 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc2c(c1)oc(=O)n2C ZINC000352441940 162136649 /nfs/dbraw/zinc/13/66/49/162136649.db2.gz HEXJYBMIZKDWAR-UHFFFAOYSA-N 1 1 343.339 2.338 20 5 EEBDMO Cc1[nH+]ccn1CCCn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O ZINC000354274932 162816135 /nfs/dbraw/zinc/81/61/35/162816135.db2.gz ZYFIHCVOVGOIHW-UHFFFAOYSA-N 1 1 339.355 2.414 20 5 EEBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1)c1ccccc1[N+](=O)[O-] ZINC000355345104 163154751 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332.404 2.391 20 5 EEBDMO C[C@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000272648544 269003976 /nfs/dbraw/zinc/00/39/76/269003976.db2.gz AFWZPXJMNRKZEC-ZDUSSCGKSA-N 1 1 332.404 2.163 20 5 EEBDMO C[C@@H](NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)C1=CC[N@@H+](C)CC1 ZINC000272740307 269015655 /nfs/dbraw/zinc/01/56/55/269015655.db2.gz CSPVSVQYKCONFH-LLVKDONJSA-N 1 1 328.372 2.456 20 5 EEBDMO C[N@H+]1CC[C@H](CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000274901147 269071921 /nfs/dbraw/zinc/07/19/21/269071921.db2.gz PQAWYHQDVWZYHB-SECBINFHSA-N 1 1 344.318 2.269 20 5 EEBDMO C[C@@H]1CN(c2ccc3ncccc3c2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000275390704 274245023 /nfs/dbraw/zinc/24/50/23/274245023.db2.gz ARMPKFFYWSXKOK-CYBMUJFWSA-N 1 1 344.415 2.424 20 5 EEBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000277477156 274296805 /nfs/dbraw/zinc/29/68/05/274296805.db2.gz PIXSHMAKCDGOAK-INIZCTEOSA-N 1 1 332.404 2.411 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C[N@H+]1C1CC1 ZINC000268037396 274391351 /nfs/dbraw/zinc/39/13/51/274391351.db2.gz WYOYJUWGLZOYAC-ZYHUDNBSSA-N 1 1 328.372 2.431 20 5 EEBDMO O=[N+]([O-])c1cccc(Cl)c1N1CC[NH+]([C@H]2CCC[C@H]2O)CC1 ZINC000368639510 275039458 /nfs/dbraw/zinc/03/94/58/275039458.db2.gz VTIYBNVYXXYGDM-GXTWGEPZSA-N 1 1 325.796 2.284 20 5 EEBDMO CSc1ccc(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)cc1[N+](=O)[O-] ZINC000292089363 275374530 /nfs/dbraw/zinc/37/45/30/275374530.db2.gz FGCCPDCGOKIZGJ-MRXNPFEDSA-N 1 1 335.429 2.485 20 5 EEBDMO C[N@H+]1CCC[C@@H](N2CCN(c3cc(Cl)ccc3[N+](=O)[O-])CC2)C1 ZINC000376173244 277053789 /nfs/dbraw/zinc/05/37/89/277053789.db2.gz NLCKVFMBRNTVDY-CQSZACIVSA-N 1 1 338.839 2.464 20 5 EEBDMO C[C@H](c1cccc(NCc2c([N+](=O)[O-])ncn2C)c1)[NH+]1CCOCC1 ZINC000347730426 290250688 /nfs/dbraw/zinc/25/06/88/290250688.db2.gz IKADXQZADKAIRS-CYBMUJFWSA-N 1 1 345.403 2.334 20 5 EEBDMO O=C(NCCC[NH+]1CCOCC1)Nc1cccc([N+](=O)[O-])c1Cl ZINC000284102165 293032038 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ZINC000582126699 324386973 /nfs/dbraw/zinc/38/69/73/324386973.db2.gz PJZBHNAKMPVAMP-CQSZACIVSA-N 1 1 340.383 2.247 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c1 ZINC000280891606 464265489 /nfs/dbraw/zinc/26/54/89/464265489.db2.gz DDJZGFUQYFHYEE-CABCVRRESA-N 1 1 347.415 2.415 20 5 EEBDMO C[N@@H+](CCOc1ccccc1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000193315787 465028720 /nfs/dbraw/zinc/02/87/20/465028720.db2.gz GLGBPXLOFIHPDJ-HNNXBMFYSA-N 1 1 346.383 2.345 20 5 EEBDMO CCOc1ccc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000060567987 462558475 /nfs/dbraw/zinc/55/84/75/462558475.db2.gz HWMFXEAWVHRPBT-KBPBESRZSA-N 1 1 333.388 2.350 20 5 EEBDMO C[C@H]1CCC[N@@H+](CCNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000153682819 462678874 /nfs/dbraw/zinc/67/88/74/462678874.db2.gz YOIKGTFSVSJRMP-ZDUSSCGKSA-N 1 1 344.415 2.467 20 5 EEBDMO C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[N@H+](C)CCO1 ZINC000129897388 462729846 /nfs/dbraw/zinc/72/98/46/462729846.db2.gz KBOQXUJGVVEBKF-TVQRCGJNSA-N 1 1 342.783 2.089 20 5 EEBDMO C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[N@@H+](C)CCO1 ZINC000129897388 462729849 /nfs/dbraw/zinc/72/98/49/462729849.db2.gz KBOQXUJGVVEBKF-TVQRCGJNSA-N 1 1 342.783 2.089 20 5 EEBDMO COCC[N@H+]1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000116278024 462751295 /nfs/dbraw/zinc/75/12/95/462751295.db2.gz MWMYCXFWYAWWLP-GFCCVEGCSA-N 1 1 327.812 2.401 20 5 EEBDMO CC[C@@H](C)[N@@H+](C)CCNS(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000067118865 462967098 /nfs/dbraw/zinc/96/70/98/462967098.db2.gz LBHVKLAFHCBYBW-CYBMUJFWSA-N 1 1 343.449 2.220 20 5 EEBDMO O=C(N[C@H]1CC[N@H+](C2CC2)C1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000067283435 462988636 /nfs/dbraw/zinc/98/86/36/462988636.db2.gz YCAOSMGSIZZHND-ZDUSSCGKSA-N 1 1 330.388 2.136 20 5 EEBDMO Cc1c([C@H](C)[NH2+]C[C@H](C)CN2CCN(C)CC2)cccc1[N+](=O)[O-] ZINC000120925467 463054529 /nfs/dbraw/zinc/05/45/29/463054529.db2.gz IISRQRZFRZYURS-HOCLYGCPSA-N 1 1 334.464 2.437 20 5 EEBDMO COc1ccccc1[C@@H]([NH3+])C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000157470719 463135129 /nfs/dbraw/zinc/13/51/29/463135129.db2.gz GQTWKUXXLRFDBQ-QGZVFWFLSA-N 1 1 341.367 2.188 20 5 EEBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000054287021 463224040 /nfs/dbraw/zinc/22/40/40/463224040.db2.gz GWSVBUFTTAZTBF-LBPRGKRZSA-N 1 1 334.420 2.417 20 5 EEBDMO NC(=O)CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000079927284 463261574 /nfs/dbraw/zinc/26/15/74/463261574.db2.gz JPLYTFXFNHYNAT-UHFFFAOYSA-N 1 1 343.383 2.351 20 5 EEBDMO CC(C)[C@@H](CNc1nc2sccn2c1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000143054502 463366025 /nfs/dbraw/zinc/36/60/25/463366025.db2.gz NBYMPVSBSRDHTE-LLVKDONJSA-N 1 1 339.421 2.073 20 5 EEBDMO CCCNC(=O)[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083169836 463537290 /nfs/dbraw/zinc/53/72/90/463537290.db2.gz YDZYWVVKBJGRFF-LBPRGKRZSA-N 1 1 346.387 2.474 20 5 EEBDMO CCCNC(=O)[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083169836 463537294 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346.431 2.482 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000177862256 463805786 /nfs/dbraw/zinc/80/57/86/463805786.db2.gz WECUUQSAJVVQPE-OAHLLOKOSA-N 1 1 334.420 2.121 20 5 EEBDMO COC(=O)C1([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])CCCC1 ZINC000283220709 463808038 /nfs/dbraw/zinc/80/80/38/463808038.db2.gz HXFUIXFIABYCRA-UHFFFAOYSA-N 1 1 349.387 2.341 20 5 EEBDMO O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000339674110 465434202 /nfs/dbraw/zinc/43/42/02/465434202.db2.gz XDMVBUAIXASGKD-JSGCOSHPSA-N 1 1 335.429 2.430 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@]12CCOC2=O ZINC000186676415 464046892 /nfs/dbraw/zinc/04/68/92/464046892.db2.gz BKDARCNZATYWRL-QGZVFWFLSA-N 1 1 347.371 2.013 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@]12CCOC2=O ZINC000186676415 464046897 /nfs/dbraw/zinc/04/68/97/464046897.db2.gz BKDARCNZATYWRL-QGZVFWFLSA-N 1 1 347.371 2.013 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+](C)C[C@H]2CCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000270046758 464169069 /nfs/dbraw/zinc/16/90/69/464169069.db2.gz FAWCFJUOVBTGLJ-CZUORRHYSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C[C@@H]1CCC[C@H]1O ZINC000270057374 464173042 /nfs/dbraw/zinc/17/30/42/464173042.db2.gz GMWAECIGTBDYSH-XJKSGUPXSA-N 1 1 335.404 2.325 20 5 EEBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCC[C@H]1O ZINC000270154303 464201782 /nfs/dbraw/zinc/20/17/82/464201782.db2.gz ROMBIGUKZKGLRW-GXTWGEPZSA-N 1 1 332.360 2.238 20 5 EEBDMO COc1cc(C[N@@H+]2CCC[C@H](O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179871456 464202397 /nfs/dbraw/zinc/20/23/97/464202397.db2.gz HBKGFYXNPWMCIP-NSHDSACASA-N 1 1 346.330 2.204 20 5 EEBDMO COc1cc(C[N@H+]2CCC[C@H](O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179871456 464202399 /nfs/dbraw/zinc/20/23/99/464202399.db2.gz HBKGFYXNPWMCIP-NSHDSACASA-N 1 1 346.330 2.204 20 5 EEBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](CO)C1 ZINC000263850599 464215918 /nfs/dbraw/zinc/21/59/18/464215918.db2.gz GMYISJQXRGXGRO-NWDGAFQWSA-N 1 1 332.360 2.410 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@@H]1C ZINC000264345034 464294618 /nfs/dbraw/zinc/29/46/18/464294618.db2.gz QTBCGCZMFNVABI-STQMWFEESA-N 1 1 330.388 2.034 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H](CO)CC3)n2)cc1 ZINC000293198837 464392860 /nfs/dbraw/zinc/39/28/60/464392860.db2.gz QQGZUFYNDGUVQR-GFCCVEGCSA-N 1 1 332.360 2.239 20 5 EEBDMO C[C@H]1C[C@H](C(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)CC[N@H+]1C ZINC000359608183 465472132 /nfs/dbraw/zinc/47/21/32/465472132.db2.gz DOOVVNRSVFKPFO-QWHCGFSZSA-N 1 1 333.388 2.046 20 5 EEBDMO C[C@H]([NH2+]CCCN1CCCO[C@@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285032195 464432611 /nfs/dbraw/zinc/43/26/11/464432611.db2.gz HUOSWOOBVWLCNE-KBPBESRZSA-N 1 1 336.436 2.329 20 5 EEBDMO C[C@H](NCCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285032195 464432615 /nfs/dbraw/zinc/43/26/15/464432615.db2.gz HUOSWOOBVWLCNE-KBPBESRZSA-N 1 1 336.436 2.329 20 5 EEBDMO C[C@H](NCCC[N@H+]1CCCO[C@@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285032195 464432621 /nfs/dbraw/zinc/43/26/21/464432621.db2.gz HUOSWOOBVWLCNE-KBPBESRZSA-N 1 1 336.436 2.329 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[C@@H]3CC[N@H+](C)C[C@H]32)c1 ZINC000281448069 464458381 /nfs/dbraw/zinc/45/83/81/464458381.db2.gz FBKQJKCXUZQNCL-GOEBONIOSA-N 1 1 347.415 2.225 20 5 EEBDMO C[N@@H+]1CC=C(CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1 ZINC000272052680 464462347 /nfs/dbraw/zinc/46/23/47/464462347.db2.gz ZRDIALVOMJREBI-UHFFFAOYSA-N 1 1 330.388 2.161 20 5 EEBDMO C[C@H](c1ccccn1)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182288274 464620044 /nfs/dbraw/zinc/62/00/44/464620044.db2.gz WHGWUOFHXJKUIT-KGLIPLIRSA-N 1 1 331.372 2.423 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000272519051 464641732 /nfs/dbraw/zinc/64/17/32/464641732.db2.gz HBMSZLFSCLSHLK-HNNXBMFYSA-N 1 1 343.383 2.157 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000265934596 464739628 /nfs/dbraw/zinc/73/96/28/464739628.db2.gz FQFUPVAQKJTCPF-XJKSGUPXSA-N 1 1 344.415 2.348 20 5 EEBDMO CCOCC[NH+]1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000266892702 464861426 /nfs/dbraw/zinc/86/14/26/464861426.db2.gz FLXHGVLSIGMGCA-UHFFFAOYSA-N 1 1 327.812 2.402 20 5 EEBDMO CCO[C@H]1C[C@@H](O)C12CC[NH+](Cc1ccc([N+](=O)[O-])c(F)c1)CC2 ZINC000276330266 464890948 /nfs/dbraw/zinc/89/09/48/464890948.db2.gz QXXCUCDQRIQTGU-CVEARBPZSA-N 1 1 338.379 2.486 20 5 EEBDMO O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000358847225 465355965 /nfs/dbraw/zinc/35/59/65/465355965.db2.gz FQUPUBBHJYPZRH-AWEZNQCLSA-N 1 1 328.372 2.317 20 5 EEBDMO O=C(C[N@@H+]1CC[C@@H](CC2CC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000339684198 465441663 /nfs/dbraw/zinc/44/16/63/465441663.db2.gz QVEUFAAVPFPEFX-LBPRGKRZSA-N 1 1 347.371 2.384 20 5 EEBDMO O=C(C[N@H+]1CC[C@@H](CC2CC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000339684198 465441670 /nfs/dbraw/zinc/44/16/70/465441670.db2.gz QVEUFAAVPFPEFX-LBPRGKRZSA-N 1 1 347.371 2.384 20 5 EEBDMO C[C@@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC000359816066 465492324 /nfs/dbraw/zinc/49/23/24/465492324.db2.gz VWFBFEGHGKKTPX-HIFRSBDPSA-N 1 1 342.399 2.326 20 5 EEBDMO CC(C)[C@H]1C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1 ZINC000339811255 465523398 /nfs/dbraw/zinc/52/33/98/465523398.db2.gz JNFZYBHLDZSNDZ-IAGOWNOFSA-N 1 1 347.415 2.447 20 5 EEBDMO CC(C)[C@H]1C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1 ZINC000339811255 465523403 /nfs/dbraw/zinc/52/34/03/465523403.db2.gz JNFZYBHLDZSNDZ-IAGOWNOFSA-N 1 1 347.415 2.447 20 5 EEBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000371364692 465745757 /nfs/dbraw/zinc/74/57/57/465745757.db2.gz PDBPPTLKICRIRY-KBPBESRZSA-N 1 1 342.399 2.362 20 5 EEBDMO CNc1c(C(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000361179106 465818723 /nfs/dbraw/zinc/81/87/23/465818723.db2.gz OVBJKPHKOLXNSS-QWHCGFSZSA-N 1 1 334.420 2.487 20 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CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000367272583 466230979 /nfs/dbraw/zinc/23/09/79/466230979.db2.gz VJVMTXNSWISQFC-HOTGVXAUSA-N 1 1 346.431 2.406 20 5 EEBDMO COC(=O)c1cc(C(=O)Nc2cc[nH+]c(N(C)C)c2)cc([N+](=O)[O-])c1 ZINC000346922527 466252670 /nfs/dbraw/zinc/25/26/70/466252670.db2.gz KXLJSLVXOLRQOC-UHFFFAOYSA-N 1 1 344.327 2.095 20 5 EEBDMO CC[C@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000340691944 466266478 /nfs/dbraw/zinc/26/64/78/466266478.db2.gz NYFDOXKETHAJAS-OAHLLOKOSA-N 1 1 342.399 2.490 20 5 EEBDMO COc1ccncc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000347003036 466308500 /nfs/dbraw/zinc/30/85/00/466308500.db2.gz XHKJAPBIKRADID-ZDUSSCGKSA-N 1 1 329.360 2.080 20 5 EEBDMO COc1ccncc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000347003036 466308504 /nfs/dbraw/zinc/30/85/04/466308504.db2.gz XHKJAPBIKRADID-ZDUSSCGKSA-N 1 1 329.360 2.080 20 5 EEBDMO O=[N+]([O-])c1ccccc1NCCNc1cc[nH+]c(N2CCCCC2)n1 ZINC000354048504 466332947 /nfs/dbraw/zinc/33/29/47/466332947.db2.gz QBUHYHCGDFETRB-UHFFFAOYSA-N 1 1 342.403 2.899 20 5 EEBDMO C[C@@H](CC[NH+]1CCOCC1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000358031087 466398615 /nfs/dbraw/zinc/39/86/15/466398615.db2.gz TVQGBGBJUCXMIZ-LBPRGKRZSA-N 1 1 347.371 2.182 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2c([N+](=O)[O-])ncn2C)C1 ZINC000363447185 466409143 /nfs/dbraw/zinc/40/91/43/466409143.db2.gz ADELMCSWEWCUNB-CABCVRRESA-N 1 1 335.452 2.415 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@H](O)C1CC1 ZINC000305696430 466426722 /nfs/dbraw/zinc/42/67/22/466426722.db2.gz CBFMAPYLKLJEGB-YGRLFVJLSA-N 1 1 332.360 2.409 20 5 EEBDMO C[C@H](C(=O)N1CC[C@H]2CC[N@@H+](C)C[C@H]21)c1ccc([N+](=O)[O-])cc1F ZINC000332237517 466461587 /nfs/dbraw/zinc/46/15/87/466461587.db2.gz HKWRAPCIHHVSRG-HWWQOWPSSA-N 1 1 335.379 2.390 20 5 EEBDMO C[C@H](C(=O)N1CC[C@H]2CC[N@@H+](C)C[C@@H]21)c1ccc([N+](=O)[O-])cc1F ZINC000332237520 466461875 /nfs/dbraw/zinc/46/18/75/466461875.db2.gz HKWRAPCIHHVSRG-OZVIIMIRSA-N 1 1 335.379 2.390 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])n2C)C1 ZINC000347201532 466472054 /nfs/dbraw/zinc/47/20/54/466472054.db2.gz OMABGSIFXLPQJL-BETUJISGSA-N 1 1 336.436 2.420 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](N2CCNC2=O)C1 ZINC000368021469 466567783 /nfs/dbraw/zinc/56/77/83/466567783.db2.gz RJAAUZLUKSFAPS-HIFRSBDPSA-N 1 1 332.404 2.454 20 5 EEBDMO COCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CC[C@H](C)C1 ZINC000362148284 466588380 /nfs/dbraw/zinc/58/83/80/466588380.db2.gz ISARMKMECOADIK-WFASDCNBSA-N 1 1 335.404 2.331 20 5 EEBDMO CCOc1cc(C[N@@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)ccc1[N+](=O)[O-] ZINC000372807896 466597268 /nfs/dbraw/zinc/59/72/68/466597268.db2.gz RUYSCAPFDJWHMG-ZENOOKHLSA-N 1 1 333.388 2.079 20 5 EEBDMO CCOc1cc(C[N@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)ccc1[N+](=O)[O-] ZINC000372807896 466597270 /nfs/dbraw/zinc/59/72/70/466597270.db2.gz RUYSCAPFDJWHMG-ZENOOKHLSA-N 1 1 333.388 2.079 20 5 EEBDMO Nc1ccc(-c2noc([C@@H]3CCc4[nH+]ccn4C3)n2)cc1[N+](=O)[O-] ZINC000364280964 466691869 /nfs/dbraw/zinc/69/18/69/466691869.db2.gz JYJXUFBCFCUBSF-SNVBAGLBSA-N 1 1 326.316 2.154 20 5 EEBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCOCC3(CCC3)C2)c2c(c1)COCO2 ZINC000368841059 466702619 /nfs/dbraw/zinc/70/26/19/466702619.db2.gz CQLDAOCVNVMVJZ-UHFFFAOYSA-N 1 1 334.372 2.464 20 5 EEBDMO O=[N+]([O-])c1cc(C[N@H+]2CCOCC3(CCC3)C2)c2c(c1)COCO2 ZINC000368841059 466702620 /nfs/dbraw/zinc/70/26/20/466702620.db2.gz CQLDAOCVNVMVJZ-UHFFFAOYSA-N 1 1 334.372 2.464 20 5 EEBDMO Cn1ncc2c1CCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000411848301 466916653 /nfs/dbraw/zinc/91/66/53/466916653.db2.gz HPKGQKCDBDWREY-UHFFFAOYSA-N 1 1 343.387 2.105 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420333788 467362367 /nfs/dbraw/zinc/36/23/67/467362367.db2.gz FTKVSFNBJJVADT-CABCVRRESA-N 1 1 346.431 2.163 20 5 EEBDMO C[C@H]1CC[C@H](C(=O)OC(C)(C)C)C[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000420924512 467515577 /nfs/dbraw/zinc/51/55/77/467515577.db2.gz JZIKUKMGUCDMLO-STQMWFEESA-N 1 1 338.408 2.234 20 5 EEBDMO CC(C)[C@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])N1CCN(C)CC1 ZINC000449075316 467616590 /nfs/dbraw/zinc/61/65/90/467616590.db2.gz MQJLSMKCDVLQCH-LPHOPBHVSA-N 1 1 348.491 2.387 20 5 EEBDMO C[C@H](CCN1CCN(C)CC1)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449253613 467626117 /nfs/dbraw/zinc/62/61/17/467626117.db2.gz ZNWIEUNLJRVWDA-CVEARBPZSA-N 1 1 334.464 2.141 20 5 EEBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000450542496 467867248 /nfs/dbraw/zinc/86/72/48/467867248.db2.gz UMJXZZJAHJTTOA-NWDGAFQWSA-N 1 1 343.387 2.150 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000450542496 467867249 /nfs/dbraw/zinc/86/72/49/467867249.db2.gz UMJXZZJAHJTTOA-NWDGAFQWSA-N 1 1 343.387 2.150 20 5 EEBDMO Cc1c(CNC(=O)NCC[C@H]2CCC[N@H+](C)C2)cccc1[N+](=O)[O-] ZINC000458689152 467880600 /nfs/dbraw/zinc/88/06/00/467880600.db2.gz JSFSECIIJYQHRI-CQSZACIVSA-N 1 1 334.420 2.434 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@@H+](C)[C@H](C(C)C)C1 ZINC000487946757 468062064 /nfs/dbraw/zinc/06/20/64/468062064.db2.gz CDMIETIPZUHHSN-INIZCTEOSA-N 1 1 334.420 2.114 20 5 EEBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[N@@H+](CC2CCC2)CC1 ZINC000550118516 468207503 /nfs/dbraw/zinc/20/75/03/468207503.db2.gz QCRYCCFBCNOLMZ-UHFFFAOYSA-N 1 1 331.416 2.472 20 5 EEBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+][C@@H]2CCCC[C@H]2F)cc1 ZINC000591771005 468518387 /nfs/dbraw/zinc/51/83/87/468518387.db2.gz HUCALSHWHMAAFI-ZIAGYGMSSA-N 1 1 330.381 2.239 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000597603504 468613508 /nfs/dbraw/zinc/61/35/08/468613508.db2.gz CTBHSERPADTUMX-CQSZACIVSA-N 1 1 335.404 2.306 20 5 EEBDMO Cc1sc(S(=O)(=O)N[C@@H]2CC[N@@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000594799066 468690810 /nfs/dbraw/zinc/69/08/10/468690810.db2.gz IHODVPRZJUMNBT-SNVBAGLBSA-N 1 1 347.462 2.116 20 5 EEBDMO Cc1sc(S(=O)(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000594799066 468690814 /nfs/dbraw/zinc/69/08/14/468690814.db2.gz IHODVPRZJUMNBT-SNVBAGLBSA-N 1 1 347.462 2.116 20 5 EEBDMO COc1ccc(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000597853427 468693554 /nfs/dbraw/zinc/69/35/54/468693554.db2.gz AFNXSHVAGOSADK-GFCCVEGCSA-N 1 1 335.404 2.454 20 5 EEBDMO C[N@@H+](CCSc1ncc([N+](=O)[O-])c(N)n1)Cc1ccc(F)cc1 ZINC000594900212 468719155 /nfs/dbraw/zinc/71/91/55/468719155.db2.gz QHHAGRGUHVMVEB-UHFFFAOYSA-N 1 1 337.380 2.330 20 5 EEBDMO CN(CCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12)CC(F)(F)F ZINC000601115751 468746885 /nfs/dbraw/zinc/74/68/85/468746885.db2.gz KBVBXCFHZXBHRX-UHFFFAOYSA-N 1 1 328.294 2.471 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CN1CCC([N@H+]2CCOC[C@H]2C)CC1 ZINC000571242556 468758878 /nfs/dbraw/zinc/75/88/78/468758878.db2.gz SZCLRXXMNYOBHT-CQSZACIVSA-N 1 1 349.431 2.289 20 5 EEBDMO Cc1noc(C[NH+]2CCC(C(=O)N3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000595292374 468802102 /nfs/dbraw/zinc/80/21/02/468802102.db2.gz PVBSSSODCGWNFN-UHFFFAOYSA-N 1 1 336.392 2.116 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1CCC([C@H](C)CO)CC1 ZINC000593084674 468864597 /nfs/dbraw/zinc/86/45/97/468864597.db2.gz QIJIZVPLLKEFRJ-CYBMUJFWSA-N 1 1 335.404 2.182 20 5 EEBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](CCOCc2ccccc2)CC1 ZINC000595524502 468887933 /nfs/dbraw/zinc/88/79/33/468887933.db2.gz WCRCMHBHGJXXSM-UHFFFAOYSA-N 1 1 342.399 2.329 20 5 EEBDMO O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598558080 468911709 /nfs/dbraw/zinc/91/17/09/468911709.db2.gz CFXYBNNRXBCMNA-OAHLLOKOSA-N 1 1 347.415 2.212 20 5 EEBDMO O=C(CNc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598562042 468914430 /nfs/dbraw/zinc/91/44/30/468914430.db2.gz SEANEWCCDHWOIB-OAHLLOKOSA-N 1 1 346.431 2.245 20 5 EEBDMO CN(C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cccnc1[N+](=O)[O-] ZINC000614533755 468966673 /nfs/dbraw/zinc/96/66/73/468966673.db2.gz VSYDQRDXVMJMAP-GOSISDBHSA-N 1 1 342.399 2.063 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CC1=CCCOC1 ZINC000595751096 468988990 /nfs/dbraw/zinc/98/89/90/468988990.db2.gz GOJALCHXNSNGPG-UHFFFAOYSA-N 1 1 349.387 2.211 20 5 EEBDMO NC(=O)c1ccc(C[NH+]2CCC3(CCCC3=O)CC2)c([N+](=O)[O-])c1 ZINC000595804678 469021133 /nfs/dbraw/zinc/02/11/33/469021133.db2.gz BTZGOMFFMBPJLX-UHFFFAOYSA-N 1 1 331.372 2.029 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000602782889 469071251 /nfs/dbraw/zinc/07/12/51/469071251.db2.gz XZFHCGWDOQZVCV-OAHLLOKOSA-N 1 1 343.431 2.306 20 5 EEBDMO CC[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C[C@@H]1C ZINC000611084824 469156925 /nfs/dbraw/zinc/15/69/25/469156925.db2.gz XOCCJHMFPGWRBC-AWEZNQCLSA-N 1 1 346.431 2.361 20 5 EEBDMO CC[N@H+]1CCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C[C@H]1C ZINC000611088336 469158934 /nfs/dbraw/zinc/15/89/34/469158934.db2.gz QJCGPIBJNSRWJC-LLVKDONJSA-N 1 1 344.371 2.015 20 5 EEBDMO Cn1ccnc1[C@@H](NCC1CC[NH2+]CC1)c1ccc([N+](=O)[O-])cc1 ZINC000573711448 469191150 /nfs/dbraw/zinc/19/11/50/469191150.db2.gz UAELIUXTUIUHOV-INIZCTEOSA-N 1 1 329.404 2.007 20 5 EEBDMO CC[N@@H+](C[C@H]1CCOC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000611205148 469191473 /nfs/dbraw/zinc/19/14/73/469191473.db2.gz JPINBAUHFJIUMO-CZUORRHYSA-N 1 1 333.388 2.059 20 5 EEBDMO CCOC(=O)c1ccnc(N2CCC[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-] ZINC000596269589 469226947 /nfs/dbraw/zinc/22/69/47/469226947.db2.gz UQOYUSQLRISBRV-LBPRGKRZSA-N 1 1 336.392 2.087 20 5 EEBDMO C[C@@H]1CC(F)(F)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000599628228 469315772 /nfs/dbraw/zinc/31/57/72/469315772.db2.gz QWIHYKMCCPRXSR-NEPJUHHUSA-N 1 1 330.331 2.454 20 5 EEBDMO CN1CC[NH+](Cc2ccc(CNc3cccnc3[N+](=O)[O-])cc2)CC1 ZINC000603857416 469437774 /nfs/dbraw/zinc/43/77/74/469437774.db2.gz RIORNMWFEKHZAR-UHFFFAOYSA-N 1 1 341.415 2.349 20 5 EEBDMO CCCc1n[nH]c(C(=O)N2CCC[N@@H+](CC3CCC3)CC2)c1[N+](=O)[O-] ZINC000619868406 469691497 /nfs/dbraw/zinc/69/14/97/469691497.db2.gz TXQKMOOYQPQIIS-UHFFFAOYSA-N 1 1 349.435 2.218 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CCC[N@H+](CC3CCC3)CC2)c1[N+](=O)[O-] ZINC000619868406 469691501 /nfs/dbraw/zinc/69/15/01/469691501.db2.gz TXQKMOOYQPQIIS-UHFFFAOYSA-N 1 1 349.435 2.218 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CCC[N@@H+](CC3CCC3)CC2)c1[N+](=O)[O-] ZINC000619868406 469691506 /nfs/dbraw/zinc/69/15/06/469691506.db2.gz TXQKMOOYQPQIIS-UHFFFAOYSA-N 1 1 349.435 2.218 20 5 EEBDMO COc1ccc(C[NH2+]C2CCN(C[C@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000609599086 469946130 /nfs/dbraw/zinc/94/61/30/469946130.db2.gz KPXHYYFUYKKUDE-MRXNPFEDSA-N 1 1 349.431 2.336 20 5 EEBDMO C[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCCc2ccccc21 ZINC000610335376 470005176 /nfs/dbraw/zinc/00/51/76/470005176.db2.gz RRDHUHPHGIECRA-WBVHZDCISA-N 1 1 330.388 2.162 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000411430992 527971411 /nfs/dbraw/zinc/97/14/11/527971411.db2.gz UEJUTJIHPKYGGN-KGLIPLIRSA-N 1 1 334.420 2.338 20 5 EEBDMO CCN1C[C@H](C)[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000411430992 527971418 /nfs/dbraw/zinc/97/14/18/527971418.db2.gz UEJUTJIHPKYGGN-KGLIPLIRSA-N 1 1 334.420 2.338 20 5 EEBDMO CCN1C[C@H](C)[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000411430992 527971422 /nfs/dbraw/zinc/97/14/22/527971422.db2.gz UEJUTJIHPKYGGN-KGLIPLIRSA-N 1 1 334.420 2.338 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000111352832 535490987 /nfs/dbraw/zinc/49/09/87/535490987.db2.gz KIZWIOSFYXOWCU-CQSZACIVSA-N 1 1 341.433 2.056 20 5 EEBDMO C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H](CO)CC(C)(C)C ZINC000451772516 536418936 /nfs/dbraw/zinc/41/89/36/536418936.db2.gz ASZFRKJVZJQUHK-HUUCEWRRSA-N 1 1 340.420 2.063 20 5 EEBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)[C@@H]2C1 ZINC000425059885 536487833 /nfs/dbraw/zinc/48/78/33/536487833.db2.gz SYSIHVQXEKVIFS-YVEFUNNKSA-N 1 1 342.399 2.171 20 5 EEBDMO CC[N@@H+](C[C@@H]1CCOC1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738080567 576430127 /nfs/dbraw/zinc/43/01/27/576430127.db2.gz GWDRMPUNVZMIHS-ZDUSSCGKSA-N 1 1 331.376 2.169 20 5 EEBDMO Cc1[nH+]ccn1CCOC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000771914663 577238141 /nfs/dbraw/zinc/23/81/41/577238141.db2.gz KYCVCBHWLJZHGC-UHFFFAOYSA-N 1 1 333.344 2.420 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1COC(=O)C[N@H+](C)[C@H]1CCSC1 ZINC000772056637 577248295 /nfs/dbraw/zinc/24/82/95/577248295.db2.gz AQHYOWXJUTXCGV-ZDUSSCGKSA-N 1 1 340.401 2.084 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1COC(=O)C[N@@H+](C)[C@H]1CCSC1 ZINC000772056637 577248296 /nfs/dbraw/zinc/24/82/96/577248296.db2.gz AQHYOWXJUTXCGV-ZDUSSCGKSA-N 1 1 340.401 2.084 20 5 EEBDMO Cc1nn(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c2ncc([N+](=O)[O-])cc12 ZINC000765105882 577495052 /nfs/dbraw/zinc/49/50/52/577495052.db2.gz LSHRQSFKHGXEPI-XJKSGUPXSA-N 1 1 344.419 2.022 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1Cn1nccc1[N+](=O)[O-] ZINC000766378519 577518165 /nfs/dbraw/zinc/51/81/65/577518165.db2.gz XJKPWFBHYRHNQI-GJZGRUSLSA-N 1 1 329.404 2.344 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)[C@@H](C)C[N@@H+]1C ZINC000769144093 577571011 /nfs/dbraw/zinc/57/10/11/577571011.db2.gz GUGPVIUEWNMEIX-KGLIPLIRSA-N 1 1 346.431 2.360 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)[C@@H](C)C[N@H+]1C ZINC000769144093 577571012 /nfs/dbraw/zinc/57/10/12/577571012.db2.gz GUGPVIUEWNMEIX-KGLIPLIRSA-N 1 1 346.431 2.360 20 5 EEBDMO Cc1[nH+]ccn1CCCOC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000763114056 577715253 /nfs/dbraw/zinc/71/52/53/577715253.db2.gz SMJQVRDUMAFHQC-UHFFFAOYSA-N 1 1 332.360 2.413 20 5 EEBDMO COc1cc(N)c([N+](=O)[O-])cc1C(=O)OCC[C@@H]1CCCC[N@H+]1C ZINC000753449624 577787692 /nfs/dbraw/zinc/78/76/92/577787692.db2.gz YFCOWXDALPFSGA-NSHDSACASA-N 1 1 337.376 2.217 20 5 EEBDMO C[N@H+](CCC1CC1)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000746628420 577931311 /nfs/dbraw/zinc/93/13/11/577931311.db2.gz UWFYQRBIBJMPBY-QGZVFWFLSA-N 1 1 346.387 2.051 20 5 EEBDMO C[N@@H+](CCC1CC1)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000746628420 577931312 /nfs/dbraw/zinc/93/13/12/577931312.db2.gz UWFYQRBIBJMPBY-QGZVFWFLSA-N 1 1 346.387 2.051 20 5 EEBDMO COC(=O)C[C@@H]1CCCC[N@@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000749943448 577984237 /nfs/dbraw/zinc/98/42/37/577984237.db2.gz GNJFCRWEDYWCSP-LBPRGKRZSA-N 1 1 347.375 2.023 20 5 EEBDMO COC(=O)C[C@@H]1CCCC[N@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000749943448 577984238 /nfs/dbraw/zinc/98/42/38/577984238.db2.gz GNJFCRWEDYWCSP-LBPRGKRZSA-N 1 1 347.375 2.023 20 5 EEBDMO COC1CCC([N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC1 ZINC000749952550 577984479 /nfs/dbraw/zinc/98/44/79/577984479.db2.gz ICTHOCQTQHNWKM-UHFFFAOYSA-N 1 1 333.392 2.495 20 5 EEBDMO C[C@@H](C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCCCCC1 ZINC000741031684 578111831 /nfs/dbraw/zinc/11/18/31/578111831.db2.gz VOCWJOLTYPZXEE-ZDUSSCGKSA-N 1 1 349.387 2.341 20 5 EEBDMO Cc1c(CN2CCC(C[NH+]3CCN(C)CC3)CC2)cccc1[N+](=O)[O-] ZINC000735873356 578171048 /nfs/dbraw/zinc/17/10/48/578171048.db2.gz KSHDYVDXQBHFCV-UHFFFAOYSA-N 1 1 346.475 2.363 20 5 EEBDMO O=C(N[C@H]1C[C@@H]([NH2+]Cc2cccc(C(F)F)c2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001022063735 676628304 /nfs/dbraw/zinc/62/83/04/676628304.db2.gz KIWRIPLZIFKKIK-XJFOESAGSA-N 1 1 339.342 2.026 20 5 EEBDMO CNC(=O)[C@@H](C)C[N@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000234362933 676794921 /nfs/dbraw/zinc/79/49/21/676794921.db2.gz WRZBRJSMBOWNRM-VIFPVBQESA-N 1 1 344.209 2.171 20 5 EEBDMO CNC(=O)[C@@H](C)C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000234362933 676794923 /nfs/dbraw/zinc/79/49/23/676794923.db2.gz WRZBRJSMBOWNRM-VIFPVBQESA-N 1 1 344.209 2.171 20 5 EEBDMO CCn1cc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c(C)n1 ZINC000891723022 676802560 /nfs/dbraw/zinc/80/25/60/676802560.db2.gz HGPULTURFFGPTL-UHFFFAOYSA-N 1 1 329.404 2.442 20 5 EEBDMO CCCNC(=O)[C@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000050900076 679477586 /nfs/dbraw/zinc/47/75/86/679477586.db2.gz STUGCRSHCPRGDL-ZDUSSCGKSA-N 1 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CCCN(CCNC(=O)Cn1cc[nH+]c1C)c1ccccc1[N+](=O)[O-] ZINC001101147459 1245450552 /nfs/dbraw/zinc/45/05/52/1245450552.db2.gz ZZRXEJHLXKHOKY-UHFFFAOYSA-N 1 1 345.403 2.133 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)N[C@H]1C[C@H](CNc2ccc([N+](=O)[O-])cc2)C1 ZINC001068493345 1251160443 /nfs/dbraw/zinc/16/04/43/1251160443.db2.gz NJTALSMZNUJWDR-CTYIDZIISA-N 1 1 343.387 2.107 20 5 EEBDMO C[C@@H](NC1CC[NH+](C[C@@H]2CCCO2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815579222 1278143689 /nfs/dbraw/zinc/14/36/89/1278143689.db2.gz HYKPGWXHPDYYHE-CJNGLKHVSA-N 1 1 348.447 2.471 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCN2CCOCC2)CC2CC2)cc1F ZINC000852636535 1292149964 /nfs/dbraw/zinc/14/99/64/1292149964.db2.gz WPWXNHRNUAKUMB-UHFFFAOYSA-N 1 1 337.395 2.278 20 5 EEBDMO COCC[N@H+]1CC[C@@H](Nc2cccc(Br)c2[N+](=O)[O-])C1 ZINC000856729685 1293608804 /nfs/dbraw/zinc/60/88/04/1293608804.db2.gz PRTODAAHJOLANA-SNVBAGLBSA-N 1 1 344.209 2.490 20 5 EEBDMO COC(=O)[C@@H]([NH3+])CCC(=O)Nc1cc2cccnc2c2ncccc12 ZINC001218978885 1297889650 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CCCC[N@@H+](C)C[C@@H](C)Nc1ccc([N+](=O)[O-])c(-c2nn[nH]n2)c1 ZINC001604182000 1350886438 /nfs/dbraw/zinc/88/64/38/1350886438.db2.gz VVVUUFGXFXUUIN-LLVKDONJSA-N 1 1 333.396 2.307 20 5 EEBDMO Cc1cccc(NCCNc2cccc(-c3nn[nH]n3)c2[N+](=O)[O-])[nH+]1 ZINC001605919974 1351253760 /nfs/dbraw/zinc/25/37/60/1351253760.db2.gz UOHQYGDPHJHGJE-UHFFFAOYSA-N 1 1 340.347 2.002 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1C[N@H+]1CCC[C@H](C2CC2)C1 ZINC001607084063 1351410791 /nfs/dbraw/zinc/41/07/91/1351410791.db2.gz RXLQTRWHKDVRLH-LBPRGKRZSA-N 1 1 328.376 2.397 20 5 EEBDMO O=C(NCCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1cocn1 ZINC001752247237 1406240636 /nfs/dbraw/zinc/24/06/36/1406240636.db2.gz NWJWUFKRLFVEPO-UHFFFAOYSA-N 1 1 344.371 2.367 20 5 EEBDMO O=[N+]([O-])c1cnc(N2CC[C@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)c(F)c1 ZINC001164731341 720367147 /nfs/dbraw/zinc/36/71/47/720367147.db2.gz ZDLVBRHWYRHONT-JKSUJKDBSA-N 1 1 343.362 2.377 20 5 EEBDMO O=[N+]([O-])c1cnc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c(F)c1 ZINC001164731341 720367153 /nfs/dbraw/zinc/36/71/53/720367153.db2.gz ZDLVBRHWYRHONT-JKSUJKDBSA-N 1 1 343.362 2.377 20 5 EEBDMO Cc1cc(Cl)nc(N2CC[NH+](C[C@@H]3CCCO3)CC2)c1[N+](=O)[O-] ZINC001165040055 721906317 /nfs/dbraw/zinc/90/63/17/721906317.db2.gz WRINDANACDSTCK-LBPRGKRZSA-N 1 1 340.811 2.253 20 5 EEBDMO O=[N+]([O-])c1cnc(NC[C@H]2C[N@H+]3CCC[C@H]3CO2)c(C(F)(F)F)c1 ZINC000840252609 782457530 /nfs/dbraw/zinc/45/75/30/782457530.db2.gz XSUJRRTZDHHLOJ-ONGXEEELSA-N 1 1 346.309 2.284 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NC[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001091380502 790513056 /nfs/dbraw/zinc/51/30/56/790513056.db2.gz XDGMVJILGYSIPG-BETUJISGSA-N 1 1 349.435 2.027 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CC1CC3(CCC3)C1)C2 ZINC000981764521 778160483 /nfs/dbraw/zinc/16/04/83/778160483.db2.gz SAEXSDWFAJVFSB-HZPDHXFCSA-N 1 1 347.459 2.156 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@H+](CC1CC3(CCC3)C1)C2 ZINC000981764521 778160486 /nfs/dbraw/zinc/16/04/86/778160486.db2.gz SAEXSDWFAJVFSB-HZPDHXFCSA-N 1 1 347.459 2.156 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CC1CC3(CCC3)C1)C2 ZINC000981764521 778160488 /nfs/dbraw/zinc/16/04/88/778160488.db2.gz SAEXSDWFAJVFSB-HZPDHXFCSA-N 1 1 347.459 2.156 20 5 EEBDMO Cc1ccc(C)c(C[NH2+]CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC000997770384 791031818 /nfs/dbraw/zinc/03/18/18/791031818.db2.gz WGKJSFAISDBLGB-QZTJIDSGSA-N 1 1 345.443 2.297 20 5 EEBDMO Cc1ccccc1C[NH+]1CC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2 ZINC001035704750 784984764 /nfs/dbraw/zinc/98/47/64/784984764.db2.gz WLIOQZMIWLSUQB-IAGOWNOFSA-N 1 1 343.427 2.085 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)NC/C=C\CNc1ccc([N+](=O)[O-])c(C)c1 ZINC001107200584 786371013 /nfs/dbraw/zinc/37/10/13/786371013.db2.gz PNRRACDOXUDTSG-ARJAWSKDSA-N 1 1 343.387 2.193 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]Cc2ccc(C3CC3)cc2)CC1 ZINC000996428394 786394040 /nfs/dbraw/zinc/39/40/40/786394040.db2.gz AYAUISRYLQKXIO-QZTJIDSGSA-N 1 1 343.427 2.310 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NC/C=C\CNc1ccc([N+](=O)[O-])c(C)n1 ZINC001107275085 786719987 /nfs/dbraw/zinc/71/99/87/786719987.db2.gz OFDLXZSJUGFFKL-WAYWQWQTSA-N 1 1 349.435 2.114 20 5 EEBDMO C[N@@H+](CC(=O)NC/C=C/CNc1ccc([N+](=O)[O-])cn1)CC(C)(C)C ZINC001107513890 787470872 /nfs/dbraw/zinc/47/08/72/787470872.db2.gz QCASRNKOBRAAAR-AATRIKPKSA-N 1 1 349.435 2.052 20 5 EEBDMO O=C1NCC[C@]12CC[N@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172905757 797131805 /nfs/dbraw/zinc/13/18/05/797131805.db2.gz UCTWQHDQTHLAFI-MAUKXSAKSA-N 1 1 329.400 2.054 20 5 EEBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(C(=O)C2CCC2)CC1 ZINC001173234836 797313788 /nfs/dbraw/zinc/31/37/88/797313788.db2.gz UIAMNIUCIJBYSS-AWEZNQCLSA-N 1 1 331.416 2.470 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N1CCC(Nc2cc(C)c([N+](=O)[O-])cn2)CC1 ZINC001095233601 797565055 /nfs/dbraw/zinc/56/50/55/797565055.db2.gz FRAPJOQUJPNKPL-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO CC(C)(C)OC(=O)N1C[C@@H]2CC[N@@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)[C@@H]2C1 ZINC001169011072 803570802 /nfs/dbraw/zinc/57/08/02/803570802.db2.gz IBSACRGAGJDCHJ-CBBWQLFWSA-N 1 1 339.436 2.373 20 5 EEBDMO CC(C)(C)OC(=O)N[C@@H]1CC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C[C@@H]1F ZINC001169036463 803579990 /nfs/dbraw/zinc/57/99/90/803579990.db2.gz OPMUKKRTJOYEBY-RFQIPJPRSA-N 1 1 345.415 2.369 20 5 EEBDMO CN1c2ccccc2[C@@]2(CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)C1=O ZINC001169023209 803589260 /nfs/dbraw/zinc/58/92/60/803589260.db2.gz DMNNNLLLSGJGBN-GLJUWKHASA-N 1 1 329.400 2.052 20 5 EEBDMO CC(C)(C)OC(=O)CC[C@@H]1COCC[N@@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169052531 803595668 /nfs/dbraw/zinc/59/56/68/803595668.db2.gz GXWPZUYCZDFAGD-RRFJBIMHSA-N 1 1 342.436 2.255 20 5 EEBDMO CC(C)(C)OC(=O)CC[C@@H]1COCC[N@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169052531 803595673 /nfs/dbraw/zinc/59/56/73/803595673.db2.gz GXWPZUYCZDFAGD-RRFJBIMHSA-N 1 1 342.436 2.255 20 5 EEBDMO CC(C)N1CC[NH+](CCCOC(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000787569334 807155206 /nfs/dbraw/zinc/15/52/06/807155206.db2.gz ANSNGNIPSWLVPV-UHFFFAOYSA-N 1 1 341.433 2.229 20 5 EEBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]2CN2CCOCC2)cc1 ZINC000174026590 231103438 /nfs/dbraw/zinc/10/34/38/231103438.db2.gz VXDWSPHWPXRHMY-KRWDZBQOSA-N 1 1 349.431 2.160 20 5 EEBDMO CC[C@]1(CO)CCC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000187592243 529424154 /nfs/dbraw/zinc/42/41/54/529424154.db2.gz AEOXHGHKTNZCLZ-KRWDZBQOSA-N 1 1 335.404 2.326 20 5 EEBDMO CC[C@]1(CO)CCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000187592243 529424155 /nfs/dbraw/zinc/42/41/55/529424155.db2.gz AEOXHGHKTNZCLZ-KRWDZBQOSA-N 1 1 335.404 2.326 20 5 EEBDMO C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC1(O)CCCCCC1 ZINC000187347708 529983953 /nfs/dbraw/zinc/98/39/53/529983953.db2.gz VONDBUUFNGXFFX-UHFFFAOYSA-N 1 1 335.404 2.211 20 5 EEBDMO COCc1cc([N+](=O)[O-])ccc1N(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000193738767 240289065 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FIDYBXIYSCORBS-UHFFFAOYSA-N 1 1 343.431 2.217 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC2(C1)CCOCC2 ZINC000266607923 248380734 /nfs/dbraw/zinc/38/07/34/248380734.db2.gz GQVHIPAMVHTVHQ-CYBMUJFWSA-N 1 1 333.388 2.424 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2n[nH]cc2C1 ZINC000118853256 221196914 /nfs/dbraw/zinc/19/69/14/221196914.db2.gz KBEWRQNRTUIGSZ-UHFFFAOYSA-N 1 1 329.360 2.013 20 5 EEBDMO CCO[C@@H]1C[C@@H](O)C12CC[NH+](Cc1ccc([N+](=O)[O-])c(F)c1)CC2 ZINC000276330269 256422828 /nfs/dbraw/zinc/42/28/28/256422828.db2.gz QXXCUCDQRIQTGU-HZPDHXFCSA-N 1 1 338.379 2.486 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCOCC2(CCOCC2)C1 ZINC000184063325 286384125 /nfs/dbraw/zinc/38/41/25/286384125.db2.gz SJRCMXGBVZJSDV-UHFFFAOYSA-N 1 1 336.388 2.232 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCOCC2(CCOCC2)C1 ZINC000184063325 286384126 /nfs/dbraw/zinc/38/41/26/286384126.db2.gz SJRCMXGBVZJSDV-UHFFFAOYSA-N 1 1 336.388 2.232 20 5 EEBDMO COC(=O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000249149500 160375442 /nfs/dbraw/zinc/37/54/42/160375442.db2.gz XKPKQKNQYDGRSU-QWHCGFSZSA-N 1 1 349.387 2.054 20 5 EEBDMO CN(C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ncc([N+](=O)[O-])s1 ZINC000192541309 160171190 /nfs/dbraw/zinc/17/11/90/160171190.db2.gz FDDAHVCAPCSRAR-MRXNPFEDSA-N 1 1 348.428 2.125 20 5 EEBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1 ZINC000192529327 160171276 /nfs/dbraw/zinc/17/12/76/160171276.db2.gz VWDDMWADOVMCID-OAGGEKHMSA-N 1 1 331.416 2.184 20 5 EEBDMO COc1ccc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)cc1[N+](=O)[O-] ZINC000246743600 160292434 /nfs/dbraw/zinc/29/24/34/160292434.db2.gz HBOPLMMANKZYHT-KBPBESRZSA-N 1 1 333.388 2.160 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C[N@H+]1Cc1ccccc1 ZINC000342380756 161061039 /nfs/dbraw/zinc/06/10/39/161061039.db2.gz KCMNZKRZMZXMQP-TZMCWYRMSA-N 1 1 328.372 2.316 20 5 EEBDMO C[C@@H]1[C@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CCC[N@H+]1C ZINC000343427231 161134907 /nfs/dbraw/zinc/13/49/07/161134907.db2.gz DWIFRNMKKVXNNQ-MWLCHTKSSA-N 1 1 343.330 2.409 20 5 EEBDMO CC[N@@H+](C[C@H]1CCCO1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000343629346 161152895 /nfs/dbraw/zinc/15/28/95/161152895.db2.gz UAMZDKPVQBDWHU-CVEARBPZSA-N 1 1 333.388 2.201 20 5 EEBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCN1CCC(O)CC1 ZINC000344832970 161249483 /nfs/dbraw/zinc/24/94/83/161249483.db2.gz OLYWXENYKPRKLK-QINSGFPZSA-N 1 1 333.432 2.435 20 5 EEBDMO COC(=O)[C@@H]1CC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@H]1C ZINC000346614649 161386121 /nfs/dbraw/zinc/38/61/21/161386121.db2.gz IGOSAIATZRQBOV-GXSJLCMTSA-N 1 1 326.324 2.126 20 5 EEBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@H]1C ZINC000346614649 161386122 /nfs/dbraw/zinc/38/61/22/161386122.db2.gz IGOSAIATZRQBOV-GXSJLCMTSA-N 1 1 326.324 2.126 20 5 EEBDMO Cc1cc(NCC[N@H+](C)C2CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000352429750 162133270 /nfs/dbraw/zinc/13/32/70/162133270.db2.gz BGKCSZUFKBOZAZ-UHFFFAOYSA-N 1 1 327.388 2.288 20 5 EEBDMO Cc1ccnc(NC[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000355723625 163281895 /nfs/dbraw/zinc/28/18/95/163281895.db2.gz UAQNSQJEUNYTIS-SFHVURJKSA-N 1 1 342.399 2.347 20 5 EEBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@H+](Cc4ccon4)CC3)nc2c1 ZINC000274797997 269054360 /nfs/dbraw/zinc/05/43/60/269054360.db2.gz DRVYTOWFVDEOCM-UHFFFAOYSA-N 1 1 342.359 2.171 20 5 EEBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](Cc4ccon4)CC3)nc2c1 ZINC000274797997 269054361 /nfs/dbraw/zinc/05/43/61/269054361.db2.gz DRVYTOWFVDEOCM-UHFFFAOYSA-N 1 1 342.359 2.171 20 5 EEBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1CCOc1ccccc1[N+](=O)[O-] ZINC000278655668 269239976 /nfs/dbraw/zinc/23/99/76/269239976.db2.gz MURHJKPRDWPPSL-OAHLLOKOSA-N 1 1 349.431 2.159 20 5 EEBDMO C[N@@H+](CCCCCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000279725666 269302362 /nfs/dbraw/zinc/30/23/62/269302362.db2.gz MJUBBMWDCRRZHW-UHFFFAOYSA-N 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O=C(NCC(F)(F)F)[C@@H]1CC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000275099835 274222299 /nfs/dbraw/zinc/22/22/99/274222299.db2.gz KOBUDJINIXOPIM-SECBINFHSA-N 1 1 337.323 2.157 20 5 EEBDMO O=[N+]([O-])c1cc(Br)cnc1N1CC[NH+](C2CCC2)CC1 ZINC000268452548 275032873 /nfs/dbraw/zinc/03/28/73/275032873.db2.gz BEMLITZDUBPWAH-UHFFFAOYSA-N 1 1 341.209 2.427 20 5 EEBDMO O=[N+]([O-])c1cnc(N2CCN(c3[nH]cc[nH+]3)CC2)c(C(F)(F)F)c1 ZINC000413265688 275041043 /nfs/dbraw/zinc/04/10/43/275041043.db2.gz NOFYUYVNPHPHLF-UHFFFAOYSA-N 1 1 342.281 2.058 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(N(C)CC[C@H]2CCCC[N@H+]2C)n1 ZINC000288469166 275061530 /nfs/dbraw/zinc/06/15/30/275061530.db2.gz QHYRCAATEBVFQN-GFCCVEGCSA-N 1 1 336.392 2.087 20 5 EEBDMO COCCOCC[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000289053138 275097314 /nfs/dbraw/zinc/09/73/14/275097314.db2.gz QMRMDCFKYPFHOM-UHFFFAOYSA-N 1 1 349.387 2.387 20 5 EEBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)C[C@@H](C)OC ZINC000291167527 275277575 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Cc1ccc(C)c([C@@H](C)[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1 ZINC000441273197 315177526 /nfs/dbraw/zinc/17/75/26/315177526.db2.gz BZNVMYXOOYWXEZ-GDBMZVCRSA-N 1 1 332.404 2.462 20 5 EEBDMO CCN1CCN(C[C@H](C)C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449130806 315421057 /nfs/dbraw/zinc/42/10/57/315421057.db2.gz HWXNUVGUOSDLDU-SJORKVTESA-N 1 1 348.491 2.389 20 5 EEBDMO CNc1nc(C(=O)N2CCC(C[N@@H+](C)C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000564417741 319083608 /nfs/dbraw/zinc/08/36/08/319083608.db2.gz HFSJAWLMDIBIPX-UHFFFAOYSA-N 1 1 349.435 2.224 20 5 EEBDMO COc1cc(C(=O)N[C@H](C)C[N@@H+](C)C(C)C)c([N+](=O)[O-])cc1F ZINC000296215389 465119091 /nfs/dbraw/zinc/11/90/91/465119091.db2.gz VWWNUGQTPHUBOT-SNVBAGLBSA-N 1 1 327.356 2.201 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)C1 ZINC000339428707 465266684 /nfs/dbraw/zinc/26/66/84/465266684.db2.gz UZSVXZJGNVNMBK-KRWDZBQOSA-N 1 1 329.404 2.389 20 5 EEBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@H]1CCC[N@H+]1C ZINC000358698689 465271625 /nfs/dbraw/zinc/27/16/25/465271625.db2.gz MBDLZUDOKBKFNR-CMPLNLGQSA-N 1 1 341.795 2.226 20 5 EEBDMO CN1CCC[C@@]2(CC[N@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000339440247 465275598 /nfs/dbraw/zinc/27/55/98/465275598.db2.gz PGGZFCZSEUWJKI-GOSISDBHSA-N 1 1 346.431 2.341 20 5 EEBDMO CN1CCC[C@@]2(CC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000339440247 465275600 /nfs/dbraw/zinc/27/56/00/465275600.db2.gz PGGZFCZSEUWJKI-GOSISDBHSA-N 1 1 346.431 2.341 20 5 EEBDMO Cc1cc(C(=O)N2CCC([N@@H+]3CCOC[C@@H]3C)CC2)cc([N+](=O)[O-])c1 ZINC000590554801 468271442 /nfs/dbraw/zinc/27/14/42/468271442.db2.gz FJOVZMMKLQBDHN-AWEZNQCLSA-N 1 1 347.415 2.229 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC([N@@H+]2CCOC[C@@H]2C)CC1 ZINC000590555985 468273115 /nfs/dbraw/zinc/27/31/15/468273115.db2.gz VZUUMPRECBEHBD-AWEZNQCLSA-N 1 1 347.415 2.229 20 5 EEBDMO COc1ccc(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000074326696 462587100 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333.388 2.160 20 5 EEBDMO CC(C)[N@@H+]1C[C@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)[C@@H](C)C1 ZINC000132471300 462858432 /nfs/dbraw/zinc/85/84/32/462858432.db2.gz VYZTXJLXDYGFMP-GUYCJALGSA-N 1 1 346.431 2.391 20 5 EEBDMO COC(=O)[C@@H]1CCC[C@@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000590752949 468326934 /nfs/dbraw/zinc/32/69/34/468326934.db2.gz BTHBGVGACUBZBG-OLZOCXBDSA-N 1 1 346.343 2.076 20 5 EEBDMO Cc1c(CC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)cccc1[N+](=O)[O-] ZINC000133653022 462955661 /nfs/dbraw/zinc/95/56/61/462955661.db2.gz FIJMYIUHYLETNY-DOTOQJQBSA-N 1 1 331.416 2.388 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000134016137 462995499 /nfs/dbraw/zinc/99/54/99/462995499.db2.gz MPDCTGYFURIQBA-OCCSQVGLSA-N 1 1 343.387 2.101 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000134016137 462995501 /nfs/dbraw/zinc/99/55/01/462995501.db2.gz MPDCTGYFURIQBA-OCCSQVGLSA-N 1 1 343.387 2.101 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000134016137 462995504 /nfs/dbraw/zinc/99/55/04/462995504.db2.gz MPDCTGYFURIQBA-OCCSQVGLSA-N 1 1 343.387 2.101 20 5 EEBDMO CC(=O)NC[C@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000067412401 463003140 /nfs/dbraw/zinc/00/31/40/463003140.db2.gz KGEYEBLGJKLGHT-OAHLLOKOSA-N 1 1 335.404 2.212 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCOc3ccccc3)CC2)nc1 ZINC000022805316 463056160 /nfs/dbraw/zinc/05/61/60/463056160.db2.gz UQLHDCNTGVUHKP-UHFFFAOYSA-N 1 1 328.372 2.191 20 5 EEBDMO CC(C)[N@H+]1CCCN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC1 ZINC000068781368 463174725 /nfs/dbraw/zinc/17/47/25/463174725.db2.gz GINLWYZKPPDWEA-UHFFFAOYSA-N 1 1 334.420 2.340 20 5 EEBDMO CN(CC[C@H]1CCCC[N@H+]1C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000072725291 463540294 /nfs/dbraw/zinc/54/02/94/463540294.db2.gz JLCDTNFFONLFSI-OAHLLOKOSA-N 1 1 348.447 2.364 20 5 EEBDMO C[C@@H](O)[C@H]1CCCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000106862965 463542948 /nfs/dbraw/zinc/54/29/48/463542948.db2.gz WPPQZVGALGLZJZ-BXUZGUMPSA-N 1 1 332.360 2.380 20 5 EEBDMO C[C@@H](O)[C@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000106862965 463542953 /nfs/dbraw/zinc/54/29/53/463542953.db2.gz WPPQZVGALGLZJZ-BXUZGUMPSA-N 1 1 332.360 2.380 20 5 EEBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000579540403 468371145 /nfs/dbraw/zinc/37/11/45/468371145.db2.gz SNOQFQICIAHGGF-ZDUSSCGKSA-N 1 1 337.420 2.383 20 5 EEBDMO COC(=O)[C@@]1(C)CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000177449589 463708136 /nfs/dbraw/zinc/70/81/36/463708136.db2.gz KNVVRAUNMFGACQ-KRWDZBQOSA-N 1 1 349.387 2.117 20 5 EEBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000177553412 463735549 /nfs/dbraw/zinc/73/55/49/463735549.db2.gz WOROAJSMFKRHCM-RRQGHBQHSA-N 1 1 330.388 2.030 20 5 EEBDMO O=[N+]([O-])c1cccc(N2CC[NH+](CCO[C@@H]3CCCCO3)CC2)c1 ZINC000185182568 463771225 /nfs/dbraw/zinc/77/12/25/463771225.db2.gz JCPWUBFASZHVHD-QGZVFWFLSA-N 1 1 335.404 2.260 20 5 EEBDMO COC(=O)CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C ZINC000283246192 463818196 /nfs/dbraw/zinc/81/81/96/463818196.db2.gz JPJOQXARRHAQAE-UHFFFAOYSA-N 1 1 337.376 2.197 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)c1 ZINC000283571280 463928438 /nfs/dbraw/zinc/92/84/38/463928438.db2.gz VQCGOTRDOXJEPA-GFCCVEGCSA-N 1 1 333.388 2.208 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000179194272 464079046 /nfs/dbraw/zinc/07/90/46/464079046.db2.gz UUIBZCHOEKUWKR-UHFFFAOYSA-N 1 1 341.367 2.251 20 5 EEBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C2CC2)O1 ZINC000279410782 464100516 /nfs/dbraw/zinc/10/05/16/464100516.db2.gz VVPKWGFEFKVODX-LRDDRELGSA-N 1 1 333.388 2.423 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000172802682 464147061 /nfs/dbraw/zinc/14/70/61/464147061.db2.gz DWAOXYSIRGHJOZ-XJKSGUPXSA-N 1 1 332.404 2.092 20 5 EEBDMO C[N@H+]1CC[C@@H]2OCCN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)[C@H]2C1 ZINC000284447983 464195911 /nfs/dbraw/zinc/19/59/11/464195911.db2.gz CJJDYZBAPFFZPV-STQMWFEESA-N 1 1 343.330 2.106 20 5 EEBDMO COc1cc(C[N@H+](CCO)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179932461 464210221 /nfs/dbraw/zinc/21/02/21/464210221.db2.gz SHQGNHNWEHFTRW-UHFFFAOYSA-N 1 1 346.330 2.204 20 5 EEBDMO COc1cc(C[N@@H+](CCO)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179932461 464210228 /nfs/dbraw/zinc/21/02/28/464210228.db2.gz SHQGNHNWEHFTRW-UHFFFAOYSA-N 1 1 346.330 2.204 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[C@@H](C[NH+](CC)CC)C2)c1[N+](=O)[O-] ZINC000173563229 464284541 /nfs/dbraw/zinc/28/45/41/464284541.db2.gz DIMFQMDDDIZZDB-LBPRGKRZSA-N 1 1 337.424 2.074 20 5 EEBDMO O=C1N[C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C[C@@H]2CO1 ZINC000281260752 464390898 /nfs/dbraw/zinc/39/08/98/464390898.db2.gz NBZNVVPSNPYOJQ-MFKMUULPSA-N 1 1 325.752 2.179 20 5 EEBDMO O=C1N[C@H]2CC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C[C@@H]2CO1 ZINC000281260752 464390903 /nfs/dbraw/zinc/39/09/03/464390903.db2.gz NBZNVVPSNPYOJQ-MFKMUULPSA-N 1 1 325.752 2.179 20 5 EEBDMO C[C@@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C[NH+]1CCOCC1 ZINC000265758997 464675983 /nfs/dbraw/zinc/67/59/83/464675983.db2.gz YPGMBOHJMQLYKJ-LBPRGKRZSA-N 1 1 347.371 2.039 20 5 EEBDMO COc1cc(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1F ZINC000295170194 464731252 /nfs/dbraw/zinc/73/12/52/464731252.db2.gz RPPITLUZRLEWNY-NXEZZACHSA-N 1 1 337.351 2.098 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](N2CCOCC2)C[C@H]1C ZINC000285895584 464734171 /nfs/dbraw/zinc/73/41/71/464734171.db2.gz KDEYTRZDLYAKGK-RHSMWYFYSA-N 1 1 349.431 2.289 20 5 EEBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+]C[C@](C)(F)C1 ZINC000295315054 464784879 /nfs/dbraw/zinc/78/48/79/464784879.db2.gz WKAFHGHBTMODGU-ABAIWWIYSA-N 1 1 341.408 2.235 20 5 EEBDMO Cc1cc(NC(=O)[C@@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)on1 ZINC000282555956 464863612 /nfs/dbraw/zinc/86/36/12/464863612.db2.gz XSIQYOPTXHQPNT-GFCCVEGCSA-N 1 1 332.360 2.393 20 5 EEBDMO Cc1cc(NC(=O)[C@@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)on1 ZINC000282555956 464863615 /nfs/dbraw/zinc/86/36/15/464863615.db2.gz XSIQYOPTXHQPNT-GFCCVEGCSA-N 1 1 332.360 2.393 20 5 EEBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000282618364 464886663 /nfs/dbraw/zinc/88/66/63/464886663.db2.gz ZPDORDUXIWUMMV-LBPRGKRZSA-N 1 1 325.384 2.011 20 5 EEBDMO COCC[NH+]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000266980319 464892981 /nfs/dbraw/zinc/89/29/81/464892981.db2.gz PPJLYUPGFDBMPM-UHFFFAOYSA-N 1 1 333.310 2.382 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000177067082 464921970 /nfs/dbraw/zinc/92/19/70/464921970.db2.gz MBRCVYNWRXGXTM-OLZOCXBDSA-N 1 1 333.388 2.105 20 5 EEBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](C(F)(F)F)[C@@H](CO)C1 ZINC000286659496 464995470 /nfs/dbraw/zinc/99/54/70/464995470.db2.gz UNLWAOKSFIHRBZ-NEPJUHHUSA-N 1 1 348.321 2.466 20 5 EEBDMO CCOC1CC([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000286667483 464999414 /nfs/dbraw/zinc/99/94/14/464999414.db2.gz BGQJKLBMVQQLHB-UHFFFAOYSA-N 1 1 337.376 2.041 20 5 EEBDMO CCOC1CC([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000286667483 464999421 /nfs/dbraw/zinc/99/94/21/464999421.db2.gz BGQJKLBMVQQLHB-UHFFFAOYSA-N 1 1 337.376 2.041 20 5 EEBDMO Cc1c(CN(C)CC[N@@H+](C)C2CCN(C)CC2)cccc1[N+](=O)[O-] ZINC000177381316 465001004 /nfs/dbraw/zinc/00/10/04/465001004.db2.gz PIIPROORTTUNKU-UHFFFAOYSA-N 1 1 334.464 2.361 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000268273688 465002157 /nfs/dbraw/zinc/00/21/57/465002157.db2.gz VTZLOWZWIKBUAL-WBMJQRKESA-N 1 1 331.416 2.471 20 5 EEBDMO CC[C@H](C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)OC ZINC000337450155 465376136 /nfs/dbraw/zinc/37/61/36/465376136.db2.gz FBJUIOXWHCTEIU-LBPRGKRZSA-N 1 1 337.376 2.197 20 5 EEBDMO C[C@@H]1C[N@H+](CCCNc2nc3ccccc3cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000352350717 465519870 /nfs/dbraw/zinc/51/98/70/465519870.db2.gz PIOCDQQBVJZKBI-OKILXGFUSA-N 1 1 344.415 3.054 20 5 EEBDMO CCN1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ncc[nH]1 ZINC000348366855 465569220 /nfs/dbraw/zinc/56/92/20/465569220.db2.gz JCTYBTWHGSXYKJ-MRXNPFEDSA-N 1 1 345.403 2.076 20 5 EEBDMO CCN1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ncc[nH]1 ZINC000348366855 465569225 /nfs/dbraw/zinc/56/92/25/465569225.db2.gz JCTYBTWHGSXYKJ-MRXNPFEDSA-N 1 1 345.403 2.076 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1 ZINC000299223651 465654148 /nfs/dbraw/zinc/65/41/48/465654148.db2.gz ONUXGASVHANPGU-CHWSQXEVSA-N 1 1 335.404 2.454 20 5 EEBDMO Cn1cc(C[N@@H+](C)[C@H]2CCC[C@@H]2O)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000348545743 465673940 /nfs/dbraw/zinc/67/39/40/465673940.db2.gz LGMMYFRZWXHDMQ-HOTGVXAUSA-N 1 1 330.388 2.341 20 5 EEBDMO C[C@@H]1C[NH+](C[C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000299277735 465679545 /nfs/dbraw/zinc/67/95/45/465679545.db2.gz ARGKPVWMDHOVOP-CKEIUWERSA-N 1 1 347.415 2.309 20 5 EEBDMO Cc1c(NC(=O)CCN2C[C@H](C)[N@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000330597785 465725037 /nfs/dbraw/zinc/72/50/37/465725037.db2.gz SNOIAUKCNWGAGI-STQMWFEESA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)N(C)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000330597785 465725042 /nfs/dbraw/zinc/72/50/42/465725042.db2.gz SNOIAUKCNWGAGI-STQMWFEESA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)N(C)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000330597785 465725047 /nfs/dbraw/zinc/72/50/47/465725047.db2.gz SNOIAUKCNWGAGI-STQMWFEESA-N 1 1 334.420 2.256 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000330602357 465726158 /nfs/dbraw/zinc/72/61/58/465726158.db2.gz WMGCVQPAINMGLN-WDEREUQCSA-N 1 1 340.811 2.211 20 5 EEBDMO C[NH+](C)[C@H](CNC(=O)c1cc([N+](=O)[O-])n[nH]1)c1ccccc1Cl ZINC000348660827 465733928 /nfs/dbraw/zinc/73/39/28/465733928.db2.gz LRDCUCYXNVXPAI-GFCCVEGCSA-N 1 1 337.767 2.004 20 5 EEBDMO C[C@@H]1C[C@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000361064256 465740010 /nfs/dbraw/zinc/74/00/10/465740010.db2.gz BQSLFIOXFLGCBW-BXUZGUMPSA-N 1 1 332.404 2.382 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000330871750 465839450 /nfs/dbraw/zinc/83/94/50/465839450.db2.gz RFTNUXQUXAFJAV-YOEHRIQHSA-N 1 1 348.447 2.362 20 5 EEBDMO Cc1ccc(S(=O)(=O)N[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000331026938 465904279 /nfs/dbraw/zinc/90/42/79/465904279.db2.gz BWPBFDPOEMMYIW-ZDUSSCGKSA-N 1 1 341.433 2.054 20 5 EEBDMO Cn1ccnc1[C@H](N[C@@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000353514462 465946033 /nfs/dbraw/zinc/94/60/33/465946033.db2.gz GYRGJKLVXUSXIX-RHSMWYFYSA-N 1 1 341.415 2.244 20 5 EEBDMO C[N@H+]1CCO[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C[C@H]21 ZINC000301668821 466006747 /nfs/dbraw/zinc/00/67/47/466006747.db2.gz PNSZIGPGNHEQDH-CHWSQXEVSA-N 1 1 331.294 2.133 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](C)C[C@H]1[C@@H](C)O ZINC000331306840 466023174 /nfs/dbraw/zinc/02/31/74/466023174.db2.gz ZTMARBTWMXYNBT-LNSITVRQSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](C)C[C@H]1[C@@H](C)O ZINC000331306840 466023183 /nfs/dbraw/zinc/02/31/83/466023183.db2.gz ZTMARBTWMXYNBT-LNSITVRQSA-N 1 1 335.404 2.323 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000346244062 466023554 /nfs/dbraw/zinc/02/35/54/466023554.db2.gz ULTBTOXDPACRSE-WOSRLPQWSA-N 1 1 347.415 2.406 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)c1 ZINC000338521925 466191537 /nfs/dbraw/zinc/19/15/37/466191537.db2.gz AYFNHOSPBBKINE-CYBMUJFWSA-N 1 1 333.388 2.302 20 5 EEBDMO O=C(CC[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000372159254 466193411 /nfs/dbraw/zinc/19/34/11/466193411.db2.gz ZENIBFUMRXXPKN-ZIAGYGMSSA-N 1 1 333.388 2.282 20 5 EEBDMO O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[N@@H+](CC2CCC2)CC1 ZINC000555529705 468480720 /nfs/dbraw/zinc/48/07/20/468480720.db2.gz PPCCMQDVTWLZRE-UHFFFAOYSA-N 1 1 346.431 2.341 20 5 EEBDMO C[C@]1(O)CCOC[C@@H]1[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000331836107 466264869 /nfs/dbraw/zinc/26/48/69/466264869.db2.gz BWPRFPPFKBCCBF-OIISXLGYSA-N 1 1 338.379 2.486 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1C(C)(C)O ZINC000305429766 466407406 /nfs/dbraw/zinc/40/74/06/466407406.db2.gz DIZRYZPUVVOIGZ-HNNXBMFYSA-N 1 1 335.404 2.467 20 5 EEBDMO C[N@@H+](C[C@@H]1CCCC[C@H]1O)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000305786444 466465008 /nfs/dbraw/zinc/46/50/08/466465008.db2.gz BCTLVVMEWNKJCU-IAOVAPTHSA-N 1 1 347.415 2.183 20 5 EEBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H]1CC[N@@H+](C)C1 ZINC000347226065 466492058 /nfs/dbraw/zinc/49/20/58/466492058.db2.gz DGNKPQWQHRCAKK-MNOVXSKESA-N 1 1 341.795 2.083 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCc3c(cnn3-c3ccccc3)C2)c1 ZINC000350682466 466575969 /nfs/dbraw/zinc/57/59/69/466575969.db2.gz CBXKUWDWAKKCKE-UHFFFAOYSA-N 1 1 338.371 2.035 20 5 EEBDMO CS(=O)(=O)c1cccc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-] ZINC000322579907 466633275 /nfs/dbraw/zinc/63/32/75/466633275.db2.gz RPPBVTNWXBQQRV-NEPJUHHUSA-N 1 1 339.417 2.037 20 5 EEBDMO C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000427900150 467184788 /nfs/dbraw/zinc/18/47/88/467184788.db2.gz GRZKYWSLNFQLHM-CHWSQXEVSA-N 1 1 335.404 2.398 20 5 EEBDMO C[C@@H]1[C@H]([NH+]2CCOCC2)CCN1c1nccc2ccc([N+](=O)[O-])cc21 ZINC000413315616 467214586 /nfs/dbraw/zinc/21/45/86/467214586.db2.gz VTAWFOGYYUJMSA-CXAGYDPISA-N 1 1 342.399 2.442 20 5 EEBDMO Cc1ccc(CN2CCN([C@H]3CCC[N@H+](C)C3)CC2)cc1[N+](=O)[O-] ZINC000378354978 467276622 /nfs/dbraw/zinc/27/66/22/467276622.db2.gz MGDAFDJCFAVDEP-KRWDZBQOSA-N 1 1 332.448 2.115 20 5 EEBDMO COc1cc(C[N@@H+](CCO)[C@H]2CCCSC2)ccc1[N+](=O)[O-] ZINC000433197707 467305260 /nfs/dbraw/zinc/30/52/60/467305260.db2.gz UDNMJRHCHFJABV-ZDUSSCGKSA-N 1 1 326.418 2.293 20 5 EEBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](n2cc(C[NH3+])nn2)C1 ZINC000420376156 467384564 /nfs/dbraw/zinc/38/45/64/467384564.db2.gz JQGKKHTWIRWRKD-OCCSQVGLSA-N 1 1 330.392 2.043 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1[C@H](O)C(F)(F)F ZINC000430230083 467409938 /nfs/dbraw/zinc/40/99/38/467409938.db2.gz ZSLCIEQXPDSPJV-YPMHNXCESA-N 1 1 334.294 2.491 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1[C@H](O)C(F)(F)F ZINC000430230083 467409942 /nfs/dbraw/zinc/40/99/42/467409942.db2.gz ZSLCIEQXPDSPJV-YPMHNXCESA-N 1 1 334.294 2.491 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H]1CCC[N@H+]1CCCO ZINC000452778401 467422877 /nfs/dbraw/zinc/42/28/77/467422877.db2.gz DQMIANQLDFJBGM-HNNXBMFYSA-N 1 1 349.431 2.097 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1C[C@@H](C2CC2)[C@@H]1C1CC1 ZINC000453047021 467457371 /nfs/dbraw/zinc/45/73/71/467457371.db2.gz YXKCIWDRQHJJDH-VKJFTORMSA-N 1 1 332.400 2.455 20 5 EEBDMO COC(=O)Cc1ccc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000450253485 467809888 /nfs/dbraw/zinc/80/98/88/467809888.db2.gz OIWCMJXWAWVBCX-KBPBESRZSA-N 1 1 333.388 2.349 20 5 EEBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)NCc1cccc([N+](=O)[O-])c1C)CC2 ZINC000518544890 468119665 /nfs/dbraw/zinc/11/96/65/468119665.db2.gz NOBHNSIZKQBSEH-AWEZNQCLSA-N 1 1 328.372 2.287 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000518747445 468125070 /nfs/dbraw/zinc/12/50/70/468125070.db2.gz OVDVGLKIFINHLL-LBPRGKRZSA-N 1 1 349.387 2.318 20 5 EEBDMO Cc1cc(OCC(=O)NC[C@H]2CC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000569998486 468575489 /nfs/dbraw/zinc/57/54/89/468575489.db2.gz HDLXOQGZYDBRKA-CQSZACIVSA-N 1 1 335.404 2.129 20 5 EEBDMO CCCN(C(=O)NCCc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000591968839 468586339 /nfs/dbraw/zinc/58/63/39/468586339.db2.gz GXTOWSUNUAKQSW-OAHLLOKOSA-N 1 1 334.420 2.263 20 5 EEBDMO CC(C)NC(=O)c1ccc(N2C[C@H](C)[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000570271325 468613516 /nfs/dbraw/zinc/61/35/16/468613516.db2.gz VFEFYTDWQKHFRG-STQMWFEESA-N 1 1 334.420 2.262 20 5 EEBDMO C[N@H+]1CCC[C@@]2(CCN(c3cc4nc[nH]c(=O)c4cc3[N+](=O)[O-])C2)C1 ZINC000582918000 468617133 /nfs/dbraw/zinc/61/71/33/468617133.db2.gz UXLHMOKTBYBRNT-QGZVFWFLSA-N 1 1 343.387 2.166 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c1 ZINC000597854995 468694548 /nfs/dbraw/zinc/69/45/48/468694548.db2.gz OSLXLMHIPFJVPA-GFCCVEGCSA-N 1 1 335.404 2.454 20 5 EEBDMO CN(CC(=O)N[C@@H]1CC[N@H+](C(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000597924918 468712693 /nfs/dbraw/zinc/71/26/93/468712693.db2.gz VDEWMEMOUQBSDJ-CYBMUJFWSA-N 1 1 334.420 2.020 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000559559175 468745840 /nfs/dbraw/zinc/74/58/40/468745840.db2.gz AMNSSXJXLRHTIO-AWEZNQCLSA-N 1 1 334.420 2.467 20 5 EEBDMO CCC[N@H+]1CC[C@H](N[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000595097591 468758650 /nfs/dbraw/zinc/75/86/50/468758650.db2.gz YUCIFEOVTWFSHO-DOTOQJQBSA-N 1 1 343.431 2.492 20 5 EEBDMO C[C@@H]1C[N@@H+](CCN(C)Cc2ccc(F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000595467935 468864708 /nfs/dbraw/zinc/86/47/08/468864708.db2.gz QWDOMBAJJJTBIU-BETUJISGSA-N 1 1 325.384 2.275 20 5 EEBDMO C[C@@H]1C[N@H+](CCN(C)Cc2ccc(F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000595467935 468864714 /nfs/dbraw/zinc/86/47/14/468864714.db2.gz QWDOMBAJJJTBIU-BETUJISGSA-N 1 1 325.384 2.275 20 5 EEBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCN1CCCCC1 ZINC000593112190 468874799 /nfs/dbraw/zinc/87/47/99/468874799.db2.gz LZDZDVVPYSBTRK-UHFFFAOYSA-N 1 1 334.420 2.341 20 5 EEBDMO C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCN1CCCCC1 ZINC000593112190 468874803 /nfs/dbraw/zinc/87/48/03/468874803.db2.gz LZDZDVVPYSBTRK-UHFFFAOYSA-N 1 1 334.420 2.341 20 5 EEBDMO CCCc1n[nH]c(C(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-] ZINC000598558033 468911696 /nfs/dbraw/zinc/91/16/96/468911696.db2.gz BNJLLXLIJOHOMZ-ZDUSSCGKSA-N 1 1 349.435 2.122 20 5 EEBDMO COC(=O)c1ccnc(NC[C@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-] ZINC000598619089 468936028 /nfs/dbraw/zinc/93/60/28/468936028.db2.gz ABFMCMBZJGDUFM-GFCCVEGCSA-N 1 1 334.376 2.205 20 5 EEBDMO COCCO[C@@H]1C[C@H](CO)C[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000562588003 468998222 /nfs/dbraw/zinc/99/82/22/468998222.db2.gz AOIYQDGSKHUKST-QLFBSQMISA-N 1 1 338.404 2.002 20 5 EEBDMO Cc1[nH+]ccn1CCCCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593485558 469000625 /nfs/dbraw/zinc/00/06/25/469000625.db2.gz YUWOGYZVFNNWHM-UHFFFAOYSA-N 1 1 334.351 2.378 20 5 EEBDMO Cc1nnc(N2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n1C ZINC000602944728 469181903 /nfs/dbraw/zinc/18/19/03/469181903.db2.gz SJXWUUIDOBIWQH-ZDUSSCGKSA-N 1 1 344.419 2.223 20 5 EEBDMO NC(=O)c1cc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000596169049 469183936 /nfs/dbraw/zinc/18/39/36/469183936.db2.gz DHYQJKQAVKDWTN-BLLLJJGKSA-N 1 1 344.415 2.147 20 5 EEBDMO COC(=O)c1cnc(NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000596309307 469239283 /nfs/dbraw/zinc/23/92/83/469239283.db2.gz YEUSDSYHVFVTQN-NSHDSACASA-N 1 1 336.392 2.309 20 5 EEBDMO Cc1ccc(CNC(=O)c2ccc([N+](=O)[O-])n2C)c(N2CCCC2)[nH+]1 ZINC000611572207 469282800 /nfs/dbraw/zinc/28/28/00/469282800.db2.gz NBDICPAUGNVMHV-UHFFFAOYSA-N 1 1 343.387 2.167 20 5 EEBDMO O=[N+]([O-])c1cccc2ncnc(NC[C@H]3CCC[N@@H+](CC4CC4)C3)c21 ZINC000596570682 469303936 /nfs/dbraw/zinc/30/39/36/469303936.db2.gz MOOHLFGEWANLFY-CQSZACIVSA-N 1 1 341.415 3.072 20 5 EEBDMO CC[NH+](CC)Cc1cn(Cc2cc(OC)c(F)cc2[N+](=O)[O-])nn1 ZINC000603237588 469319421 /nfs/dbraw/zinc/31/94/21/469319421.db2.gz JUPCYZSCEUEXBQ-UHFFFAOYSA-N 1 1 337.355 2.224 20 5 EEBDMO COc1ccc(NC(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000611825178 469330332 /nfs/dbraw/zinc/33/03/32/469330332.db2.gz VWOVUSPYVGCKOY-ZDUSSCGKSA-N 1 1 334.376 2.209 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@H]1C[C@@H](O)C1 ZINC000599673744 469334109 /nfs/dbraw/zinc/33/41/09/469334109.db2.gz SGBDZSIGYLCQGR-JBLDHEPKSA-N 1 1 341.795 2.278 20 5 EEBDMO C[C@H]1COCC[N@H+]1C1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000603402103 469378710 /nfs/dbraw/zinc/37/87/10/469378710.db2.gz MLLLHTGLGOQSPC-NSHDSACASA-N 1 1 340.811 2.333 20 5 EEBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000603635597 469420593 /nfs/dbraw/zinc/42/05/93/469420593.db2.gz GIBDKSIVBRKNAD-HNNXBMFYSA-N 1 1 342.399 2.328 20 5 EEBDMO Cc1ccc(NC(=O)NCCCCN2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000609214574 469903028 /nfs/dbraw/zinc/90/30/28/469903028.db2.gz KCTRASDGDJUFDP-UHFFFAOYSA-N 1 1 349.435 2.052 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000534636485 485550304 /nfs/dbraw/zinc/55/03/04/485550304.db2.gz GGWBQDPWCKZPLW-HNNXBMFYSA-N 1 1 334.420 2.167 20 5 EEBDMO CC1(CO)CC[NH+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000186953732 528002390 /nfs/dbraw/zinc/00/23/90/528002390.db2.gz TZUVZIPESVKVHL-UHFFFAOYSA-N 1 1 332.360 2.239 20 5 EEBDMO CCN1CC[NH+](CCC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000177867801 529141365 /nfs/dbraw/zinc/14/13/65/529141365.db2.gz KKCVNQOPVVGLLS-HNNXBMFYSA-N 1 1 348.447 2.108 20 5 EEBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000771401180 577615260 /nfs/dbraw/zinc/61/52/60/577615260.db2.gz AYTMTELOKKGYPE-KBPBESRZSA-N 1 1 346.431 2.360 20 5 EEBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000771401180 577615261 /nfs/dbraw/zinc/61/52/61/577615261.db2.gz AYTMTELOKKGYPE-KBPBESRZSA-N 1 1 346.431 2.360 20 5 EEBDMO O=[N+]([O-])c1c(N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)nc2ccccn21 ZINC000763375480 577720188 /nfs/dbraw/zinc/72/01/88/577720188.db2.gz HCMGRJFQTBCVBR-KGLIPLIRSA-N 1 1 345.403 2.298 20 5 EEBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000752813957 577776659 /nfs/dbraw/zinc/77/66/59/577776659.db2.gz VWBKEXNGIABNEK-KGLIPLIRSA-N 1 1 348.403 2.030 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)cc1[N+](=O)[O-] ZINC000745980588 577920945 /nfs/dbraw/zinc/92/09/45/577920945.db2.gz DIZVUKNGPCTPDO-OLZOCXBDSA-N 1 1 348.359 2.120 20 5 EEBDMO O=C1C[C@@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@@H+]1CCC2(CCC2)C1 ZINC000840024555 782189657 /nfs/dbraw/zinc/18/96/57/782189657.db2.gz VXCLWRCWNINOCD-MRXNPFEDSA-N 1 1 331.372 2.366 20 5 EEBDMO O=C1C[C@@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@H+]1CCC2(CCC2)C1 ZINC000840024555 782189663 /nfs/dbraw/zinc/18/96/63/782189663.db2.gz VXCLWRCWNINOCD-MRXNPFEDSA-N 1 1 331.372 2.366 20 5 EEBDMO O=[N+]([O-])c1ccc2ccnc(NCC[N@@H+]3CCC4(C3)OCCO4)c2c1 ZINC000895252423 684388240 /nfs/dbraw/zinc/38/82/40/684388240.db2.gz IVDSVVUOFJIPAT-UHFFFAOYSA-N 1 1 344.371 2.004 20 5 EEBDMO O=[N+]([O-])c1ccc2ccnc(NCC[N@H+]3CCC4(C3)OCCO4)c2c1 ZINC000895252423 684388246 /nfs/dbraw/zinc/38/82/46/684388246.db2.gz IVDSVVUOFJIPAT-UHFFFAOYSA-N 1 1 344.371 2.004 20 5 EEBDMO Cc1cc(C(=O)NCC2C[NH+](Cc3ccccc3[N+](=O)[O-])C2)ccn1 ZINC001032063618 1192039385 /nfs/dbraw/zinc/03/93/85/1192039385.db2.gz IFEUJVYSJKEFHJ-UHFFFAOYSA-N 1 1 340.383 2.160 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1CN1CCN([C@@H]2CCC[N@H+](C)C2)CC1 ZINC000876714937 1199736070 /nfs/dbraw/zinc/73/60/70/1199736070.db2.gz GQHIKJZYZSHHMN-QGZVFWFLSA-N 1 1 346.475 2.423 20 5 EEBDMO CN(Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCC[N@H+]1C ZINC000878722124 1200639667 /nfs/dbraw/zinc/63/96/67/1200639667.db2.gz AJVYYVCALIQVPI-GFCCVEGCSA-N 1 1 331.376 2.171 20 5 EEBDMO COC(=O)CC[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000880041117 1201360774 /nfs/dbraw/zinc/36/07/74/1201360774.db2.gz HAAGDRHUEWVODF-CZUORRHYSA-N 1 1 336.388 2.293 20 5 EEBDMO COCC[N@@H+]1[C@H](C)CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1C ZINC000129156010 1201733934 /nfs/dbraw/zinc/73/39/34/1201733934.db2.gz MYRVIKIOEZMQFY-BETUJISGSA-N 1 1 348.403 2.277 20 5 EEBDMO CCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000882628472 1201909347 /nfs/dbraw/zinc/90/93/47/1201909347.db2.gz PUIXMASHLIUTMV-ZDUSSCGKSA-N 1 1 332.404 2.383 20 5 EEBDMO COC(=O)C[C@H]1CCC[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777962412 1206609287 /nfs/dbraw/zinc/60/92/87/1206609287.db2.gz CZHGAMPRYFKLBP-OAHLLOKOSA-N 1 1 344.371 2.443 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1 ZINC000931261807 1206620200 /nfs/dbraw/zinc/62/02/00/1206620200.db2.gz GLXYGPLSNJPNKL-TXEJJXNPSA-N 1 1 334.376 2.019 20 5 EEBDMO CC1=CC[N@@H+](CCNC(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CC1 ZINC000935398387 1208146076 /nfs/dbraw/zinc/14/60/76/1208146076.db2.gz KCFVMHYBFJWFJN-IAGOWNOFSA-N 1 1 329.400 2.467 20 5 EEBDMO COc1cc(CN[C@@H]2CC[N@H+](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000779072407 1208491568 /nfs/dbraw/zinc/49/15/68/1208491568.db2.gz KSEMEJKANZRDRY-LLVKDONJSA-N 1 1 345.346 2.041 20 5 EEBDMO COc1cc(CN[C@@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000779072407 1208491569 /nfs/dbraw/zinc/49/15/69/1208491569.db2.gz KSEMEJKANZRDRY-LLVKDONJSA-N 1 1 345.346 2.041 20 5 EEBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H]3COC[C@@H]3C2)ccc1Br ZINC000718172931 1212012054 /nfs/dbraw/zinc/01/20/54/1212012054.db2.gz ITXRFMCHCLHCSM-PHIMTYICSA-N 1 1 327.178 2.436 20 5 EEBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@@H]3COC[C@@H]3C2)ccc1Br ZINC000718172931 1212012057 /nfs/dbraw/zinc/01/20/57/1212012057.db2.gz ITXRFMCHCLHCSM-PHIMTYICSA-N 1 1 327.178 2.436 20 5 EEBDMO Cc1ccc(F)c(C[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001045437441 1233744833 /nfs/dbraw/zinc/74/48/33/1233744833.db2.gz REMXQHNSDOAFPF-GDBMZVCRSA-N 1 1 349.406 2.270 20 5 EEBDMO Cc1ccc(C[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1F ZINC001045437609 1233744881 /nfs/dbraw/zinc/74/48/81/1233744881.db2.gz VFJMJGNYRNBGRT-GDBMZVCRSA-N 1 1 349.406 2.270 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NCCCN(c1ccccc1[N+](=O)[O-])C1CC1 ZINC001096050915 1234089853 /nfs/dbraw/zinc/08/98/53/1234089853.db2.gz SQZRYWLBGYSHHV-UHFFFAOYSA-N 1 1 348.447 2.412 20 5 EEBDMO C/C=C(\C)C(=O)NCCC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC001096251729 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O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCCN(CC(F)(F)F)CC2)c1 ZINC000269643092 464044912 /nfs/dbraw/zinc/04/49/12/464044912.db2.gz JUSMOIYFYPPUGB-CQSZACIVSA-N 1 1 347.337 2.198 20 5 EEBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCCN(CC(F)(F)F)CC2)c1 ZINC000269643092 464044915 /nfs/dbraw/zinc/04/49/15/464044915.db2.gz JUSMOIYFYPPUGB-CQSZACIVSA-N 1 1 347.337 2.198 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCN(c3nccs3)CC2)c1 ZINC000269684630 464056851 /nfs/dbraw/zinc/05/68/51/464056851.db2.gz ZHLGXTGWGMWICB-HNNXBMFYSA-N 1 1 348.428 2.297 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)C[C@H]2C1 ZINC000279232008 464072111 /nfs/dbraw/zinc/07/21/11/464072111.db2.gz RHYFOBFZQLUMRB-TXEJJXNPSA-N 1 1 335.379 2.032 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000172805570 464146814 /nfs/dbraw/zinc/14/68/14/464146814.db2.gz WMULTPHRWLAHTK-ZIAGYGMSSA-N 1 1 332.404 2.092 20 5 EEBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@H](O)COCC(F)(F)F)C2CC2)c1 ZINC000292490932 464251441 /nfs/dbraw/zinc/25/14/41/464251441.db2.gz BHUGLZOMYTZTTM-AWEZNQCLSA-N 1 1 348.321 2.499 20 5 EEBDMO C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)Cc2ccccc2O1 ZINC000292495692 464252492 /nfs/dbraw/zinc/25/24/92/464252492.db2.gz UBQVZZOIWVHYQJ-CYBMUJFWSA-N 1 1 329.356 2.040 20 5 EEBDMO C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)Cc2ccccc2O1 ZINC000292495692 464252496 /nfs/dbraw/zinc/25/24/96/464252496.db2.gz UBQVZZOIWVHYQJ-CYBMUJFWSA-N 1 1 329.356 2.040 20 5 EEBDMO Cc1cc(OCC(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)ccc1[N+](=O)[O-] ZINC000281009862 464298476 /nfs/dbraw/zinc/29/84/76/464298476.db2.gz LOOZJEHGLCWPFE-HNNXBMFYSA-N 1 1 347.415 2.415 20 5 EEBDMO C[N@H+]1CC[C@@H]2OCCN(Cc3ccc([N+](=O)[O-])cc3Cl)[C@H]2C1 ZINC000284747458 464322010 /nfs/dbraw/zinc/32/20/10/464322010.db2.gz XFIJYLVMAOFEJQ-GJZGRUSLSA-N 1 1 325.796 2.153 20 5 EEBDMO C[C@H]1CN(C/C=C/c2ccccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000188896171 464390636 /nfs/dbraw/zinc/39/06/36/464390636.db2.gz LFDDQBQXPIHKJZ-VFADXPBXSA-N 1 1 333.432 2.385 20 5 EEBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@H]2[C@@H](O)C(F)(F)F)c1 ZINC000264633905 464402892 /nfs/dbraw/zinc/40/28/92/464402892.db2.gz VUQWPZPQAUEMFQ-QWHCGFSZSA-N 1 1 334.294 2.361 20 5 EEBDMO C[C@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000294229435 464438278 /nfs/dbraw/zinc/43/82/78/464438278.db2.gz DQXCVSTUBZJWNY-GFCCVEGCSA-N 1 1 339.461 2.446 20 5 EEBDMO C[C@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000294229435 464438285 /nfs/dbraw/zinc/43/82/85/464438285.db2.gz DQXCVSTUBZJWNY-GFCCVEGCSA-N 1 1 339.461 2.446 20 5 EEBDMO COc1cc(C(=O)NCC[N@@H+](C)C2CCCC2)c([N+](=O)[O-])cc1F ZINC000294706347 464581866 /nfs/dbraw/zinc/58/18/66/464581866.db2.gz VPJZBERTRIZBBQ-UHFFFAOYSA-N 1 1 339.367 2.347 20 5 EEBDMO CCO[C@@H]1C[C@](CO)([NH2+]Cc2c(F)cccc2[N+](=O)[O-])C1(C)C ZINC000190020428 464587957 /nfs/dbraw/zinc/58/79/57/464587957.db2.gz DWTQWPOMGHTICJ-GDBMZVCRSA-N 1 1 326.368 2.390 20 5 EEBDMO Cc1ccc(NCCCNC(=O)N2CCC[N@H+](C)CC2)c([N+](=O)[O-])c1 ZINC000265759255 464675475 /nfs/dbraw/zinc/67/54/75/464675475.db2.gz CUPXCMIPIBVKRJ-UHFFFAOYSA-N 1 1 349.435 2.052 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000295159821 464726455 /nfs/dbraw/zinc/72/64/55/464726455.db2.gz QLLRXWPJWDZESS-JSGCOSHPSA-N 1 1 345.399 2.299 20 5 EEBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+]C[C@@](C)(F)C1 ZINC000295316541 464786029 /nfs/dbraw/zinc/78/60/29/464786029.db2.gz WKAFHGHBTMODGU-XHDPSFHLSA-N 1 1 341.408 2.235 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(CO)CC1 ZINC000298741164 465490843 /nfs/dbraw/zinc/49/08/43/465490843.db2.gz JWZWAXOGXOTQCV-LLVKDONJSA-N 1 1 332.360 2.410 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000295483335 464854912 /nfs/dbraw/zinc/85/49/12/464854912.db2.gz ZZZINZAWPUSIMZ-CQSZACIVSA-N 1 1 347.415 2.358 20 5 EEBDMO CN(C)C(=O)O[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 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C[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1CCO ZINC000595695884 468958705 /nfs/dbraw/zinc/95/87/05/468958705.db2.gz IXFGTCMNNZKWNQ-BLLLJJGKSA-N 1 1 336.388 2.444 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000601705293 468975978 /nfs/dbraw/zinc/97/59/78/468975978.db2.gz LCRVDLPQUDWMAD-HIFRSBDPSA-N 1 1 342.399 2.421 20 5 EEBDMO Cn1cnnc1C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000610581133 469010279 /nfs/dbraw/zinc/01/02/79/469010279.db2.gz PIGWXFOJBQLDTE-UHFFFAOYSA-N 1 1 342.359 2.244 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)c([N+](=O)[O-])c1 ZINC000595791918 469012036 /nfs/dbraw/zinc/01/20/36/469012036.db2.gz YCZQMWSRFJDYJQ-RDJZCZTQSA-N 1 1 347.415 2.475 20 5 EEBDMO CCC[N@H+]1CC[C@@H](NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1 ZINC000595806978 469020369 /nfs/dbraw/zinc/02/03/69/469020369.db2.gz NTMILIUDRVLJEG-OAHLLOKOSA-N 1 1 334.420 2.263 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)[C@@](C)(CO)C1 ZINC000595870089 469054663 /nfs/dbraw/zinc/05/46/63/469054663.db2.gz GAYUMLKJLIDAFW-CXAGYDPISA-N 1 1 335.404 2.182 20 5 EEBDMO CNc1ccc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc1[N+](=O)[O-] ZINC000573396774 469122355 /nfs/dbraw/zinc/12/23/55/469122355.db2.gz MHBZCYXOFOJMIN-KRWDZBQOSA-N 1 1 332.404 2.194 20 5 EEBDMO NC(=O)c1cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000596055317 469130842 /nfs/dbraw/zinc/13/08/42/469130842.db2.gz WDNMCSFZUCXJET-OAHLLOKOSA-N 1 1 340.383 2.380 20 5 EEBDMO COc1ccccc1C[NH+]1CCN(c2cc[nH]c(=O)c2[N+](=O)[O-])CC1 ZINC000596111153 469159169 /nfs/dbraw/zinc/15/91/69/469159169.db2.gz ZFBBOJSBESSBSO-UHFFFAOYSA-N 1 1 344.371 2.026 20 5 EEBDMO CSC1CC[NH+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000602922288 469166237 /nfs/dbraw/zinc/16/62/37/469166237.db2.gz GKZPNXGTEIYVKO-UHFFFAOYSA-N 1 1 335.429 2.311 20 5 EEBDMO Cc1cc(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)ncn1 ZINC000611134739 469171384 /nfs/dbraw/zinc/17/13/84/469171384.db2.gz 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Cc1cccc(C(=O)N2CCC[N@@H+](C[C@H]3CCCO3)CC2)c1[N+](=O)[O-] ZINC000604489559 469482919 /nfs/dbraw/zinc/48/29/19/469482919.db2.gz JAIONFRLCCPOIS-OAHLLOKOSA-N 1 1 347.415 2.230 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594204671 485603114 /nfs/dbraw/zinc/60/31/14/485603114.db2.gz WMXKGKQVJHIPQQ-HUUCEWRRSA-N 1 1 333.388 2.350 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(NC[C@H](O)C[N@H+]2CCc3ccccc3C2)n1 ZINC000178167842 534327731 /nfs/dbraw/zinc/32/77/31/534327731.db2.gz SLKFSIKMDWUFAV-INIZCTEOSA-N 1 1 342.399 2.129 20 5 EEBDMO O=C(CC[N@@H+]1CCC[C@@H]1c1ncc[nH]1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411434138 534401581 /nfs/dbraw/zinc/40/15/81/534401581.db2.gz VOLMHHWGEKGYTL-CQSZACIVSA-N 1 1 329.360 2.484 20 5 EEBDMO O=C(CC[N@H+]1CCC[C@@H]1c1ncc[nH]1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411434138 534401585 /nfs/dbraw/zinc/40/15/85/534401585.db2.gz VOLMHHWGEKGYTL-CQSZACIVSA-N 1 1 329.360 2.484 20 5 EEBDMO C[N@H+](Cc1ccc2ccccc2c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266479225 536474188 /nfs/dbraw/zinc/47/41/88/536474188.db2.gz SPIZCJYNIHPYFX-SFHVURJKSA-N 1 1 340.383 2.437 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000111352903 535490794 /nfs/dbraw/zinc/49/07/94/535490794.db2.gz BEZWBYXOMAEJPH-CYBMUJFWSA-N 1 1 341.433 2.056 20 5 EEBDMO C[C@H](CNS(=O)(=O)c1csc([N+](=O)[O-])c1)[N@H+]1CCCC[C@H]1C ZINC000768806118 577562952 /nfs/dbraw/zinc/56/29/52/577562952.db2.gz WVOWRACGPFAMKX-GHMZBOCLSA-N 1 1 347.462 2.198 20 5 EEBDMO Cn1ccnc1[C@H](O)[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000769939851 577587437 /nfs/dbraw/zinc/58/74/37/577587437.db2.gz AYWUSOIEBINAAH-DOTOQJQBSA-N 1 1 344.415 2.316 20 5 EEBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CC[N@H+](CCO)C(C)(C)C1 ZINC000770146403 577591152 /nfs/dbraw/zinc/59/11/52/577591152.db2.gz SSIBQNMCPRBXMI-UHFFFAOYSA-N 1 1 327.812 2.450 20 5 EEBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CC[N@@H+](CCO)C(C)(C)C1 ZINC000770146403 577591153 /nfs/dbraw/zinc/59/11/53/577591153.db2.gz SSIBQNMCPRBXMI-UHFFFAOYSA-N 1 1 327.812 2.450 20 5 EEBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@@H](O)C1CC1 ZINC000764282779 577733764 /nfs/dbraw/zinc/73/37/64/577733764.db2.gz MAICZUSEGOFZCJ-LKFCYVNXSA-N 1 1 341.795 2.278 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)c1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000892840548 683124827 /nfs/dbraw/zinc/12/48/27/683124827.db2.gz PZASTJJIKKJPNC-GXTWGEPZSA-N 1 1 344.415 2.223 20 5 EEBDMO Cc1ccccc1C[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001034643321 1196464340 /nfs/dbraw/zinc/46/43/40/1196464340.db2.gz MMKLCVGTOCZIQR-QBPKDAKJSA-N 1 1 331.416 2.177 20 5 EEBDMO CCS(=O)(=O)CC[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872032625 1198031911 /nfs/dbraw/zinc/03/19/11/1198031911.db2.gz WVIMNVVJHAUOQQ-SNVBAGLBSA-N 1 1 332.447 2.402 20 5 EEBDMO Cn1cc[nH+]c1N1CCC(Nc2cc(F)c([N+](=O)[O-])cc2CO)CC1 ZINC000865723274 1198348340 /nfs/dbraw/zinc/34/83/40/1198348340.db2.gz WSDQXXFIAXJNQE-UHFFFAOYSA-N 1 1 349.366 2.041 20 5 EEBDMO Cc1c(C[NH2+]C[C@@H](C(C)C)N2CCN(C)CC2)cccc1[N+](=O)[O-] ZINC000873011236 1198473914 /nfs/dbraw/zinc/47/39/14/1198473914.db2.gz VTGGAKDGLBGYKG-SFHVURJKSA-N 1 1 334.464 2.265 20 5 EEBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000825909826 1199774554 /nfs/dbraw/zinc/77/45/54/1199774554.db2.gz JUSPVKQMEGWGRT-GDBMZVCRSA-N 1 1 335.404 2.009 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@H](CS(C)(=O)=O)C1 ZINC000877547379 1199962116 /nfs/dbraw/zinc/96/21/16/1199962116.db2.gz VOFQWGHICAPCNC-ZDUSSCGKSA-N 1 1 326.418 2.078 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H](CS(C)(=O)=O)C1 ZINC000877547379 1199962121 /nfs/dbraw/zinc/96/21/21/1199962121.db2.gz VOFQWGHICAPCNC-ZDUSSCGKSA-N 1 1 326.418 2.078 20 5 EEBDMO CC(C)(O)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000877796405 1200113552 /nfs/dbraw/zinc/11/35/52/1200113552.db2.gz FYCKGIQJGHUTRO-AWEZNQCLSA-N 1 1 336.388 2.444 20 5 EEBDMO CN(C(=O)C[N@H+]1CCC[C@H](C(C)(C)O)C1)c1ccc([N+](=O)[O-])cc1 ZINC000879962924 1201327579 /nfs/dbraw/zinc/32/75/79/1201327579.db2.gz RTOXWBJICZEBTA-ZDUSSCGKSA-N 1 1 335.404 2.041 20 5 EEBDMO C[C@H](c1ccccc1[N+](=O)[O-])n1cc(CCC[NH+]2CCOCC2)nn1 ZINC000881277070 1201670675 /nfs/dbraw/zinc/67/06/75/1201670675.db2.gz CIFREMBWLKKZCV-CQSZACIVSA-N 1 1 345.403 2.060 20 5 EEBDMO COCC[N@@H+]1[C@H](C)CN(CCOc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000129103227 1201722538 /nfs/dbraw/zinc/72/25/38/1201722538.db2.gz XDKGWAISJFIZTQ-GASCZTMLSA-N 1 1 337.420 2.015 20 5 EEBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000869210501 1201965213 /nfs/dbraw/zinc/96/52/13/1201965213.db2.gz SGDBEWNHUSJSHW-GJZGRUSLSA-N 1 1 335.379 2.410 20 5 EEBDMO COc1ccc(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000886589601 1202528491 /nfs/dbraw/zinc/52/84/91/1202528491.db2.gz ZXTDUCNXXZFGLN-CQSZACIVSA-N 1 1 335.404 2.406 20 5 EEBDMO COc1ccc(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000886589601 1202528492 /nfs/dbraw/zinc/52/84/92/1202528492.db2.gz ZXTDUCNXXZFGLN-CQSZACIVSA-N 1 1 335.404 2.406 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)NCCCN(C)c1ccc(C)cc1[N+](=O)[O-] ZINC001095562426 1205875486 /nfs/dbraw/zinc/87/54/86/1205875486.db2.gz MNJKDZPQDOGWDL-UHFFFAOYSA-N 1 1 345.403 2.051 20 5 EEBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000930369124 1206552929 /nfs/dbraw/zinc/55/29/29/1206552929.db2.gz YMZXLCVBZKCRMZ-JCURWCKSSA-N 1 1 329.400 2.299 20 5 EEBDMO C[C@@H]1CC2(C[N@H+]1CC[N+](=O)[O-])CCN(C(=O)OC(C)(C)C)CC2 ZINC000930762748 1206580980 /nfs/dbraw/zinc/58/09/80/1206580980.db2.gz JYLDIHXMORJEAG-CYBMUJFWSA-N 1 1 327.425 2.375 20 5 EEBDMO CC(C)(C)NC(=O)[C@@H]1CCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000932440638 1207606909 /nfs/dbraw/zinc/60/69/09/1207606909.db2.gz NTQDBVLTMHGRGC-LSDHHAIUSA-N 1 1 335.404 2.007 20 5 EEBDMO CC(C)(C)NC(=O)[C@@H]1CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000932440638 1207606912 /nfs/dbraw/zinc/60/69/12/1207606912.db2.gz NTQDBVLTMHGRGC-LSDHHAIUSA-N 1 1 335.404 2.007 20 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C[N@@H+](CC(=O)N[C@H]1C[C@@H](Nc2ncccc2[N+](=O)[O-])C1)CC(C)(C)C ZINC001097256108 1243881114 /nfs/dbraw/zinc/88/11/14/1243881114.db2.gz WJYNVDIYEDZQAL-BETUJISGSA-N 1 1 349.435 2.027 20 5 EEBDMO CC1(C)OC[C@H](CC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)O1 ZINC000851843478 1291879990 /nfs/dbraw/zinc/87/99/90/1291879990.db2.gz IEAGTEJACWLYSU-JSGCOSHPSA-N 1 1 336.392 2.018 20 5 EEBDMO Cc1noc(C[NH2+][C@@H](CNC(=O)OC(C)(C)C)C2CC2)c1[N+](=O)[O-] ZINC000851925822 1291918962 /nfs/dbraw/zinc/91/89/62/1291918962.db2.gz BUFFMBTVQNUJCK-NSHDSACASA-N 1 1 340.380 2.284 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)nc1-c1ccccn1 ZINC000853502864 1292404388 /nfs/dbraw/zinc/40/43/88/1292404388.db2.gz AGUUQGJCFVPAKI-UONOGXRCSA-N 1 1 343.387 2.169 20 5 EEBDMO C[C@]1(CO)C[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C[C@@]1(C)CO ZINC000862518996 1295864395 /nfs/dbraw/zinc/86/43/95/1295864395.db2.gz OPBKZIDSECCQJD-GASCZTMLSA-N 1 1 328.796 2.061 20 5 EEBDMO 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ZINC001234412052 1304912745 /nfs/dbraw/zinc/91/27/45/1304912745.db2.gz YBIDWNVKORBYRE-ZDUSSCGKSA-N 1 1 345.355 2.291 20 5 EEBDMO C[C@H]([N@@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C(C)(C)O ZINC000839612271 1315220169 /nfs/dbraw/zinc/22/01/69/1315220169.db2.gz OUHLVUKNTBSIBK-VIFPVBQESA-N 1 1 329.784 2.278 20 5 EEBDMO COC(=O)C[C@@H]1CCCN(c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1 ZINC001154839410 1317344236 /nfs/dbraw/zinc/34/42/36/1317344236.db2.gz PJLUMCKOOCDENT-CFNZNRNTSA-N 1 1 348.403 2.302 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CC[C@](CO)(C(F)(F)F)C1)C2 ZINC001254593943 1318136836 /nfs/dbraw/zinc/13/68/36/1318136836.db2.gz OGWLHSRSANPZKV-KBPBESRZSA-N 1 1 330.306 2.309 20 5 EEBDMO CCO[C@@H]1C[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)[C@@H]2CCCO[C@H]12 ZINC001254596266 1318138893 /nfs/dbraw/zinc/13/88/93/1318138893.db2.gz NEJLEHMENYHARL-TVFCKZIOSA-N 1 1 332.400 2.330 20 5 EEBDMO O=c1ccc2c([nH]1)CC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001254607244 1318141945 /nfs/dbraw/zinc/14/19/45/1318141945.db2.gz JVHGOORWNDDEMX-MRXNPFEDSA-N 1 1 325.368 2.263 20 5 EEBDMO COc1cc(N2CCC([NH+]3CC4(C3)CCCO4)CC2)ccc1[N+](=O)[O-] ZINC001256093887 1318646249 /nfs/dbraw/zinc/64/62/49/1318646249.db2.gz RQUOEUKWASDJLW-UHFFFAOYSA-N 1 1 347.415 2.437 20 5 EEBDMO CCC[N@@H+]1C[C@H]2CN(c3nc(Cl)nc(Cl)c3[N+](=O)[O-])C[C@H]2C1 ZINC001157689106 1318798115 /nfs/dbraw/zinc/79/81/15/1318798115.db2.gz GQYXAYUOJNJEIY-DTORHVGOSA-N 1 1 346.218 2.470 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](Nc2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])[C@H](C)C1 ZINC001163366704 1321106236 /nfs/dbraw/zinc/10/62/36/1321106236.db2.gz WJEHZYBPBZIMER-PWSUYJOCSA-N 1 1 328.800 2.412 20 5 EEBDMO [NH3+][C@@H]1CN(c2nc(Cl)c(Cl)cc2[N+](=O)[O-])CCC1(F)F ZINC001164319756 1321350478 /nfs/dbraw/zinc/35/04/78/1321350478.db2.gz OLTKLYSOTGXYCZ-SSDOTTSWSA-N 1 1 327.118 2.469 20 5 EEBDMO O=C(NCCC1(C[NH2+]CC2CC3(CCC3)C2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164494597 1321395739 /nfs/dbraw/zinc/39/57/39/1321395739.db2.gz NTPGGWXEWCMINW-HUUCEWRRSA-N 1 1 335.448 2.108 20 5 EEBDMO Cc1nc(Nc2cccc([N+](=O)[O-])c2F)cc(N2CCOCC2)[nH+]1 ZINC001210381078 1325260885 /nfs/dbraw/zinc/26/08/85/1325260885.db2.gz HCTJMFOGLCRSBC-UHFFFAOYSA-N 1 1 333.323 2.413 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001318829988 1332605878 /nfs/dbraw/zinc/60/58/78/1332605878.db2.gz ZDFXBOCCMVMICT-CVEARBPZSA-N 1 1 330.388 2.247 20 5 EEBDMO C[N@@H+](CCNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-])C1CCCCC1 ZINC001609276044 1351918534 /nfs/dbraw/zinc/91/85/34/1351918534.db2.gz DLJZLABVPKYPNT-UHFFFAOYSA-N 1 1 345.407 2.451 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001328526383 1334473521 /nfs/dbraw/zinc/47/35/21/1334473521.db2.gz SAUVNQRVEUHCFM-CQSZACIVSA-N 1 1 346.431 2.488 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC001337887391 1336748797 /nfs/dbraw/zinc/74/87/97/1336748797.db2.gz FJSPOEZKEFSXLO-MEDUHNTESA-N 1 1 344.415 2.382 20 5 EEBDMO COc1ccc(NC(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC001345717867 1337462157 /nfs/dbraw/zinc/46/21/57/1337462157.db2.gz CQGWTOOBNABNQF-KGLIPLIRSA-N 1 1 334.376 2.352 20 5 EEBDMO Cc1ccc(N(C)CCNC(=O)C[N@H+]2CCC(C)(C)C2)c([N+](=O)[O-])c1 ZINC001100346637 1338289686 /nfs/dbraw/zinc/28/96/86/1338289686.db2.gz ARPKFEVXAFLMSB-UHFFFAOYSA-N 1 1 348.447 2.188 20 5 EEBDMO CNc1nccc(C(=O)OCC[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000848790129 1338764192 /nfs/dbraw/zinc/76/41/92/1338764192.db2.gz KCJBKMMJWZLSEC-UHFFFAOYSA-N 1 1 344.371 2.320 20 5 EEBDMO C[C@@H](c1cccc(-c2nn[nH]n2)c1)[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC001590046746 1349128022 /nfs/dbraw/zinc/12/80/22/1349128022.db2.gz NSFYNWWWGUPMPQ-NSHDSACASA-N 1 1 339.359 2.363 20 5 EEBDMO C[C@@H](c1cccc(-c2nn[nH]n2)c1)[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC001590046746 1349128025 /nfs/dbraw/zinc/12/80/25/1349128025.db2.gz NSFYNWWWGUPMPQ-NSHDSACASA-N 1 1 339.359 2.363 20 5 EEBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590258863 1349232371 /nfs/dbraw/zinc/23/23/71/1349232371.db2.gz DBAJFDMOISFYQF-NWDGAFQWSA-N 1 1 345.407 2.307 20 5 EEBDMO C[C@@H](CNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC001590258910 1349236207 /nfs/dbraw/zinc/23/62/07/1349236207.db2.gz FOYNSIOUNSAPLF-RYUDHWBXSA-N 1 1 345.407 2.307 20 5 EEBDMO C[N@H+]1CCC[C@H](CCNc2cc(F)c(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001591184472 1349445095 /nfs/dbraw/zinc/44/50/95/1349445095.db2.gz OVAPOCNXLQTWQR-SNVBAGLBSA-N 1 1 349.370 2.058 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H](Nc2cc(-c3nn[nH]n3)ccc2[N+](=O)[O-])C1 ZINC001603077600 1350634999 /nfs/dbraw/zinc/63/49/99/1350634999.db2.gz FPJYMLGBLIHVMF-LLVKDONJSA-N 1 1 331.380 2.060 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001603078073 1350635231 /nfs/dbraw/zinc/63/52/31/1350635231.db2.gz SBRMMLQRNVHGRW-NSHDSACASA-N 1 1 345.407 2.307 20 5 EEBDMO O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1C[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC001607077385 1351407245 /nfs/dbraw/zinc/40/72/45/1351407245.db2.gz MKQHFPOPRPTERT-JTQLQIEISA-N 1 1 342.281 2.159 20 5 EEBDMO O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1C[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC001607077385 1351407247 /nfs/dbraw/zinc/40/72/47/1351407247.db2.gz MKQHFPOPRPTERT-JTQLQIEISA-N 1 1 342.281 2.159 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nn[nH]n2)cc1N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC001607081193 1351409471 /nfs/dbraw/zinc/40/94/71/1351409471.db2.gz AZMIKTLJOWIHKE-JSGCOSHPSA-N 1 1 343.391 2.204 20 5 EEBDMO O=C(NCCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1cn[nH]c1 ZINC001752242726 1406238612 /nfs/dbraw/zinc/23/86/12/1406238612.db2.gz FXNFBXLFDDPGCH-UHFFFAOYSA-N 1 1 343.387 2.102 20 5 EEBDMO CCOc1cc(C[N@@H+]2CC[C@@H](N3CCOC3=O)C2)ccc1[N+](=O)[O-] ZINC000852438395 1369272722 /nfs/dbraw/zinc/27/27/22/1369272722.db2.gz PZBJASJFDWKAQC-CYBMUJFWSA-N 1 1 335.360 2.020 20 5 EEBDMO CCOc1cc(C[N@H+]2CC[C@@H](N3CCOC3=O)C2)ccc1[N+](=O)[O-] ZINC000852438395 1369272728 /nfs/dbraw/zinc/27/27/28/1369272728.db2.gz PZBJASJFDWKAQC-CYBMUJFWSA-N 1 1 335.360 2.020 20 5 EEBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCCC2(CCOCC2)C1 ZINC000794635934 1369591658 /nfs/dbraw/zinc/59/16/58/1369591658.db2.gz YMMRTTLTVAEZIA-UHFFFAOYSA-N 1 1 347.371 2.353 20 5 EEBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000794635934 1369591663 /nfs/dbraw/zinc/59/16/63/1369591663.db2.gz YMMRTTLTVAEZIA-UHFFFAOYSA-N 1 1 347.371 2.353 20 5 EEBDMO Cc1cnc(N2CC[NH+](CCc3ccccn3)CC2)c([N+](=O)[O-])c1 ZINC001165053501 722009137 /nfs/dbraw/zinc/00/91/37/722009137.db2.gz IJSKWDIXRDBMRL-UHFFFAOYSA-N 1 1 327.388 2.058 20 5 EEBDMO O=[N+]([O-])c1cc2c(Cl)ncnc2cc1N1CCc2[nH+]ccn2CC1 ZINC001167178237 757459127 /nfs/dbraw/zinc/45/91/27/757459127.db2.gz OYRUFQWUJOSZSS-UHFFFAOYSA-N 1 1 344.762 2.451 20 5 EEBDMO CCN(CCNc1nccc(C)c1[N+](=O)[O-])C(=O)C[N@@H+](C)C1CCC1 ZINC001106979568 782760471 /nfs/dbraw/zinc/76/04/71/782760471.db2.gz SOHSLESIWVCSFM-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO O=C(O[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC000893604723 774640302 /nfs/dbraw/zinc/64/03/02/774640302.db2.gz GYWUCQPWENGDBO-NQNKBUKLSA-N 1 1 330.384 2.105 20 5 EEBDMO O=C(O[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12)[C@@H]1CC1[N+](=O)[O-] ZINC000893604723 774640306 /nfs/dbraw/zinc/64/03/06/774640306.db2.gz GYWUCQPWENGDBO-NQNKBUKLSA-N 1 1 330.384 2.105 20 5 EEBDMO O=C(O[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12)[C@@H]1CC1[N+](=O)[O-] ZINC000893604723 774640314 /nfs/dbraw/zinc/64/03/14/774640314.db2.gz GYWUCQPWENGDBO-NQNKBUKLSA-N 1 1 330.384 2.105 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NCC1=CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC001127690326 779403805 /nfs/dbraw/zinc/40/38/05/779403805.db2.gz LXDIRHFDIIRNRV-UHFFFAOYSA-N 1 1 346.431 2.189 20 5 EEBDMO CN(C[C@H]1CCC[N@H+]1C)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000817371671 784720558 /nfs/dbraw/zinc/72/05/58/784720558.db2.gz BVCQPDPYYQBLFS-QGZVFWFLSA-N 1 1 329.404 2.442 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)N(C)CCCNc1ccc(C)cc1[N+](=O)[O-] ZINC001109564775 805686551 /nfs/dbraw/zinc/68/65/51/805686551.db2.gz HXFDWAONKMMJBY-UHFFFAOYSA-N 1 1 345.403 2.369 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NC/C=C/CNc1ccccc1[N+](=O)[O-] ZINC001107391523 787106027 /nfs/dbraw/zinc/10/60/27/787106027.db2.gz JXWJCYUOGKNQOF-CMDGGOBGSA-N 1 1 334.420 2.409 20 5 EEBDMO Cn1nc(C2CC2)cc1C[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000922948938 788421963 /nfs/dbraw/zinc/42/19/63/788421963.db2.gz ZXDJIHNCRSGMIV-UHFFFAOYSA-N 1 1 344.371 2.267 20 5 EEBDMO Cc1nn(CN2CC[N@H+](C)C[C@H]2Cc2ccccc2)c(C)c1[N+](=O)[O-] ZINC000844742665 789341659 /nfs/dbraw/zinc/34/16/59/789341659.db2.gz QQRPKGMGKJTKCT-QGZVFWFLSA-N 1 1 343.431 2.224 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC000785730463 806558903 /nfs/dbraw/zinc/55/89/03/806558903.db2.gz KCFNUUWQAHWSES-BETUJISGSA-N 1 1 349.387 2.258 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000785730463 806558907 /nfs/dbraw/zinc/55/89/07/806558907.db2.gz KCFNUUWQAHWSES-BETUJISGSA-N 1 1 349.387 2.258 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@H](O)[C@H](C)C2)c1F ZINC001173180754 797278510 /nfs/dbraw/zinc/27/85/10/797278510.db2.gz MWSDUTIWRXXARN-SUNKGSAMSA-N 1 1 326.368 2.376 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@@H](CO)C2)c1F ZINC001173184882 797280328 /nfs/dbraw/zinc/28/03/28/797280328.db2.gz PDPSARMMPRFQSE-VXGBXAGGSA-N 1 1 326.368 2.378 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2C[C@H](Oc3cccnc3)[C@H]3OCCC[C@@H]32)C1 ZINC001169017520 803586629 /nfs/dbraw/zinc/58/66/29/803586629.db2.gz AGMLSBVTPANWPD-SSGTUYFUSA-N 1 1 347.415 2.138 20 5 EEBDMO O=C1NCC[C@]12C[N@@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@H]2c1ccccc1 ZINC001169026764 803592468 /nfs/dbraw/zinc/59/24/68/803592468.db2.gz NVPCAAMZRGGINN-PCODUJHASA-N 1 1 343.427 2.038 20 5 EEBDMO COC(=O)[C@H]1CC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)[C@H]1C ZINC000787238169 807063595 /nfs/dbraw/zinc/06/35/95/807063595.db2.gz JZDSICWTDMGEIY-LRDDRELGSA-N 1 1 344.371 2.299 20 5 EEBDMO CC(C)[C@@H](C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000787960105 807315557 /nfs/dbraw/zinc/31/55/57/807315557.db2.gz HDSFOPQECGKFRE-RISCZKNCSA-N 1 1 337.376 2.051 20 5 EEBDMO COc1ccc(C[C@H](C)[N@@H+]2CCN(C(C)=O)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001170355027 809902613 /nfs/dbraw/zinc/90/26/13/809902613.db2.gz UWPGQBFLCGSLFS-STQMWFEESA-N 1 1 335.404 2.087 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CCN(C(C)=O)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001170355027 809902617 /nfs/dbraw/zinc/90/26/17/809902617.db2.gz UWPGQBFLCGSLFS-STQMWFEESA-N 1 1 335.404 2.087 20 5 EEBDMO COC(=O)[C@@H]1C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CC12CC2 ZINC001170356149 809903970 /nfs/dbraw/zinc/90/39/70/809903970.db2.gz YNWQHGHFWZQBIC-WFASDCNBSA-N 1 1 348.399 2.419 20 5 EEBDMO Cc1nn(C[N@@H+]2CCOC[C@H](C3CCC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000793742590 810514968 /nfs/dbraw/zinc/51/49/68/810514968.db2.gz BVGKJOPGHRRFBM-CQSZACIVSA-N 1 1 345.403 2.354 20 5 EEBDMO Cc1nn(C[N@H+]2CCOC[C@H](C3CCC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000793742590 810514975 /nfs/dbraw/zinc/51/49/75/810514975.db2.gz BVGKJOPGHRRFBM-CQSZACIVSA-N 1 1 345.403 2.354 20 5 EEBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)CSc1ccc([N+](=O)[O-])cc1)C2 ZINC000174610997 529831567 /nfs/dbraw/zinc/83/15/67/529831567.db2.gz KBROEORXFRAAPQ-GXTWGEPZSA-N 1 1 335.429 2.382 20 5 EEBDMO CC(C)C(=O)NC[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000101908778 219171654 /nfs/dbraw/zinc/17/16/54/219171654.db2.gz JHTXRMRCZIPIJP-HNNXBMFYSA-N 1 1 349.431 2.458 20 5 EEBDMO C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C1CCCC1 ZINC000104573462 219395722 /nfs/dbraw/zinc/39/57/22/219395722.db2.gz XAKJNSWBZUUQAX-UHFFFAOYSA-N 1 1 336.348 2.107 20 5 EEBDMO O=C(NCC[N@H+]1CCc2ccccc2C1)Nc1ccncc1[N+](=O)[O-] ZINC000183639407 235176925 /nfs/dbraw/zinc/17/69/25/235176925.db2.gz HYLZIHLUPXECEA-UHFFFAOYSA-N 1 1 341.371 2.170 20 5 EEBDMO NC(=O)c1ccc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000246212340 283379406 /nfs/dbraw/zinc/37/94/06/283379406.db2.gz AONKFZLZHCTRLN-ZFWWWQNUSA-N 1 1 344.415 2.147 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CC(C)(C)O)C1CC1 ZINC000189907059 237386911 /nfs/dbraw/zinc/38/69/11/237386911.db2.gz RXOPZBLTBFWKNS-UHFFFAOYSA-N 1 1 335.404 2.467 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CCC([C@@H]3[NH2+]CC3(C)C)CC2)c1[N+](=O)[O-] ZINC000424036410 240804521 /nfs/dbraw/zinc/80/45/21/240804521.db2.gz FALCQGMVPHWFGE-HNNXBMFYSA-N 1 1 349.435 2.121 20 5 EEBDMO C[S@@](=O)c1ccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000425974055 241192112 /nfs/dbraw/zinc/19/21/12/241192112.db2.gz BUTMGMQCAARRPU-XMMPIXPASA-N 1 1 348.428 2.366 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC000426930817 241356687 /nfs/dbraw/zinc/35/66/87/241356687.db2.gz FFMLNKJYBHCERF-CHWSQXEVSA-N 1 1 335.404 2.454 20 5 EEBDMO Cc1c(NC(=O)CCN(C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cccc1[N+](=O)[O-] ZINC000442767741 242108792 /nfs/dbraw/zinc/10/87/92/242108792.db2.gz ZLZHEGXBUMAVKA-YIONKMFJSA-N 1 1 346.431 2.447 20 5 EEBDMO C[C@H]1COCCN1CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549156 243152542 /nfs/dbraw/zinc/15/25/42/243152542.db2.gz PBLGVRACBIXSIF-DOTOQJQBSA-N 1 1 333.432 2.495 20 5 EEBDMO C[N@@H+](C[C@@H](O)CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C1CC1 ZINC000451549659 243153301 /nfs/dbraw/zinc/15/33/01/243153301.db2.gz PZCDFVLAEGNPDA-MAUKXSAKSA-N 1 1 333.432 2.229 20 5 EEBDMO CN(C[C@@H](O)C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C1CC1 ZINC000451549659 243153302 /nfs/dbraw/zinc/15/33/02/243153302.db2.gz PZCDFVLAEGNPDA-MAUKXSAKSA-N 1 1 333.432 2.229 20 5 EEBDMO CN(C[C@@H](O)C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C1CC1 ZINC000451549659 243153306 /nfs/dbraw/zinc/15/33/06/243153306.db2.gz PZCDFVLAEGNPDA-MAUKXSAKSA-N 1 1 333.432 2.229 20 5 EEBDMO C[C@H]1COCCN1CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549162 243153751 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2.002 20 5 EEBDMO COCC[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000273317410 256286324 /nfs/dbraw/zinc/28/63/24/256286324.db2.gz VTYBANCLHINFAT-ZDUSSCGKSA-N 1 1 333.344 2.494 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000274288492 256370737 /nfs/dbraw/zinc/37/07/37/256370737.db2.gz LTROAPDYHRNTBO-SWLSCSKDSA-N 1 1 328.372 2.173 20 5 EEBDMO COCCCOCC[N@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000274301187 256372173 /nfs/dbraw/zinc/37/21/73/256372173.db2.gz JRXKFIPCVNKAPE-UHFFFAOYSA-N 1 1 330.356 2.227 20 5 EEBDMO COCCCOCC[N@@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000274301187 256372175 /nfs/dbraw/zinc/37/21/75/256372175.db2.gz JRXKFIPCVNKAPE-UHFFFAOYSA-N 1 1 330.356 2.227 20 5 EEBDMO COc1ccc(C[N@@H+]2CCOCC3(CCOCC3)C2)cc1[N+](=O)[O-] ZINC000184064623 533564070 /nfs/dbraw/zinc/56/40/70/533564070.db2.gz MBAGZLFWUGGVIA-UHFFFAOYSA-N 1 1 336.388 2.232 20 5 EEBDMO COc1ccc(C[N@H+]2CCOCC3(CCOCC3)C2)cc1[N+](=O)[O-] ZINC000184064623 533564075 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DDJUMTXVIFYOKK-GFCCVEGCSA-N 1 1 328.800 2.190 20 5 EEBDMO CC[C@@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000153720038 462683757 /nfs/dbraw/zinc/68/37/57/462683757.db2.gz DDJUMTXVIFYOKK-GFCCVEGCSA-N 1 1 328.800 2.190 20 5 EEBDMO Cc1cc(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c(N)c([N+](=O)[O-])c1 ZINC000075158543 462688824 /nfs/dbraw/zinc/68/88/24/462688824.db2.gz BWXYAKONJKRVLJ-ZDUSSCGKSA-N 1 1 334.420 2.432 20 5 EEBDMO C[C@@H](CNC(=O)COc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000046953361 462726293 /nfs/dbraw/zinc/72/62/93/462726293.db2.gz POOOCLLIJUDFIT-KGLIPLIRSA-N 1 1 335.404 2.210 20 5 EEBDMO CCOc1ccc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000046996088 462731740 /nfs/dbraw/zinc/73/17/40/462731740.db2.gz HWMFXEAWVHRPBT-UONOGXRCSA-N 1 1 333.388 2.350 20 5 EEBDMO CC[C@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000117334914 462798807 /nfs/dbraw/zinc/79/88/07/462798807.db2.gz RFQQPGSOQDNWCQ-ZDUSSCGKSA-N 1 1 335.360 2.004 20 5 EEBDMO CC[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000117334914 462798811 /nfs/dbraw/zinc/79/88/11/462798811.db2.gz RFQQPGSOQDNWCQ-ZDUSSCGKSA-N 1 1 335.360 2.004 20 5 EEBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1 ZINC000119419269 462899082 /nfs/dbraw/zinc/89/90/82/462899082.db2.gz QFWDQOXVTOXGIH-AWEZNQCLSA-N 1 1 348.447 2.369 20 5 EEBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000120882771 463050015 /nfs/dbraw/zinc/05/00/15/463050015.db2.gz HSEOUHFRWGDDRM-INIZCTEOSA-N 1 1 348.447 2.414 20 5 EEBDMO Cc1[nH+]ccn1CCNC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000052192646 463068192 /nfs/dbraw/zinc/06/81/92/463068192.db2.gz WBRVBIWCGFTEJY-LLVKDONJSA-N 1 1 334.401 2.397 20 5 EEBDMO C[C@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC[N@H+]1Cc1ccccc1 ZINC000078689640 463141779 /nfs/dbraw/zinc/14/17/79/463141779.db2.gz MHIJTAGQJCBYNN-ZDUSSCGKSA-N 1 1 342.403 2.068 20 5 EEBDMO CCOCC[N@@H+](CC)CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000157602016 463148183 /nfs/dbraw/zinc/14/81/83/463148183.db2.gz AVPLZRFUTKCVTP-UHFFFAOYSA-N 1 1 339.392 2.290 20 5 EEBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000054620111 463248844 /nfs/dbraw/zinc/24/88/44/463248844.db2.gz SXAXXODWCAHWEQ-CYBMUJFWSA-N 1 1 345.403 2.354 20 5 EEBDMO Cc1cc[nH+]c(N2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000159038874 463265853 /nfs/dbraw/zinc/26/58/53/463265853.db2.gz BGROAWLPDZEBRE-UHFFFAOYSA-N 1 1 340.383 2.190 20 5 EEBDMO CN(CC(=O)N[C@H]1CC[N@H+](C2CCCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000080086851 463280509 /nfs/dbraw/zinc/28/05/09/463280509.db2.gz HWZGHUQLTLFHJE-AWEZNQCLSA-N 1 1 346.431 2.164 20 5 EEBDMO CN(c1ccc([N+](=O)[O-])cc1F)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000069810874 463330070 /nfs/dbraw/zinc/33/00/70/463330070.db2.gz OPVKDXRGCLTVMI-OAHLLOKOSA-N 1 1 336.411 2.339 20 5 EEBDMO CN(c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000069810874 463330074 /nfs/dbraw/zinc/33/00/74/463330074.db2.gz OPVKDXRGCLTVMI-OAHLLOKOSA-N 1 1 336.411 2.339 20 5 EEBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCc1ccccn1 ZINC000124404874 463420163 /nfs/dbraw/zinc/42/01/63/463420163.db2.gz CCVOOPONNGIUDO-UHFFFAOYSA-N 1 1 328.372 2.493 20 5 EEBDMO CCCCN(CC)C(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072665128 463532709 /nfs/dbraw/zinc/53/27/09/463532709.db2.gz AYOYHUXKWCSGKV-AWEZNQCLSA-N 1 1 349.435 2.125 20 5 EEBDMO CCCCN(CC)C(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072665128 463532711 /nfs/dbraw/zinc/53/27/11/463532711.db2.gz AYOYHUXKWCSGKV-AWEZNQCLSA-N 1 1 349.435 2.125 20 5 EEBDMO CC(C)[N@H+](Cc1cccnc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000125643255 463565027 /nfs/dbraw/zinc/56/50/27/463565027.db2.gz WCJWWKOOCBGKKK-UHFFFAOYSA-N 1 1 328.372 2.499 20 5 EEBDMO CC(C)[N@@H+](Cc1cccnc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000125643255 463565032 /nfs/dbraw/zinc/56/50/32/463565032.db2.gz WCJWWKOOCBGKKK-UHFFFAOYSA-N 1 1 328.372 2.499 20 5 EEBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000108782654 463623022 /nfs/dbraw/zinc/62/30/22/463623022.db2.gz TZVOHHMECBGPTO-GFCCVEGCSA-N 1 1 344.415 2.383 20 5 EEBDMO Nc1c(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000126509174 463642369 /nfs/dbraw/zinc/64/23/69/463642369.db2.gz JURBETSASGQQGT-DOMZBBRYSA-N 1 1 344.415 2.266 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](N(C)C)C2)cccc1[N+](=O)[O-] ZINC000109809636 463650955 /nfs/dbraw/zinc/65/09/55/463650955.db2.gz QYVCFPAZELOBPD-CQSZACIVSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H](N(C)C)C2)cccc1[N+](=O)[O-] ZINC000109809636 463650956 /nfs/dbraw/zinc/65/09/56/463650956.db2.gz QYVCFPAZELOBPD-CQSZACIVSA-N 1 1 334.420 2.258 20 5 EEBDMO O=C1CCCN1[C@H]1CCC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000111290740 463673907 /nfs/dbraw/zinc/67/39/07/463673907.db2.gz HTUUPHKJAZWBKW-HNNXBMFYSA-N 1 1 333.388 2.060 20 5 EEBDMO COCCC[N@@H+](C)CCNC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000152531951 463700815 /nfs/dbraw/zinc/70/08/15/463700815.db2.gz PZJMWOKXHUACAN-UHFFFAOYSA-N 1 1 341.433 2.015 20 5 EEBDMO C[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1nc(-c2cccc(F)c2)no1 ZINC000185076118 463746879 /nfs/dbraw/zinc/74/68/79/463746879.db2.gz RTANBOCCNYQGBZ-SNVBAGLBSA-N 1 1 346.322 2.331 20 5 EEBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000287233599 463842622 /nfs/dbraw/zinc/84/26/22/463842622.db2.gz JLQRUTXHJQUOKE-LLVKDONJSA-N 1 1 331.376 2.022 20 5 EEBDMO C[C@H]1[C@@H]([NH+]2CCCC2)CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000287239345 463844000 /nfs/dbraw/zinc/84/40/00/463844000.db2.gz RBMPQICHAPEGEH-NHYWBVRUSA-N 1 1 343.387 2.170 20 5 EEBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000269312118 463949562 /nfs/dbraw/zinc/94/95/62/463949562.db2.gz AJMDRTSBSDGLGY-SNVBAGLBSA-N 1 1 334.380 2.012 20 5 EEBDMO COc1ccc(C[N@H+](CCCO)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000287700026 463972625 /nfs/dbraw/zinc/97/26/25/463972625.db2.gz JELFILCDCOMXLL-UHFFFAOYSA-N 1 1 331.372 2.383 20 5 EEBDMO COc1ccc(C[N@@H+](CCCO)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000287700026 463972630 /nfs/dbraw/zinc/97/26/30/463972630.db2.gz JELFILCDCOMXLL-UHFFFAOYSA-N 1 1 331.372 2.383 20 5 EEBDMO C[C@@H]1C[N@@H+](CCN(C)Cc2ccc([N+](=O)[O-])cc2F)C[C@H](C)O1 ZINC000279654962 464120959 /nfs/dbraw/zinc/12/09/59/464120959.db2.gz CADSMDODFWTDNA-BETUJISGSA-N 1 1 325.384 2.275 20 5 EEBDMO C[C@@H]1C[N@H+](CCN(C)Cc2ccc([N+](=O)[O-])cc2F)C[C@H](C)O1 ZINC000279654962 464120961 /nfs/dbraw/zinc/12/09/61/464120961.db2.gz CADSMDODFWTDNA-BETUJISGSA-N 1 1 325.384 2.275 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@H]1CCN(C(C)=O)C1 ZINC000179445088 464138669 /nfs/dbraw/zinc/13/86/69/464138669.db2.gz QUWNRWYYPPQXHB-CQSZACIVSA-N 1 1 335.404 2.294 20 5 EEBDMO CC(C)C(=O)NC[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000263702475 464160130 /nfs/dbraw/zinc/16/01/30/464160130.db2.gz IYLDYNGYLHHEHV-OAHLLOKOSA-N 1 1 349.431 2.458 20 5 EEBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000270275928 464243241 /nfs/dbraw/zinc/24/32/41/464243241.db2.gz SMKPQBKQVXNLMR-DLBZAZTESA-N 1 1 342.399 2.362 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[C@H](C[NH+](CC)CC)C2)c1[N+](=O)[O-] ZINC000173563217 464283972 /nfs/dbraw/zinc/28/39/72/464283972.db2.gz DIMFQMDDDIZZDB-GFCCVEGCSA-N 1 1 337.424 2.074 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCO[C@@H]2CC[N@@H+](C)C[C@@H]21 ZINC000284810238 464350591 /nfs/dbraw/zinc/35/05/91/464350591.db2.gz KRMRGJSNLQPFSR-FUHWJXTLSA-N 1 1 349.431 2.287 20 5 EEBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@H]2[C@@H](O)C(F)(F)F)cc1 ZINC000264577414 464381650 /nfs/dbraw/zinc/38/16/50/464381650.db2.gz BCMYFBLBQMZOBB-QWHCGFSZSA-N 1 1 334.294 2.361 20 5 EEBDMO C[N@@H+]1CC=C(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC1 ZINC000271913236 464410409 /nfs/dbraw/zinc/41/04/09/464410409.db2.gz IWUABFKTFBZGAN-UHFFFAOYSA-N 1 1 344.415 2.187 20 5 EEBDMO C[C@@]1(CCCO)CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000272022079 464450229 /nfs/dbraw/zinc/45/02/29/464450229.db2.gz NATPLVBPPHOYOP-SFHVURJKSA-N 1 1 347.415 2.111 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(c3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])[C@H]2C1 ZINC000272208094 464518120 /nfs/dbraw/zinc/51/81/20/464518120.db2.gz PTRNUODGJDRUNL-SJCJKPOMSA-N 1 1 344.415 2.017 20 5 EEBDMO Cc1ncc(C[N@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])s1 ZINC000182215675 464601599 /nfs/dbraw/zinc/60/15/99/464601599.db2.gz ZXFANWKQPAGDLY-GFCCVEGCSA-N 1 1 337.401 2.231 20 5 EEBDMO Cc1ncc(C[N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])s1 ZINC000182215675 464601605 /nfs/dbraw/zinc/60/16/05/464601605.db2.gz ZXFANWKQPAGDLY-GFCCVEGCSA-N 1 1 337.401 2.231 20 5 EEBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000272426751 464603960 /nfs/dbraw/zinc/60/39/60/464603960.db2.gz CEJVJLJNCUHNBB-DOTOQJQBSA-N 1 1 346.431 2.263 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2CCc2ccccc2)c1 ZINC000246736374 464616609 /nfs/dbraw/zinc/61/66/09/464616609.db2.gz NSRMAGVOWFHSRT-FUHWJXTLSA-N 1 1 344.415 2.249 20 5 EEBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCNC1=O ZINC000281913320 464632997 /nfs/dbraw/zinc/63/29/97/464632997.db2.gz RKSVCVMCJWFCMY-CQSZACIVSA-N 1 1 344.371 2.003 20 5 EEBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 ZINC000285631602 464636193 /nfs/dbraw/zinc/63/61/93/464636193.db2.gz KUBACLNVYKLQSQ-XOKHGSTOSA-N 1 1 330.388 2.235 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](C[NH+]3CCOCC3)C2)c1 ZINC000282117472 464704026 /nfs/dbraw/zinc/70/40/26/464704026.db2.gz GDQSTHWTAVPULL-HNNXBMFYSA-N 1 1 347.415 2.088 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1CCn1ccc([N+](=O)[O-])n1 ZINC000176260607 464732998 /nfs/dbraw/zinc/73/29/98/464732998.db2.gz XXWVUQRXVYJSRA-INIZCTEOSA-N 1 1 343.431 2.388 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(c3nc4ccc([N+](=O)[O-])cc4c(=O)[nH]3)CC[C@@H]21 ZINC000286136996 464817005 /nfs/dbraw/zinc/81/70/05/464817005.db2.gz HRHIHNUZVPCZRG-ABAIWWIYSA-N 1 1 343.387 2.164 20 5 EEBDMO CC(C)c1ccc(C(=O)N2CC[N@@H+](C[C@H](C)O)C[C@H]2C)cc1[N+](=O)[O-] ZINC000249105447 464842064 /nfs/dbraw/zinc/84/20/64/464842064.db2.gz PFFMTUGFXZNVEE-KGLIPLIRSA-N 1 1 349.431 2.245 20 5 EEBDMO CC(C)c1ccc(C(=O)N2CC[N@H+](C[C@H](C)O)C[C@H]2C)cc1[N+](=O)[O-] ZINC000249105447 464842068 /nfs/dbraw/zinc/84/20/68/464842068.db2.gz PFFMTUGFXZNVEE-KGLIPLIRSA-N 1 1 349.431 2.245 20 5 EEBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000286271859 464862665 /nfs/dbraw/zinc/86/26/65/464862665.db2.gz BIZGEHPXPKBISR-NUTGUDPMSA-N 1 1 345.399 2.279 20 5 EEBDMO C[C@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CCS1 ZINC000192193271 464883700 /nfs/dbraw/zinc/88/37/00/464883700.db2.gz YORYQHHRNIFOGS-LBPRGKRZSA-N 1 1 335.429 2.311 20 5 EEBDMO C[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CCS1 ZINC000192193271 464883705 /nfs/dbraw/zinc/88/37/05/464883705.db2.gz YORYQHHRNIFOGS-LBPRGKRZSA-N 1 1 335.429 2.311 20 5 EEBDMO CC(C)[NH+]1CCN(C2CCN(c3ccc(N)cc3[N+](=O)[O-])CC2)CC1 ZINC000286437315 464917895 /nfs/dbraw/zinc/91/78/95/464917895.db2.gz IKZALANHTFDILR-UHFFFAOYSA-N 1 1 347.463 2.172 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000177067125 464922579 /nfs/dbraw/zinc/92/25/79/464922579.db2.gz MBRCVYNWRXGXTM-QWHCGFSZSA-N 1 1 333.388 2.105 20 5 EEBDMO CCCc1[nH]nc(C(=O)N(CCC)CCC[NH+](C)C)c1[N+](=O)[O-] ZINC000276428697 464928018 /nfs/dbraw/zinc/92/80/18/464928018.db2.gz TXNHZLHSTRTPTD-UHFFFAOYSA-N 1 1 325.413 2.074 20 5 EEBDMO C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+](C2CC2)C1 ZINC000295781403 464962789 /nfs/dbraw/zinc/96/27/89/464962789.db2.gz XZNQPVVOTXRSTP-CYBMUJFWSA-N 1 1 346.431 2.217 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCCO)CC1 ZINC000339780477 465507765 /nfs/dbraw/zinc/50/77/65/465507765.db2.gz VFKRVLJDWSMQAQ-UHFFFAOYSA-N 1 1 338.404 2.355 20 5 EEBDMO C[N@@H+]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000356724011 465507984 /nfs/dbraw/zinc/50/79/84/465507984.db2.gz FZECSVGYRRZOBZ-IAGOWNOFSA-N 1 1 341.367 2.128 20 5 EEBDMO C[N@H+]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000356724011 465507992 /nfs/dbraw/zinc/50/79/92/465507992.db2.gz FZECSVGYRRZOBZ-IAGOWNOFSA-N 1 1 341.367 2.128 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000348523880 465652020 /nfs/dbraw/zinc/65/20/20/465652020.db2.gz BKONITWUIYKXNI-ZDUSSCGKSA-N 1 1 343.387 2.444 20 5 EEBDMO C[C@H](C1CCC1)[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000357012283 465699868 /nfs/dbraw/zinc/69/98/68/465699868.db2.gz QQLILWXTACGHQM-SNVBAGLBSA-N 1 1 335.360 2.382 20 5 EEBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000330602356 465726798 /nfs/dbraw/zinc/72/67/98/465726798.db2.gz WMGCVQPAINMGLN-QWRGUYRKSA-N 1 1 340.811 2.211 20 5 EEBDMO Cc1n[nH]c(C(=O)NCC(C)(C)[N@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000299590018 465814593 /nfs/dbraw/zinc/81/45/93/465814593.db2.gz ZGSCNHZAVFADRK-PHIMTYICSA-N 1 1 337.424 2.113 20 5 EEBDMO CC[C@H](C)[C@@H](O)C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000353528376 465954486 /nfs/dbraw/zinc/95/44/86/465954486.db2.gz GVBVQYINMTUOGN-RCBQFDQVSA-N 1 1 332.404 2.414 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@]1(C)CCOC1)c1cccc([N+](=O)[O-])c1 ZINC000353526100 465954719 /nfs/dbraw/zinc/95/47/19/465954719.db2.gz HXIQJQBFJFSXRG-DOTOQJQBSA-N 1 1 330.388 2.434 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(c3cc4nc[nH]c(=O)c4cc3[N+](=O)[O-])CC[C@H]21 ZINC000301705401 466014944 /nfs/dbraw/zinc/01/49/44/466014944.db2.gz IEYZAXQYXAQMNI-BXUZGUMPSA-N 1 1 343.387 2.164 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](n2cccn2)C1 ZINC000338725161 466337962 /nfs/dbraw/zinc/33/79/62/466337962.db2.gz RJWZIJLCQRNXQJ-CJNGLKHVSA-N 1 1 343.387 2.455 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](n2cccn2)C1 ZINC000338725161 466337972 /nfs/dbraw/zinc/33/79/72/466337972.db2.gz RJWZIJLCQRNXQJ-CJNGLKHVSA-N 1 1 343.387 2.455 20 5 EEBDMO C[NH+](C)Cc1ccc(NC(=O)Cn2ccc([N+](=O)[O-])n2)cc1Cl ZINC000357956958 466345423 /nfs/dbraw/zinc/34/54/23/466345423.db2.gz HYEUHDRKBVCPTP-UHFFFAOYSA-N 1 1 337.767 2.145 20 5 EEBDMO Cc1cccc(NC[C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)n1 ZINC000363354116 466362304 /nfs/dbraw/zinc/36/23/04/466362304.db2.gz XQQYARFBKCPXRB-AWEZNQCLSA-N 1 1 330.392 2.071 20 5 EEBDMO COc1ccc(CNc2[nH+]cccc2N2CCOCC2)cc1[N+](=O)[O-] ZINC000367544061 466405150 /nfs/dbraw/zinc/40/51/50/466405150.db2.gz IJCPYLPRYYCICW-UHFFFAOYSA-N 1 1 344.371 2.447 20 5 EEBDMO COc1cc(C[N@@H+]2C[C@H](O)C[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000340909821 466427469 /nfs/dbraw/zinc/42/74/69/466427469.db2.gz NSJJVIBLAQLAGU-PSASIEDQSA-N 1 1 332.303 2.160 20 5 EEBDMO COc1cc(C[N@H+]2C[C@H](O)C[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000340909821 466427472 /nfs/dbraw/zinc/42/74/72/466427472.db2.gz NSJJVIBLAQLAGU-PSASIEDQSA-N 1 1 332.303 2.160 20 5 EEBDMO CC(C)(O)[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000305738834 466440818 /nfs/dbraw/zinc/44/08/18/466440818.db2.gz MUGLGRLDDNERQC-CYBMUJFWSA-N 1 1 341.795 2.422 20 5 EEBDMO CC(C)(O)[C@H]1CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000305738834 466440826 /nfs/dbraw/zinc/44/08/26/466440826.db2.gz MUGLGRLDDNERQC-CYBMUJFWSA-N 1 1 341.795 2.422 20 5 EEBDMO CC(C)(C)OC(=O)[C@@](C)(O)C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000362107574 466562474 /nfs/dbraw/zinc/56/24/74/466562474.db2.gz VRPUIPCLOKKHPZ-HNNXBMFYSA-N 1 1 344.795 2.431 20 5 EEBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(S(N)(=O)=O)c1 ZINC000320314641 466606992 /nfs/dbraw/zinc/60/69/92/466606992.db2.gz VYWULXWAJLKTTB-NSHDSACASA-N 1 1 335.385 2.093 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1c([N+](=O)[O-])ncn1C ZINC000373462114 466811266 /nfs/dbraw/zinc/81/12/66/466811266.db2.gz YGERPJFVBWNYPJ-HOCLYGCPSA-N 1 1 343.431 2.329 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412127156 467020029 /nfs/dbraw/zinc/02/00/29/467020029.db2.gz KWAUNEZJUDDUGU-SJWGOKEGSA-N 1 1 331.416 2.497 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC2(C[C@@H]1C)CC[NH2+]CC2 ZINC000424285533 467022364 /nfs/dbraw/zinc/02/23/64/467022364.db2.gz FRSSMNDLINVIRZ-AWEZNQCLSA-N 1 1 346.431 2.306 20 5 EEBDMO Cc1ncccc1OC[C@H]1CCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C ZINC000419402007 467195219 /nfs/dbraw/zinc/19/52/19/467195219.db2.gz PSEFQVZUMIMGHF-CYBMUJFWSA-N 1 1 331.376 2.075 20 5 EEBDMO Cc1ncccc1OC[C@H]1CCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C ZINC000419402007 467195222 /nfs/dbraw/zinc/19/52/22/467195222.db2.gz PSEFQVZUMIMGHF-CYBMUJFWSA-N 1 1 331.376 2.075 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C2CC2)C[C@@H](C)C1 ZINC000451082837 467243119 /nfs/dbraw/zinc/24/31/19/467243119.db2.gz GYDBPAWZUUVJPP-ZDUSSCGKSA-N 1 1 346.431 2.258 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420347071 467372669 /nfs/dbraw/zinc/37/26/69/467372669.db2.gz ZXPMGKCKGNDNQG-QLFBSQMISA-N 1 1 346.431 2.243 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(NC)c([N+](=O)[O-])c1 ZINC000394312080 467433136 /nfs/dbraw/zinc/43/31/36/467433136.db2.gz NEJZAYRQCVYACI-KGLIPLIRSA-N 1 1 332.404 2.335 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](C)[C@@H]1CN ZINC000430569685 467441235 /nfs/dbraw/zinc/44/12/35/467441235.db2.gz ALKSKDVMXJXDAV-CJNGLKHVSA-N 1 1 334.420 2.291 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](C)[C@@H]1CN ZINC000430569685 467441238 /nfs/dbraw/zinc/44/12/38/467441238.db2.gz ALKSKDVMXJXDAV-CJNGLKHVSA-N 1 1 334.420 2.291 20 5 EEBDMO CC[N@@H+](CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000448982965 467610241 /nfs/dbraw/zinc/61/02/41/467610241.db2.gz YUIBEBYIYYXERR-UHFFFAOYSA-N 1 1 335.404 2.404 20 5 EEBDMO Cc1nc(Nc2ccc(CC[NH+]3CCOCC3)cc2)ncc1[N+](=O)[O-] ZINC000450268968 467813629 /nfs/dbraw/zinc/81/36/29/467813629.db2.gz JTNWXVSJDPCFTJ-UHFFFAOYSA-N 1 1 343.387 2.312 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@@H+](C)[C@@H](C(C)C)C1 ZINC000488037781 468068384 /nfs/dbraw/zinc/06/83/84/468068384.db2.gz GYVQOXVNWZJLTP-MRXNPFEDSA-N 1 1 334.420 2.114 20 5 EEBDMO CN(C(=O)C[N@@H+]1CC[C@@H](c2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000517832988 468099514 /nfs/dbraw/zinc/09/95/14/468099514.db2.gz MMGZRECSOPHBOE-OAHLLOKOSA-N 1 1 340.383 2.442 20 5 EEBDMO CN(C(=O)C[N@H+]1CC[C@@H](c2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000517832988 468099517 /nfs/dbraw/zinc/09/95/17/468099517.db2.gz MMGZRECSOPHBOE-OAHLLOKOSA-N 1 1 340.383 2.442 20 5 EEBDMO CNC(=O)c1ccc(N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000488753698 468101972 /nfs/dbraw/zinc/10/19/72/468101972.db2.gz NDNVWQJDFRWZQK-DVOMOZLQSA-N 1 1 346.431 2.121 20 5 EEBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(c2nc3sccn3c2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488752885 468102059 /nfs/dbraw/zinc/10/20/59/468102059.db2.gz YPCBXIFATSSGSG-SRVKXCTJSA-N 1 1 335.433 2.471 20 5 EEBDMO CC(C)(NC(=O)N[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000489032877 468117181 /nfs/dbraw/zinc/11/71/81/468117181.db2.gz BQICHWZMRCHUAK-GFCCVEGCSA-N 1 1 332.404 2.366 20 5 EEBDMO CC(C)(C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000590033664 468206749 /nfs/dbraw/zinc/20/67/49/468206749.db2.gz WNFWWURXKGTZME-CQSZACIVSA-N 1 1 331.416 2.473 20 5 EEBDMO CC1(C)CN(c2ccnc3c2cccc3[N+](=O)[O-])CC[N@H+]1CCO ZINC000590084572 468212395 /nfs/dbraw/zinc/21/23/95/468212395.db2.gz GKMKOTNAPLUCIN-UHFFFAOYSA-N 1 1 330.388 2.036 20 5 EEBDMO C[N@H+]1CCCC[C@@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000600309874 468529169 /nfs/dbraw/zinc/52/91/69/468529169.db2.gz DEDRUWIOKHFXEJ-AWEZNQCLSA-N 1 1 334.420 2.245 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)n1 ZINC000594596543 468630923 /nfs/dbraw/zinc/63/09/23/468630923.db2.gz ANQLUUJNPQVLLZ-YPMHNXCESA-N 1 1 334.376 2.205 20 5 EEBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594598716 468631496 /nfs/dbraw/zinc/63/14/96/468631496.db2.gz HQEZMEYAVPPOIY-JKSUJKDBSA-N 1 1 332.404 2.383 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC[NH+]1CCC(OC)CC1 ZINC000595010707 468743151 /nfs/dbraw/zinc/74/31/51/468743151.db2.gz DJPLGTCHBLMWLU-ZDUSSCGKSA-N 1 1 337.420 2.365 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCC[N@H+](CCCO)C1 ZINC000595043255 468748185 /nfs/dbraw/zinc/74/81/85/468748185.db2.gz VOQZWXVPPLSEDJ-UONOGXRCSA-N 1 1 337.420 2.101 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCC[N@@H+](CCCO)C1 ZINC000595043255 468748192 /nfs/dbraw/zinc/74/81/92/468748192.db2.gz VOQZWXVPPLSEDJ-UONOGXRCSA-N 1 1 337.420 2.101 20 5 EEBDMO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])c[nH]3)C2)cc1 ZINC000601245826 468796490 /nfs/dbraw/zinc/79/64/90/468796490.db2.gz LMXKBQGRENIGHJ-CQSZACIVSA-N 1 1 328.372 2.236 20 5 EEBDMO CCCN(C(=O)CCNc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000592830079 468798857 /nfs/dbraw/zinc/79/88/57/468798857.db2.gz BGOQIBPPEUIAGW-AWEZNQCLSA-N 1 1 334.420 2.340 20 5 EEBDMO Cc1cnc(N2CC[NH+](Cc3ccc(O)cc3)CC2)c([N+](=O)[O-])c1 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O=C(CC[N@H+]1CC[C@@H]2OCCC[C@@H]2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000155392769 462886086 /nfs/dbraw/zinc/88/60/86/462886086.db2.gz XUCZUSAYRPPPSE-CJNGLKHVSA-N 1 1 333.388 2.424 20 5 EEBDMO COCC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000066854704 462937707 /nfs/dbraw/zinc/93/77/07/462937707.db2.gz HMFVHNNBRROVKM-UHFFFAOYSA-N 1 1 333.310 2.382 20 5 EEBDMO CC(=O)N1CC[C@@H](C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000156362497 463013348 /nfs/dbraw/zinc/01/33/48/463013348.db2.gz LUXQCIFNNCDPEC-LBPRGKRZSA-N 1 1 332.360 2.036 20 5 EEBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000157089185 463097894 /nfs/dbraw/zinc/09/78/94/463097894.db2.gz VMKWKYVBTJSBQX-HUUCEWRRSA-N 1 1 347.415 2.306 20 5 EEBDMO C[C@H](c1ccc(S(N)(=O)=O)cc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000028727109 463231574 /nfs/dbraw/zinc/23/15/74/463231574.db2.gz AXQFPVGUNFZWPI-GFCCVEGCSA-N 1 1 349.412 2.435 20 5 EEBDMO Cc1c(C[N@H+]2CCC[C@@H](CN3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000069803484 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Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000152428583 463689624 /nfs/dbraw/zinc/68/96/24/463689624.db2.gz CPEQNJHXMIYQMW-AWEZNQCLSA-N 1 1 334.420 2.115 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCO[C@H](C)C1 ZINC000170774762 463704054 /nfs/dbraw/zinc/70/40/54/463704054.db2.gz WHDUKOQKRYRBBV-GFCCVEGCSA-N 1 1 337.376 2.043 20 5 EEBDMO C[C@@H](CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000286869656 463729463 /nfs/dbraw/zinc/72/94/63/463729463.db2.gz CQVJNGFNRRKWMT-ZDUSSCGKSA-N 1 1 334.420 2.261 20 5 EEBDMO Nc1ccc(NC[C@@H]2C[N@H+](Cc3ccccc3)CCO2)c([N+](=O)[O-])c1 ZINC000287085544 463794606 /nfs/dbraw/zinc/79/46/06/463794606.db2.gz ULLSGINKRMGMCJ-MRXNPFEDSA-N 1 1 342.399 2.490 20 5 EEBDMO Nc1ccc(NC[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)c([N+](=O)[O-])c1 ZINC000287085544 463794611 /nfs/dbraw/zinc/79/46/11/463794611.db2.gz ULLSGINKRMGMCJ-MRXNPFEDSA-N 1 1 342.399 2.490 20 5 EEBDMO C[N@H+]1CCC[C@@H](CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000185817887 463885701 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MGTOXJCUWFGXOX-UHFFFAOYSA-N 1 1 335.404 2.469 20 5 EEBDMO C[C@]1(O)CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000279885689 464161723 /nfs/dbraw/zinc/16/17/23/464161723.db2.gz CTMMLUCKWCUQOP-HNNXBMFYSA-N 1 1 341.795 2.424 20 5 EEBDMO C[C@]1(O)CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000279885689 464161726 /nfs/dbraw/zinc/16/17/26/464161726.db2.gz CTMMLUCKWCUQOP-HNNXBMFYSA-N 1 1 341.795 2.424 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000284674383 464289720 /nfs/dbraw/zinc/28/97/20/464289720.db2.gz HAZQQAADPAKQPT-CVEARBPZSA-N 1 1 333.388 2.485 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000284674383 464289723 /nfs/dbraw/zinc/28/97/23/464289723.db2.gz HAZQQAADPAKQPT-CVEARBPZSA-N 1 1 333.388 2.485 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@H](C)[C@H]1C ZINC000298644158 465458522 /nfs/dbraw/zinc/45/85/22/465458522.db2.gz PWQSHGJYJUPPHE-NEPJUHHUSA-N 1 1 337.376 2.041 20 5 EEBDMO CN(C(=O)C[NH+]1CCC([C@@H]2CCCO2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000189160988 464448418 /nfs/dbraw/zinc/44/84/18/464448418.db2.gz KKRHWJRSSVPCOO-KRWDZBQOSA-N 1 1 347.415 2.449 20 5 EEBDMO CCCN(CCC[NH+](C)C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000189272582 464467856 /nfs/dbraw/zinc/46/78/56/464467856.db2.gz VJRGVFGMZXVNAL-UHFFFAOYSA-N 1 1 333.392 2.275 20 5 EEBDMO CN(CC1([NH+](C)C)CCC1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000189523001 464525570 /nfs/dbraw/zinc/52/55/70/464525570.db2.gz JTQBTNNZYNYRRK-UHFFFAOYSA-N 1 1 331.376 2.027 20 5 EEBDMO CN(Cc1ccco1)C(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285366509 464538845 /nfs/dbraw/zinc/53/88/45/464538845.db2.gz QSAGAWAKKPAKIV-UHFFFAOYSA-N 1 1 331.372 2.321 20 5 EEBDMO CN(Cc1ccco1)C(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285366509 464538848 /nfs/dbraw/zinc/53/88/48/464538848.db2.gz QSAGAWAKKPAKIV-UHFFFAOYSA-N 1 1 331.372 2.321 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000175397593 464539961 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345.403 2.422 20 5 EEBDMO COc1cc(C)c(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)cc1OC ZINC000176196636 464717634 /nfs/dbraw/zinc/71/76/34/464717634.db2.gz PYZQIWAEYPUSGC-UHFFFAOYSA-N 1 1 334.376 2.249 20 5 EEBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000282349394 464783975 /nfs/dbraw/zinc/78/39/75/464783975.db2.gz GZTXENYOQWOMIF-SJORKVTESA-N 1 1 346.431 2.406 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@H](C)[C@@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000248998525 464828736 /nfs/dbraw/zinc/82/87/36/464828736.db2.gz YJSGZWXFXDMJSK-CABZTGNLSA-N 1 1 346.330 2.408 20 5 EEBDMO COC(=O)[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000249064576 464836212 /nfs/dbraw/zinc/83/62/12/464836212.db2.gz JYRRIQXKFIRPPJ-XJKSGUPXSA-N 1 1 336.388 2.495 20 5 EEBDMO C[C@@H](CNc1nccc2cc([N+](=O)[O-])ccc21)[NH+]1CCN(C)CC1 ZINC000295446786 464838831 /nfs/dbraw/zinc/83/88/31/464838831.db2.gz GWILHALECPJQDH-ZDUSSCGKSA-N 1 1 329.404 2.191 20 5 EEBDMO CC[C@@]1(CO)CCC[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000249581725 464894296 /nfs/dbraw/zinc/89/42/96/464894296.db2.gz RJGIANMRVVTTAD-CXAGYDPISA-N 1 1 335.404 2.406 20 5 EEBDMO CC[C@@]1(CO)CCC[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000249581725 464894303 /nfs/dbraw/zinc/89/43/03/464894303.db2.gz RJGIANMRVVTTAD-CXAGYDPISA-N 1 1 335.404 2.406 20 5 EEBDMO C[C@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)CN1CCN(C)CC1 ZINC000192822921 465005463 /nfs/dbraw/zinc/00/54/63/465005463.db2.gz DFJHAMCPXBVOSF-DNVCBOLYSA-N 1 1 346.475 2.445 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000351852615 465399428 /nfs/dbraw/zinc/39/94/28/465399428.db2.gz WISBDTVMRSHGNX-INIZCTEOSA-N 1 1 334.420 2.311 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000371345460 465732766 /nfs/dbraw/zinc/73/27/66/465732766.db2.gz QTGIGUODLDNDOI-ZDUSSCGKSA-N 1 1 340.383 2.453 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000338046665 465777332 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1 348.428 2.417 20 5 EEBDMO COC(=O)CC(C)(C)[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000177922559 681590311 /nfs/dbraw/zinc/59/03/11/681590311.db2.gz FVCGCRUVNODXDZ-UHFFFAOYSA-N 1 1 334.332 2.076 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21)C1CC=CC1 ZINC001025716585 683245376 /nfs/dbraw/zinc/24/53/76/683245376.db2.gz UNBOXWDTZCNSSX-FVQHAEBGSA-N 1 1 327.384 2.107 20 5 EEBDMO CC1(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4cccc([N+](=O)[O-])c4)C[C@H]32)CCC1 ZINC001025946487 683669883 /nfs/dbraw/zinc/66/98/83/683669883.db2.gz CDKMPTUBDGUZTK-ZSHCYNCHSA-N 1 1 329.400 2.331 20 5 EEBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)[C@H]1CN(C)CC[N@@H+]1C ZINC000895245941 684381207 /nfs/dbraw/zinc/38/12/07/684381207.db2.gz KBPHVMQMTYCZTP-GXFFZTMASA-N 1 1 344.362 2.242 20 5 EEBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)[C@H]1CN(C)CC[N@H+]1C ZINC000895245941 684381214 /nfs/dbraw/zinc/38/12/14/684381214.db2.gz KBPHVMQMTYCZTP-GXFFZTMASA-N 1 1 344.362 2.242 20 5 EEBDMO Cc1ccccc1C[N@@H+](C)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964671 688721049 /nfs/dbraw/zinc/72/10/49/688721049.db2.gz VCVMQFKFUNLCCZ-QZTJIDSGSA-N 1 1 345.443 2.331 20 5 EEBDMO Cc1ccccc1C[N@H+](C)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964671 688721052 /nfs/dbraw/zinc/72/10/52/688721052.db2.gz VCVMQFKFUNLCCZ-QZTJIDSGSA-N 1 1 345.443 2.331 20 5 EEBDMO Cc1ccccc1C[N@@H+](C)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964671 688721055 /nfs/dbraw/zinc/72/10/55/688721055.db2.gz VCVMQFKFUNLCCZ-QZTJIDSGSA-N 1 1 345.443 2.331 20 5 EEBDMO Cc1cc[nH+]c(N2CCN(c3cc(F)c([N+](=O)[O-])cc3CO)CC2)c1 ZINC000865621758 1198301948 /nfs/dbraw/zinc/30/19/48/1198301948.db2.gz ZQZKNPXKIXECIP-UHFFFAOYSA-N 1 1 346.362 2.256 20 5 EEBDMO CCOC(=O)Cc1ccc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c([N+](=O)[O-])c1 ZINC000825795697 1199262839 /nfs/dbraw/zinc/26/28/39/1199262839.db2.gz PIPMLLOLWSIOFT-CABCVRRESA-N 1 1 347.415 2.373 20 5 EEBDMO CCOC(=O)Cc1ccc(N2CC[C@]3(CC[N@@H+](C)C3)C2)c([N+](=O)[O-])c1 ZINC000826105281 1201034049 /nfs/dbraw/zinc/03/40/49/1201034049.db2.gz ULXCKVDCAGZQDQ-SFHVURJKSA-N 1 1 347.415 2.232 20 5 EEBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](CF)C2)c([N+](=O)[O-])c1 ZINC000880296888 1201450209 /nfs/dbraw/zinc/45/02/09/1201450209.db2.gz GATJLOZMZQPIKK-QWRGUYRKSA-N 1 1 325.340 2.222 20 5 EEBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H](CF)C2)c([N+](=O)[O-])c1 ZINC000880296888 1201450212 /nfs/dbraw/zinc/45/02/12/1201450212.db2.gz GATJLOZMZQPIKK-QWRGUYRKSA-N 1 1 325.340 2.222 20 5 EEBDMO CC(C)(C)OC(=O)NC[C@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000885980250 1202461584 /nfs/dbraw/zinc/46/15/84/1202461584.db2.gz XIKGWKUHZKSFFY-GFCCVEGCSA-N 1 1 336.392 2.336 20 5 EEBDMO CC(C)(C)OC(=O)NC[C@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000885980250 1202461585 /nfs/dbraw/zinc/46/15/85/1202461585.db2.gz XIKGWKUHZKSFFY-GFCCVEGCSA-N 1 1 336.392 2.336 20 5 EEBDMO CCOc1ccc(C(=O)NCC[N@H+]2CCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000890081945 1204780552 /nfs/dbraw/zinc/78/05/52/1204780552.db2.gz NPCRNYJAKHFNSG-UHFFFAOYSA-N 1 1 335.404 2.455 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCn2cc[nH+]c21 ZINC000931524738 1207405227 /nfs/dbraw/zinc/40/52/27/1207405227.db2.gz VCJWJISILCOBCH-SECBINFHSA-N 1 1 335.751 2.292 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2 ZINC000931724728 1207449504 /nfs/dbraw/zinc/44/95/04/1207449504.db2.gz HYHPZAVWCBSLAW-BJJXKVORSA-N 1 1 332.404 2.090 20 5 EEBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000778938971 1208411634 /nfs/dbraw/zinc/41/16/34/1208411634.db2.gz HSKCMUYAIGGVQS-LLVKDONJSA-N 1 1 327.331 2.287 20 5 EEBDMO C[N@H+]1CCC[C@H](CNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC000900630808 1234585973 /nfs/dbraw/zinc/58/59/73/1234585973.db2.gz RXDVSTLMONENRQ-SECBINFHSA-N 1 1 329.759 2.459 20 5 EEBDMO CCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C1 ZINC000856073623 1293399085 /nfs/dbraw/zinc/39/90/85/1293399085.db2.gz UJNHQZKTZQWZPO-NSHDSACASA-N 1 1 338.383 2.014 20 5 EEBDMO Cn1nccc1[C@@H](O)C1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000856797531 1293637014 /nfs/dbraw/zinc/63/70/14/1293637014.db2.gz ILRWMELHOJVBMX-KRWDZBQOSA-N 1 1 348.378 2.413 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@@H]1CCCCS1(=O)=O ZINC000784621057 1304513707 /nfs/dbraw/zinc/51/37/07/1304513707.db2.gz LZQXQUGMNLBHAK-LBPRGKRZSA-N 1 1 332.809 2.305 20 5 EEBDMO COC(=O)c1ccc(OC2CC[NH+](CCF)CC2)cc1[N+](=O)[O-] ZINC001234049693 1304707404 /nfs/dbraw/zinc/70/74/04/1304707404.db2.gz ANLZBIQZTVORHX-UHFFFAOYSA-N 1 1 326.324 2.194 20 5 EEBDMO C[N@H+]1CCC[C@@H](Oc2cc(N3CCOCC3)ccc2[N+](=O)[O-])CC1 ZINC001234361092 1304898764 /nfs/dbraw/zinc/89/87/64/1304898764.db2.gz XMNLABYSWOIAQP-OAHLLOKOSA-N 1 1 335.404 2.295 20 5 EEBDMO COCCCC(=O)NCCC[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001234398171 1304908797 /nfs/dbraw/zinc/90/87/97/1304908797.db2.gz MMVSMUHEAVWGAT-UHFFFAOYSA-N 1 1 329.422 2.021 20 5 EEBDMO COCCCC(=O)NCCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001234398171 1304908802 /nfs/dbraw/zinc/90/88/02/1304908802.db2.gz MMVSMUHEAVWGAT-UHFFFAOYSA-N 1 1 329.422 2.021 20 5 EEBDMO C[N@H+]1[C@@H]2C[C@H](Oc3nccc4c3cccc4[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001234674005 1305006260 /nfs/dbraw/zinc/00/62/60/1305006260.db2.gz GCXSJBGUILQLKD-JQAFLVLXSA-N 1 1 327.340 2.326 20 5 EEBDMO Cc1ocnc1C(=O)NCCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001235001465 1305080623 /nfs/dbraw/zinc/08/06/23/1305080623.db2.gz RCVAISNCDYTVPJ-UHFFFAOYSA-N 1 1 338.389 2.205 20 5 EEBDMO Cc1ocnc1C(=O)NCCC[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001235001465 1305080629 /nfs/dbraw/zinc/08/06/29/1305080629.db2.gz RCVAISNCDYTVPJ-UHFFFAOYSA-N 1 1 338.389 2.205 20 5 EEBDMO [NH3+][C@H](Cc1cccs1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001247162556 1310540943 /nfs/dbraw/zinc/54/09/43/1310540943.db2.gz SGTGFBAQDHAWKC-SECBINFHSA-N 1 1 335.320 2.483 20 5 EEBDMO O=C1C[C@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000839986992 1315268868 /nfs/dbraw/zinc/26/88/68/1315268868.db2.gz CSURSXMQRQUNQE-WBVHZDCISA-N 1 1 331.372 2.364 20 5 EEBDMO COC[C@@]1(C)CC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000840104464 1315294971 /nfs/dbraw/zinc/29/49/71/1315294971.db2.gz MLWUZWVGWSGHIO-INIZCTEOSA-N 1 1 331.376 2.169 20 5 EEBDMO COC[C@@]1(C)CC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000840104464 1315294975 /nfs/dbraw/zinc/29/49/75/1315294975.db2.gz MLWUZWVGWSGHIO-INIZCTEOSA-N 1 1 331.376 2.169 20 5 EEBDMO COc1ccc([C@@H]2[C@H](COC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CCC[N@H+]2C)cc1 ZINC000842305753 1315685620 /nfs/dbraw/zinc/68/56/20/1315685620.db2.gz BMRHXCXLOUGUGF-RKTXRCNFSA-N 1 1 348.399 2.287 20 5 EEBDMO COc1ccc([C@@H]2[C@H](COC(=O)[C@@H]3CC3[N+](=O)[O-])CCC[N@@H+]2C)cc1 ZINC000842305753 1315685623 /nfs/dbraw/zinc/68/56/23/1315685623.db2.gz BMRHXCXLOUGUGF-RKTXRCNFSA-N 1 1 348.399 2.287 20 5 EEBDMO COc1ccc([C@@H]2[C@H](COC(=O)[C@@H]3CC3[N+](=O)[O-])CCC[N@H+]2C)cc1 ZINC000842305753 1315685626 /nfs/dbraw/zinc/68/56/26/1315685626.db2.gz BMRHXCXLOUGUGF-RKTXRCNFSA-N 1 1 348.399 2.287 20 5 EEBDMO CC(C)(C)[C@H](C[NH3+])NCCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000842475371 1315712425 /nfs/dbraw/zinc/71/24/25/1315712425.db2.gz OKCXICDQSIXZFZ-ZDUSSCGKSA-N 1 1 326.372 2.026 20 5 EEBDMO CCN1C[C@@H](C)[N@@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1=O ZINC001254480893 1318083845 /nfs/dbraw/zinc/08/38/45/1318083845.db2.gz OPKYBBRMHBROAM-CQSZACIVSA-N 1 1 346.431 2.116 20 5 EEBDMO CCN1C[C@@H](C)[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1=O ZINC001254480893 1318083854 /nfs/dbraw/zinc/08/38/54/1318083854.db2.gz OPKYBBRMHBROAM-CQSZACIVSA-N 1 1 346.431 2.116 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CCC([NH+]3CC(N4CCCC4)C3)CC2)cc1 ZINC001254478967 1318085147 /nfs/dbraw/zinc/08/51/47/1318085147.db2.gz MQHXBDJFJYGPDK-UHFFFAOYSA-N 1 1 330.432 2.344 20 5 EEBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1CCN(C2COC2)CC1 ZINC001254549307 1318118384 /nfs/dbraw/zinc/11/83/84/1318118384.db2.gz RCSKTXGWRCMGKL-AWEZNQCLSA-N 1 1 333.432 2.226 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CC[C@H](OC)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093691 1318646168 /nfs/dbraw/zinc/64/61/68/1318646168.db2.gz ODTHMLAFSZWIQM-HNNXBMFYSA-N 1 1 335.404 2.293 20 5 EEBDMO COc1cc(N2CCC([N@@H+](C)CC3COC3)CC2)ccc1[N+](=O)[O-] ZINC001256100424 1318647651 /nfs/dbraw/zinc/64/76/51/1318647651.db2.gz ICXWQBXQEMUYAW-UHFFFAOYSA-N 1 1 335.404 2.150 20 5 EEBDMO CC(C)(C)c1ccc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001157766843 1318845318 /nfs/dbraw/zinc/84/53/18/1318845318.db2.gz AOESHSSRTYKULX-HZPDHXFCSA-N 1 1 333.432 2.245 20 5 EEBDMO O=[N+]([O-])c1ccc2ncc(N[C@H]3CCC[C@H]3[NH+]3CCOCC3)nc2c1 ZINC001160724568 1320249419 /nfs/dbraw/zinc/24/94/19/1320249419.db2.gz QNEOSFLQPHBBBZ-GOEBONIOSA-N 1 1 343.387 2.203 20 5 EEBDMO CCOC(=O)[C@H]([NH3+])CNc1cc2ccc(Cl)nc2cc1[N+](=O)[O-] ZINC001161950876 1320690371 /nfs/dbraw/zinc/69/03/71/1320690371.db2.gz PRAYGIZLYRVXBC-SECBINFHSA-N 1 1 338.751 2.099 20 5 EEBDMO Cc1ncc([N+](=O)[O-])c(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)n1 ZINC001165090003 1321452532 /nfs/dbraw/zinc/45/25/32/1321452532.db2.gz WXRXRSULMGBFHT-WBVHZDCISA-N 1 1 339.399 2.404 20 5 EEBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2nccc(C)c2[N+](=O)[O-])CC1 ZINC001165107608 1321455965 /nfs/dbraw/zinc/45/59/65/1321455965.db2.gz JNFKBPVSFPCIQY-HNNXBMFYSA-N 1 1 334.420 2.378 20 5 EEBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C1 ZINC001329593797 1334680899 /nfs/dbraw/zinc/68/08/99/1334680899.db2.gz CXAPDVGPGJTXOV-GFCCVEGCSA-N 1 1 336.348 2.026 20 5 EEBDMO Cc1cncc([N+](=O)[O-])c1N1CC[NH+](Cc2ccc(O)cc2)CC1 ZINC001331908692 1335672533 /nfs/dbraw/zinc/67/25/33/1335672533.db2.gz ZSPSSIIHXRGRAI-UHFFFAOYSA-N 1 1 328.372 2.326 20 5 EEBDMO Cc1ccc(NCCNC(=O)Cc2cccc(F)c2[N+](=O)[O-])[nH+]c1 ZINC001333558400 1336070749 /nfs/dbraw/zinc/07/07/49/1336070749.db2.gz KTZHXFJNPVHORQ-UHFFFAOYSA-N 1 1 332.335 2.208 20 5 EEBDMO O=[N+]([O-])c1ccnn1CN1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001337218261 1336665327 /nfs/dbraw/zinc/66/53/27/1336665327.db2.gz KBZURRWRDUIPKC-DLBZAZTESA-N 1 1 341.415 2.203 20 5 EEBDMO CC[N@H+]1CCN(c2nnc(-c3cc(C)cc([N+](=O)[O-])c3)n2C)C[C@@H]1C ZINC001339172878 1336970566 /nfs/dbraw/zinc/97/05/66/1336970566.db2.gz JXBCORDQQFQUNF-ZDUSSCGKSA-N 1 1 344.419 2.229 20 5 EEBDMO COc1cc(CNCc2ccc(CC[NH3+])cc2)c([N+](=O)[O-])cc1O ZINC001579153808 1344344729 /nfs/dbraw/zinc/34/47/29/1344344729.db2.gz MCGFJQKLUGRICO-UHFFFAOYSA-N 1 1 331.372 2.100 20 5 EEBDMO CC(C)CO[C@H]1CC[N@@H+](Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001589640271 1349014037 /nfs/dbraw/zinc/01/40/37/1349014037.db2.gz JBSGTKOLAZCBIN-AWEZNQCLSA-N 1 1 346.391 2.022 20 5 EEBDMO CC(C)CO[C@@H]1CC[N@@H+](Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001589640272 1349014390 /nfs/dbraw/zinc/01/43/90/1349014390.db2.gz JBSGTKOLAZCBIN-CQSZACIVSA-N 1 1 346.391 2.022 20 5 EEBDMO CN(CC[C@H]1CCCC[N@H+]1C)c1cccc(-c2nn[nH]n2)c1[N+](=O)[O-] ZINC001591065740 1349437345 /nfs/dbraw/zinc/43/73/45/1349437345.db2.gz YHSNNLMUPABTTF-GFCCVEGCSA-N 1 1 345.407 2.086 20 5 EEBDMO CCC[N@H+]1CC[C@@H](NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000851821773 1369247722 /nfs/dbraw/zinc/24/77/22/1369247722.db2.gz ZRGKOLVJEVDTNJ-LLVKDONJSA-N 1 1 347.824 2.011 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)nc1-c1ccccn1 ZINC000853511212 1369343444 /nfs/dbraw/zinc/34/34/44/1369343444.db2.gz KKAMTANAIZQIBH-HOCLYGCPSA-N 1 1 343.387 2.454 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)nc1-c1ccccn1 ZINC000853511212 1369343449 /nfs/dbraw/zinc/34/34/49/1369343449.db2.gz KKAMTANAIZQIBH-HOCLYGCPSA-N 1 1 343.387 2.454 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000782532605 1371308618 /nfs/dbraw/zinc/30/86/18/1371308618.db2.gz XTMDLQHWUPEYOJ-VXGBXAGGSA-N 1 1 338.383 2.087 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCN1C ZINC000782532605 1371308621 /nfs/dbraw/zinc/30/86/21/1371308621.db2.gz 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ZINC000342215903 161048021 /nfs/dbraw/zinc/04/80/21/161048021.db2.gz KFMOHLHSPSSMFO-UHFFFAOYSA-N 1 1 343.387 2.217 20 5 EEBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CC[N@H+](C2CC2)C1 ZINC000342649505 161080562 /nfs/dbraw/zinc/08/05/62/161080562.db2.gz GIVIJNPCKIZSNS-LLVKDONJSA-N 1 1 338.795 2.284 20 5 EEBDMO CC[N@@H+](C[C@H]1CCCO1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000343629349 161152760 /nfs/dbraw/zinc/15/27/60/161152760.db2.gz UAMZDKPVQBDWHU-HZPDHXFCSA-N 1 1 333.388 2.201 20 5 EEBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1C[C@H](C)[N@H+](C2CC2)C1 ZINC000343759500 161165740 /nfs/dbraw/zinc/16/57/40/161165740.db2.gz CNNBKHQXXPEBLJ-RYUDHWBXSA-N 1 1 333.388 2.349 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCCOCC(F)(F)F)C2)nc1 ZINC000345672123 161321449 /nfs/dbraw/zinc/32/14/49/161321449.db2.gz ZEYYGSHZDFOMNR-NSHDSACASA-N 1 1 348.325 2.445 20 5 EEBDMO CCOC(=O)C[C@H](C)[N@@H+](C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000346330392 161363677 /nfs/dbraw/zinc/36/36/77/161363677.db2.gz KIESEGACGUSILR-NSHDSACASA-N 1 1 340.376 2.386 20 5 EEBDMO Cc1cc(OCC(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000369067100 166181945 /nfs/dbraw/zinc/18/19/45/166181945.db2.gz UDZKVYPDKNTDHB-AWEZNQCLSA-N 1 1 347.415 2.415 20 5 EEBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](C)C[C@@H]1c1ccccc1 ZINC000369771335 166328670 /nfs/dbraw/zinc/32/86/70/166328670.db2.gz GTDJBPLBLDHERA-SJORKVTESA-N 1 1 340.383 2.126 20 5 EEBDMO CN(CC[N@@H+](C)C1CC1)C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000274513491 269037250 /nfs/dbraw/zinc/03/72/50/269037250.db2.gz LPXGNUNFRRZQGA-UHFFFAOYSA-N 1 1 340.811 2.484 20 5 EEBDMO COC[C@@H](C)OC[C@@H](O)C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000278139180 269211028 /nfs/dbraw/zinc/21/10/28/269211028.db2.gz WGWQWWREFKNOLS-RISCZKNCSA-N 1 1 346.811 2.092 20 5 EEBDMO COC[C@@H](C)OC[C@@H](O)C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000278139180 269211029 /nfs/dbraw/zinc/21/10/29/269211029.db2.gz WGWQWWREFKNOLS-RISCZKNCSA-N 1 1 346.811 2.092 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)c1 ZINC000278840086 269246019 /nfs/dbraw/zinc/24/60/19/269246019.db2.gz KVHIXKIRCZPDTO-AWEZNQCLSA-N 1 1 347.415 2.229 20 5 EEBDMO C[N@H+]1CCC[C@@H]1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279294433 269268516 /nfs/dbraw/zinc/26/85/16/269268516.db2.gz KQYJAIFZILYLHB-GFCCVEGCSA-N 1 1 331.294 2.324 20 5 EEBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000280556943 269372321 /nfs/dbraw/zinc/37/23/21/269372321.db2.gz NMMRFZKAMRQCJN-GFCCVEGCSA-N 1 1 346.387 2.239 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](O)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000275429810 274247869 /nfs/dbraw/zinc/24/78/69/274247869.db2.gz IXIRRXITFGPGMR-DOMZBBRYSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@H](O)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000275429810 274247871 /nfs/dbraw/zinc/24/78/71/274247871.db2.gz IXIRRXITFGPGMR-DOMZBBRYSA-N 1 1 335.404 2.323 20 5 EEBDMO C[C@H](C[NH+]1CCOCC1)N(C)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000278568332 274374805 /nfs/dbraw/zinc/37/48/05/274374805.db2.gz BNSYHXRAZZHWNS-LLVKDONJSA-N 1 1 345.346 2.353 20 5 EEBDMO C[C@@H]1[C@H]([NH+]2CCOCC2)CCN1c1ccc([N+](=O)[O-])c2cnccc21 ZINC000291053857 275265268 /nfs/dbraw/zinc/26/52/68/275265268.db2.gz DZGRZCUYTMIMCJ-CZUORRHYSA-N 1 1 342.399 2.442 20 5 EEBDMO CON(C)C(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000291209766 275282227 /nfs/dbraw/zinc/28/22/27/275282227.db2.gz ILHGLNBLKSSKII-UHFFFAOYSA-N 1 1 341.795 2.480 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](n2cccn2)C1 ZINC000291395663 275301319 /nfs/dbraw/zinc/30/13/19/275301319.db2.gz BMXFNNGHIWOTQT-OAHLLOKOSA-N 1 1 343.387 2.375 20 5 EEBDMO C[C@H]([N@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1(C)CC1 ZINC000181980472 279391390 /nfs/dbraw/zinc/39/13/90/279391390.db2.gz BYKQQIHMXKSCGG-LBPRGKRZSA-N 1 1 326.418 2.489 20 5 EEBDMO C[C@H]([N@@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1(C)CC1 ZINC000181980472 279391393 /nfs/dbraw/zinc/39/13/93/279391393.db2.gz BYKQQIHMXKSCGG-LBPRGKRZSA-N 1 1 326.418 2.489 20 5 EEBDMO Cc1[nH+]ccn1CCCCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000284053574 293023258 /nfs/dbraw/zinc/02/32/58/293023258.db2.gz QPIMDJQUTTVMPQ-UHFFFAOYSA-N 1 1 335.339 2.031 20 5 EEBDMO C[C@@H](CCO)CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000295158637 293631439 /nfs/dbraw/zinc/63/14/39/293631439.db2.gz RYIWESSYXFJATH-CJNGLKHVSA-N 1 1 332.404 2.416 20 5 EEBDMO CC[C@@H](C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC1 ZINC000296809821 294073447 /nfs/dbraw/zinc/07/34/47/294073447.db2.gz FIHNAALYRLXBIW-LLVKDONJSA-N 1 1 336.348 2.059 20 5 EEBDMO NC(=O)c1cccc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000342774183 295188103 /nfs/dbraw/zinc/18/81/03/295188103.db2.gz BUQILDBIPHDSKT-WFASDCNBSA-N 1 1 344.415 2.147 20 5 EEBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000159859459 311347343 /nfs/dbraw/zinc/34/73/43/311347343.db2.gz KQOBHLSHKUVHIY-GXTWGEPZSA-N 1 1 325.434 2.363 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000342304036 312263944 /nfs/dbraw/zinc/26/39/44/312263944.db2.gz DIDDDTZGESUTFI-QWHCGFSZSA-N 1 1 337.445 2.486 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)C[C@H](CO)C1 ZINC000420940752 314003618 /nfs/dbraw/zinc/00/36/18/314003618.db2.gz NDXVLFQCSWGJIF-OCCSQVGLSA-N 1 1 335.404 2.182 20 5 EEBDMO CC[NH2+]CC1CCN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000430592233 314554153 /nfs/dbraw/zinc/55/41/53/314554153.db2.gz PUBJQIFJUJNTDI-QGZVFWFLSA-N 1 1 346.431 2.022 20 5 EEBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC[N@H+](CC)C(C)C ZINC000444165035 315278260 /nfs/dbraw/zinc/27/82/60/315278260.db2.gz FLRPUNAZGDRZSA-UHFFFAOYSA-N 1 1 343.449 2.166 20 5 EEBDMO C[C@H](Nc1c([N+](=O)[O-])ncn1C)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000525461569 317059308 /nfs/dbraw/zinc/05/93/08/317059308.db2.gz ZEMZQQBIDANQPK-DZGCQCFKSA-N 1 1 345.403 2.030 20 5 EEBDMO C[C@H](Nc1c([N+](=O)[O-])ncn1C)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000525461569 317059312 /nfs/dbraw/zinc/05/93/12/317059312.db2.gz ZEMZQQBIDANQPK-DZGCQCFKSA-N 1 1 345.403 2.030 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCN(c2[nH]cc[nH+]2)CC1 ZINC000548062828 318350770 /nfs/dbraw/zinc/35/07/70/318350770.db2.gz ONMNTUHBBSJSMI-UHFFFAOYSA-N 1 1 343.387 2.206 20 5 EEBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000548394547 318385025 /nfs/dbraw/zinc/38/50/25/318385025.db2.gz QVIMLVVNCVPEOW-HNNXBMFYSA-N 1 1 349.387 2.174 20 5 EEBDMO O=C(CC[N@H+]1CCOC[C@H]1C1CCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000582120275 324385090 /nfs/dbraw/zinc/38/50/90/324385090.db2.gz MWYGNJCPMQZHKS-INIZCTEOSA-N 1 1 333.388 2.424 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(N[C@H]3CCn4cc[nH+]c4C3)n2)cc1 ZINC000489914474 447879353 /nfs/dbraw/zinc/87/93/53/447879353.db2.gz MRXRNSUPHZJITL-NSHDSACASA-N 1 1 326.316 2.268 20 5 EEBDMO C[C@H]1C[N@@H+](CCCNc2ncnc3ccc([N+](=O)[O-])cc32)CCCO1 ZINC000617843292 449874504 /nfs/dbraw/zinc/87/45/04/449874504.db2.gz ZDGVFVKEAUQHOE-ZDUSSCGKSA-N 1 1 345.403 2.451 20 5 EEBDMO CO[C@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1(C)C ZINC000296074354 465073108 /nfs/dbraw/zinc/07/31/08/465073108.db2.gz POWGOCUHYUQKBN-INIZCTEOSA-N 1 1 347.415 2.231 20 5 EEBDMO CO[C@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1(C)C ZINC000296074354 465073110 /nfs/dbraw/zinc/07/31/10/465073110.db2.gz POWGOCUHYUQKBN-INIZCTEOSA-N 1 1 347.415 2.231 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@@H]1CCCC[C@H]1O ZINC000351199099 465090699 /nfs/dbraw/zinc/09/06/99/465090699.db2.gz HHKIZVSZRKYQGG-DZGCQCFKSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@@H]1CCCC[C@H]1O ZINC000351199099 465090703 /nfs/dbraw/zinc/09/07/03/465090703.db2.gz HHKIZVSZRKYQGG-DZGCQCFKSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1CCn1ccc([N+](=O)[O-])n1 ZINC000347592412 465110415 /nfs/dbraw/zinc/11/04/15/465110415.db2.gz NGHSATNLIJAFFT-HZPDHXFCSA-N 1 1 343.431 2.386 20 5 EEBDMO Cc1c(CNC(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-] ZINC000358682602 465261639 /nfs/dbraw/zinc/26/16/39/465261639.db2.gz LSDPQWDMTFFYLJ-GDBMZVCRSA-N 1 1 332.404 2.329 20 5 EEBDMO CC(=O)N1CC[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000152810669 462583822 /nfs/dbraw/zinc/58/38/22/462583822.db2.gz VQDGRNNXFPREIL-CYBMUJFWSA-N 1 1 346.412 2.429 20 5 EEBDMO C[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000153472626 462654480 /nfs/dbraw/zinc/65/44/80/462654480.db2.gz UVZRFLXXJRVQPT-LBPRGKRZSA-N 1 1 328.372 2.215 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@H]2C[C@H](O)C[N@@H+]2Cc2ccccc2)nc1 ZINC000089644902 462702552 /nfs/dbraw/zinc/70/25/52/462702552.db2.gz FBHKGVVKJBOIKA-CVEARBPZSA-N 1 1 328.372 2.037 20 5 EEBDMO CC(C)[C@H]1C[N@H+](C)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000153956025 462712429 /nfs/dbraw/zinc/71/24/29/462712429.db2.gz WMBGQUPHRFDROQ-OAHLLOKOSA-N 1 1 337.445 2.486 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000153956025 462712436 /nfs/dbraw/zinc/71/24/36/462712436.db2.gz WMBGQUPHRFDROQ-OAHLLOKOSA-N 1 1 337.445 2.486 20 5 EEBDMO CCNc1ccc(C(=O)N2CC[N@@H+](C)C[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC000154060744 462725959 /nfs/dbraw/zinc/72/59/59/462725959.db2.gz CTPCLGIDFMHDNI-MRXNPFEDSA-N 1 1 334.420 2.439 20 5 EEBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](CO)c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000090884769 462815423 /nfs/dbraw/zinc/81/54/23/462815423.db2.gz TULQEUACUKKLAT-BXUZGUMPSA-N 1 1 334.376 2.111 20 5 EEBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000065674620 462817647 /nfs/dbraw/zinc/81/76/47/462817647.db2.gz IREDOTNTEBHKCG-ZIAGYGMSSA-N 1 1 335.404 2.210 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@@H+](Cc2ccccc2)[C@@H](CO)C2CC2)c1 ZINC000155937136 462962018 /nfs/dbraw/zinc/96/20/18/462962018.db2.gz LQNWXUYMZUHCPC-KRWDZBQOSA-N 1 1 330.388 2.064 20 5 EEBDMO O=C(NCC1CC1)[C@H]1CCC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000051909109 463054008 /nfs/dbraw/zinc/05/40/08/463054008.db2.gz DIQVCXSEHHZUNJ-HNNXBMFYSA-N 1 1 347.415 2.212 20 5 EEBDMO NC(=O)c1ccc(NCC[NH+]2Cc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000068321606 463119541 /nfs/dbraw/zinc/11/95/41/463119541.db2.gz CWBBGRSDWYRRDG-UHFFFAOYSA-N 1 1 326.356 2.121 20 5 EEBDMO CC(C)C[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000026062451 463148872 /nfs/dbraw/zinc/14/88/72/463148872.db2.gz PEWLJKKMBGIFDM-INIZCTEOSA-N 1 1 335.404 2.072 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000056122690 463377884 /nfs/dbraw/zinc/37/78/84/463377884.db2.gz HBANBAIUDMJBCO-UHFFFAOYSA-N 1 1 327.344 2.401 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000081569740 463462953 /nfs/dbraw/zinc/46/29/53/463462953.db2.gz GBQZESLWZYDEST-OAHLLOKOSA-N 1 1 348.447 2.221 20 5 EEBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H]3CN3CCOCC3)nc2c1 ZINC000083213871 463541385 /nfs/dbraw/zinc/54/13/85/463541385.db2.gz IUGWUYCALPSOBZ-AWEZNQCLSA-N 1 1 346.387 2.033 20 5 EEBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]3CN3CCOCC3)nc2c1 ZINC000083213871 463541387 /nfs/dbraw/zinc/54/13/87/463541387.db2.gz IUGWUYCALPSOBZ-AWEZNQCLSA-N 1 1 346.387 2.033 20 5 EEBDMO Nc1c(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000126508920 463642689 /nfs/dbraw/zinc/64/26/89/463642689.db2.gz JURBETSASGQQGT-IUODEOHRSA-N 1 1 344.415 2.266 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)C1CC1 ZINC000152237338 463664845 /nfs/dbraw/zinc/66/48/45/463664845.db2.gz IWNUVFFVISTSAB-UHFFFAOYSA-N 1 1 328.372 2.357 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000152381592 463682743 /nfs/dbraw/zinc/68/27/43/463682743.db2.gz MHZNLSFFNYPXKD-CQSZACIVSA-N 1 1 334.420 2.115 20 5 EEBDMO NC(=O)CC[C@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000170732052 463700776 /nfs/dbraw/zinc/70/07/76/463700776.db2.gz VFSULOFZUWSSGH-CQSZACIVSA-N 1 1 335.404 2.341 20 5 EEBDMO CCOc1cc(C[N@H+]2CCC[C@H](Cn3ccnn3)C2)ccc1[N+](=O)[O-] ZINC000276884981 463793935 /nfs/dbraw/zinc/79/39/35/463793935.db2.gz JIXUTQCBOSMISI-HNNXBMFYSA-N 1 1 345.403 2.497 20 5 EEBDMO COc1cc(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)cc([N+](=O)[O-])c1C ZINC000276915583 463805668 /nfs/dbraw/zinc/80/56/68/463805668.db2.gz PVTVWKVJXQVPMD-IINYFYTJSA-N 1 1 333.388 2.124 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)c1[N+](=O)[O-] ZINC000269313910 463949595 /nfs/dbraw/zinc/94/95/95/463949595.db2.gz GREYSOQFDIBXBC-JTQLQIEISA-N 1 1 335.364 2.067 20 5 EEBDMO COC[C@H](C)OC[C@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000278809265 463989863 /nfs/dbraw/zinc/98/98/63/463989863.db2.gz ZNXOSXLSKHPERC-WMLDXEAASA-N 1 1 340.420 2.218 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000269558900 464019152 /nfs/dbraw/zinc/01/91/52/464019152.db2.gz ZVADAQMVOYPKCF-LBPRGKRZSA-N 1 1 337.424 2.388 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)c1[N+](=O)[O-] ZINC000269558900 464019157 /nfs/dbraw/zinc/01/91/57/464019157.db2.gz ZVADAQMVOYPKCF-LBPRGKRZSA-N 1 1 337.424 2.388 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000269558900 464019162 /nfs/dbraw/zinc/01/91/62/464019162.db2.gz ZVADAQMVOYPKCF-LBPRGKRZSA-N 1 1 337.424 2.388 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[NH+](CC(C)(C)O)CC1 ZINC000179552695 464156115 /nfs/dbraw/zinc/15/61/15/464156115.db2.gz JDDDKFNXWLTASS-UHFFFAOYSA-N 1 1 349.431 2.049 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C[C@H]1CCC[C@H]1O ZINC000270144551 464198531 /nfs/dbraw/zinc/19/85/31/464198531.db2.gz QJHAJVPBOKGFLL-CZUORRHYSA-N 1 1 335.404 2.325 20 5 EEBDMO C[N@H+]1CCCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC1 ZINC000281081430 464324669 /nfs/dbraw/zinc/32/46/69/464324669.db2.gz CPOAJQMHDHZAAL-UHFFFAOYSA-N 1 1 340.383 2.435 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000281211951 464372598 /nfs/dbraw/zinc/37/25/98/464372598.db2.gz QJMWHROIZCFPEM-CYBMUJFWSA-N 1 1 341.433 2.008 20 5 EEBDMO C[C@H]1CSCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000189029684 464417643 /nfs/dbraw/zinc/41/76/43/464417643.db2.gz ZGCAOZFZNZXYOC-JTQLQIEISA-N 1 1 327.381 2.500 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000174962375 464473167 /nfs/dbraw/zinc/47/31/67/464473167.db2.gz YHNBRRPYGJXSSJ-CQSZACIVSA-N 1 1 334.420 2.197 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])CC1 ZINC000281582518 464511529 /nfs/dbraw/zinc/51/15/29/464511529.db2.gz NABPPLJUPCVCSU-UHFFFAOYSA-N 1 1 335.404 2.226 20 5 EEBDMO Cc1cc(OCC(=O)N(C)[C@H]2CC[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000281716875 464558530 /nfs/dbraw/zinc/55/85/30/464558530.db2.gz QKTPGGGUCJPJBD-ZFWWWQNUSA-N 1 1 335.404 2.081 20 5 EEBDMO COCCC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000294836818 464620856 /nfs/dbraw/zinc/62/08/56/464620856.db2.gz FLFFDHBELSIXCO-UHFFFAOYSA-N 1 1 343.811 2.255 20 5 EEBDMO CC[N@H+]1CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000285634562 464636629 /nfs/dbraw/zinc/63/66/29/464636629.db2.gz AJZKBIIIBYSKFO-ZDUSSCGKSA-N 1 1 334.420 2.258 20 5 EEBDMO CCN1CC[N@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000285634562 464636634 /nfs/dbraw/zinc/63/66/34/464636634.db2.gz AJZKBIIIBYSKFO-ZDUSSCGKSA-N 1 1 334.420 2.258 20 5 EEBDMO CCN1CC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000285634562 464636640 /nfs/dbraw/zinc/63/66/40/464636640.db2.gz AJZKBIIIBYSKFO-ZDUSSCGKSA-N 1 1 334.420 2.258 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]CC(C)(C)CCO)c1ccc([N+](=O)[O-])cc1 ZINC000272535093 464650546 /nfs/dbraw/zinc/65/05/46/464650546.db2.gz NYEHZVJQGSGWIT-OAHLLOKOSA-N 1 1 332.404 2.416 20 5 EEBDMO O=[N+]([O-])c1cc2ccccc2nc1N[C@H]1CCC[N@H+](CCCO)C1 ZINC000295029987 464683550 /nfs/dbraw/zinc/68/35/50/464683550.db2.gz VNMFHEDWXUDYTH-AWEZNQCLSA-N 1 1 330.388 2.402 20 5 EEBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(CCn2ccc([N+](=O)[O-])n2)C1 ZINC000176244424 464729879 /nfs/dbraw/zinc/72/98/79/464729879.db2.gz HRZQRCFRBCAGCO-JKSUJKDBSA-N 1 1 335.452 2.378 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)n1 ZINC000286133573 464815585 /nfs/dbraw/zinc/81/55/85/464815585.db2.gz VGYAMLKRTDFUIR-ZACQAIPSSA-N 1 1 342.399 2.296 20 5 EEBDMO C[C@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCS1 ZINC000192189254 464882400 /nfs/dbraw/zinc/88/24/00/464882400.db2.gz NVDXUBGYUSHVEV-STQMWFEESA-N 1 1 326.418 2.162 20 5 EEBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)Nc2ccncc2[N+](=O)[O-])C1 ZINC000183612702 464886897 /nfs/dbraw/zinc/88/68/97/464886897.db2.gz KWNUZRWVYMYZOF-CYBMUJFWSA-N 1 1 335.408 2.479 20 5 EEBDMO CNC(=O)CC[C@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000286559359 464960303 /nfs/dbraw/zinc/96/03/03/464960303.db2.gz TUGZQNNHUDZCAX-ZBFHGGJFSA-N 1 1 335.404 2.009 20 5 EEBDMO CC(C)[C@H]1C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1 ZINC000339811254 465523742 /nfs/dbraw/zinc/52/37/42/465523742.db2.gz JNFZYBHLDZSNDZ-DLBZAZTESA-N 1 1 347.415 2.447 20 5 EEBDMO CC(C)[C@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1 ZINC000339811254 465523747 /nfs/dbraw/zinc/52/37/47/465523747.db2.gz JNFZYBHLDZSNDZ-DLBZAZTESA-N 1 1 347.415 2.447 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCCO1 ZINC000339824294 465534725 /nfs/dbraw/zinc/53/47/25/465534725.db2.gz FKNUUSQBHZYHBW-WBVHZDCISA-N 1 1 338.404 2.081 20 5 EEBDMO C[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1cnn(Cc2ccccc2)c1 ZINC000348399769 465583700 /nfs/dbraw/zinc/58/37/00/465583700.db2.gz REBVFWYYCPUGQN-ZDUSSCGKSA-N 1 1 340.387 2.424 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+](C)[C@@H](C)[C@@H]1C ZINC000356973129 465670213 /nfs/dbraw/zinc/67/02/13/465670213.db2.gz IGCUHCDYTVYRGP-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN(C)[C@@H](C)[C@@H]1C ZINC000356973129 465670221 /nfs/dbraw/zinc/67/02/21/465670221.db2.gz IGCUHCDYTVYRGP-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCN(C)[C@@H](C)[C@@H]1C ZINC000356973129 465670225 /nfs/dbraw/zinc/67/02/25/465670225.db2.gz IGCUHCDYTVYRGP-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO O=[N+]([O-])c1ccc(CNc2nc(N[C@@H]3CCCOC3)cc[nH+]2)cc1 ZINC000337920276 465681281 /nfs/dbraw/zinc/68/12/81/465681281.db2.gz YQOXGOWLIYADKQ-CYBMUJFWSA-N 1 1 329.360 2.588 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000330560103 465706672 /nfs/dbraw/zinc/70/66/72/465706672.db2.gz IOUCMZWVPSJDFA-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CCOC[C@@H]2C2CC2)c([N+](=O)[O-])c1 ZINC000299734011 465875675 /nfs/dbraw/zinc/87/56/75/465875675.db2.gz ZFWYBGRJFMJISE-MRXNPFEDSA-N 1 1 349.387 2.043 20 5 EEBDMO C[C@@H]1C[C@H](N[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000353523863 465952324 /nfs/dbraw/zinc/95/23/24/465952324.db2.gz CIDQFVBLCCZPNH-FRFSOERESA-N 1 1 343.431 2.490 20 5 EEBDMO C[C@H](CN1CCOCC1)[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] 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CCC[C@]1(CO)CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000367359937 466287272 /nfs/dbraw/zinc/28/72/72/466287272.db2.gz CXAOONQHRGGUIV-KRWDZBQOSA-N 1 1 335.404 2.408 20 5 EEBDMO Nc1ccc(-c2noc([C@H]3CCn4cc[nH+]c4C3)n2)cc1[N+](=O)[O-] ZINC000349919607 466308765 /nfs/dbraw/zinc/30/87/65/466308765.db2.gz ZBGYMCBDVYWFLY-JTQLQIEISA-N 1 1 326.316 2.154 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCC[C@@H](CO)C3)o2)c1 ZINC000304662681 466309735 /nfs/dbraw/zinc/30/97/35/466309735.db2.gz ANUVLZPHSXCCRL-CYBMUJFWSA-N 1 1 331.372 2.497 20 5 EEBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CC2)C1 ZINC000341002643 466504660 /nfs/dbraw/zinc/50/46/60/466504660.db2.gz ODBBZSUEZQWXBU-CQSZACIVSA-N 1 1 332.404 2.140 20 5 EEBDMO C[C@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1CO ZINC000362080746 466539494 /nfs/dbraw/zinc/53/94/94/466539494.db2.gz YLUHSULHOYRFIH-JSGCOSHPSA-N 1 1 331.372 2.353 20 5 EEBDMO C[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1CO ZINC000362080747 466540059 /nfs/dbraw/zinc/54/00/59/466540059.db2.gz YLUHSULHOYRFIH-TZMCWYRMSA-N 1 1 331.372 2.353 20 5 EEBDMO C[NH+](C)[C@@H](C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000354507160 466618316 /nfs/dbraw/zinc/61/83/16/466618316.db2.gz VCOVMWREKVSVKX-OAHLLOKOSA-N 1 1 339.355 2.713 20 5 EEBDMO Cn1ccnc1[C@H](N[C@@H]1CC[C@H](C[NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423508096 466761420 /nfs/dbraw/zinc/76/14/20/466761420.db2.gz NMMBXWZVWYOBSY-JGGQBBKZSA-N 1 1 329.404 2.135 20 5 EEBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CC[N@H+]1CC(C)(C)O ZINC000413248557 467196841 /nfs/dbraw/zinc/19/68/41/467196841.db2.gz OFFMZTCLQSHVOW-CYBMUJFWSA-N 1 1 344.415 2.424 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000431997450 467207692 /nfs/dbraw/zinc/20/76/92/467207692.db2.gz HIYSMYLXFNCHJY-CQSZACIVSA-N 1 1 335.404 2.273 20 5 EEBDMO C[C@@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[N@H+](C2CC2)C1 ZINC000451097033 467247851 /nfs/dbraw/zinc/24/78/51/467247851.db2.gz YNAZRINMZISVHL-GFCCVEGCSA-N 1 1 329.404 2.387 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)[C@H]1CC[N@H+](C(C)C)C1 ZINC000452118674 467329738 /nfs/dbraw/zinc/32/97/38/467329738.db2.gz PDGJZDHUGWIWTI-AWEZNQCLSA-N 1 1 334.420 2.256 20 5 EEBDMO C[C@H]1CC[C@@H]([N@@H+](CCO)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000429775575 467369968 /nfs/dbraw/zinc/36/99/68/467369968.db2.gz PZJJNVPIPGHPFO-XJKSGUPXSA-N 1 1 335.404 2.041 20 5 EEBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1nnc(C2CC2)[nH]1 ZINC000449405359 467639935 /nfs/dbraw/zinc/63/99/35/467639935.db2.gz KCSYJLDFGYYLDE-JTQLQIEISA-N 1 1 344.375 2.097 20 5 EEBDMO COC[C@]1(CO)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000449695684 467692579 /nfs/dbraw/zinc/69/25/79/467692579.db2.gz JGDBDHHSTFCMLM-OAHLLOKOSA-N 1 1 346.330 2.027 20 5 EEBDMO COC[C@]1(CO)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000449695684 467692583 /nfs/dbraw/zinc/69/25/83/467692583.db2.gz JGDBDHHSTFCMLM-OAHLLOKOSA-N 1 1 346.330 2.027 20 5 EEBDMO C[C@H]1[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCC[N@H+]1C ZINC000450556201 467869163 /nfs/dbraw/zinc/86/91/63/467869163.db2.gz UUZHEMUHYMEZQQ-WFASDCNBSA-N 1 1 333.388 2.157 20 5 EEBDMO C[C@@H](O)CCC[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000450739689 467899711 /nfs/dbraw/zinc/89/97/11/467899711.db2.gz RNFHOQNCDJIIHE-CYBMUJFWSA-N 1 1 347.419 2.144 20 5 EEBDMO C[C@@H](CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)[N@H+]1CCC[C@H](C)C1 ZINC000516394203 468025812 /nfs/dbraw/zinc/02/58/12/468025812.db2.gz VRQGLZLSYBLZMV-RYUDHWBXSA-N 1 1 349.387 2.174 20 5 EEBDMO CC(C)OC1CC[NH+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000548845969 468146948 /nfs/dbraw/zinc/14/69/48/468146948.db2.gz SEALWRCJCQTANO-UHFFFAOYSA-N 1 1 347.415 2.373 20 5 EEBDMO CCC[N@@H+](CC)C[C@@H](C)Nc1cc2c(cc1[N+](=O)[O-])n(C)c(=O)n2C ZINC000589609047 468166463 /nfs/dbraw/zinc/16/64/63/468166463.db2.gz WZARMXMYFNIJIV-GFCCVEGCSA-N 1 1 349.435 2.318 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H](c3ccncc3)C2)c1 ZINC000559637750 468749751 /nfs/dbraw/zinc/74/97/51/468749751.db2.gz ZQWPJBICYRGOBM-DOTOQJQBSA-N 1 1 343.383 2.219 20 5 EEBDMO C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccnc2ccc([N+](=O)[O-])cc21 ZINC000601165394 468767425 /nfs/dbraw/zinc/76/74/25/468767425.db2.gz NTFCOSPSOZYRQK-UKRRQHHQSA-N 1 1 342.399 2.442 20 5 EEBDMO CCC[N@H+]1CC[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000598344087 468837576 /nfs/dbraw/zinc/83/75/76/468837576.db2.gz ZTCICGBIILJRBJ-CQSZACIVSA-N 1 1 333.388 2.158 20 5 EEBDMO C[C@@H](CO)C1CC[NH+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000593084458 468864634 /nfs/dbraw/zinc/86/46/34/468864634.db2.gz PKLIZWPTGALQPX-STQMWFEESA-N 1 1 335.404 2.262 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC000595505171 468880538 /nfs/dbraw/zinc/88/05/38/468880538.db2.gz QFTRQKTWPCVLJY-RDTXWAMCSA-N 1 1 346.431 2.340 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@H]1COCCO1 ZINC000595736608 468979024 /nfs/dbraw/zinc/97/90/24/468979024.db2.gz MWUJZQADAPNZKX-RISCZKNCSA-N 1 1 348.359 2.053 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@H]1COCCO1 ZINC000595736608 468979031 /nfs/dbraw/zinc/97/90/31/468979031.db2.gz MWUJZQADAPNZKX-RISCZKNCSA-N 1 1 348.359 2.053 20 5 EEBDMO CCC[C@@H](C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)OC ZINC000602673968 469003526 /nfs/dbraw/zinc/00/35/26/469003526.db2.gz AJTVARJNIFYSHF-AWEZNQCLSA-N 1 1 335.404 2.168 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@@H](C)[C@@](C)(CO)C2)cccc1[N+](=O)[O-] ZINC000595870536 469053870 /nfs/dbraw/zinc/05/38/70/469053870.db2.gz HGRVSTAIJXFOIZ-SJKOYZFVSA-N 1 1 335.404 2.182 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](c2ccnc(C)n2)C1 ZINC000602769636 469062215 /nfs/dbraw/zinc/06/22/15/469062215.db2.gz UDSRLJYTUMUVTA-CQSZACIVSA-N 1 1 330.392 2.078 20 5 EEBDMO C[C@@H]1CN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000593729206 469111183 /nfs/dbraw/zinc/11/11/83/469111183.db2.gz QVKLHUZDONNFNX-LBPRGKRZSA-N 1 1 335.379 2.219 20 5 EEBDMO Nc1ccc(N2CC[NH+](C/C=C\c3ccccc3)CC2)nc1[N+](=O)[O-] ZINC000596056208 469130583 /nfs/dbraw/zinc/13/05/83/469130583.db2.gz TXPCDKIXFIVXCU-DAXSKMNVSA-N 1 1 339.399 2.407 20 5 EEBDMO COCC[NH+]1CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1 ZINC000596063453 469134811 /nfs/dbraw/zinc/13/48/11/469134811.db2.gz SKOHTGMFQHWSOJ-UHFFFAOYSA-N 1 1 333.310 2.382 20 5 EEBDMO Cc1cc(NCCC[NH+]2CCC(O)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000596086629 469147112 /nfs/dbraw/zinc/14/71/12/469147112.db2.gz UYRZNHSGNSAQHJ-UHFFFAOYSA-N 1 1 344.415 2.132 20 5 EEBDMO CN(CC[N@@H+](C)C1CCCCC1)c1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596087128 469149457 /nfs/dbraw/zinc/14/94/57/469149457.db2.gz GBSLBIJYEANFPU-UHFFFAOYSA-N 1 1 334.420 2.394 20 5 EEBDMO NC(=O)c1cc(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000596169051 469183918 /nfs/dbraw/zinc/18/39/18/469183918.db2.gz DHYQJKQAVKDWTN-MLGOLLRUSA-N 1 1 344.415 2.147 20 5 EEBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC([N@H+]2CCC[C@H]2C(N)=O)CC1 ZINC000611244106 469208083 /nfs/dbraw/zinc/20/80/83/469208083.db2.gz AXGLRTQEFNGFKB-GUYCJALGSA-N 1 1 346.431 2.070 20 5 EEBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(N2CCC[C@H]2C(N)=O)CC1 ZINC000611244106 469208088 /nfs/dbraw/zinc/20/80/88/469208088.db2.gz AXGLRTQEFNGFKB-GUYCJALGSA-N 1 1 346.431 2.070 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+](C[C@@H]1CCOC1)C1CC1)OCCO2 ZINC000611254255 469209853 /nfs/dbraw/zinc/20/98/53/469209853.db2.gz GLNZBBOOWZPFGY-LBPRGKRZSA-N 1 1 334.372 2.367 20 5 EEBDMO O=C(C[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21)Nc1ccccc1[N+](=O)[O-] ZINC000602997841 469213220 /nfs/dbraw/zinc/21/32/20/469213220.db2.gz RXCYABVMMSYMQZ-XPKDYRNWSA-N 1 1 333.388 2.159 20 5 EEBDMO O=C(C[N@@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21)Nc1ccccc1[N+](=O)[O-] ZINC000602997841 469213230 /nfs/dbraw/zinc/21/32/30/469213230.db2.gz RXCYABVMMSYMQZ-XPKDYRNWSA-N 1 1 333.388 2.159 20 5 EEBDMO Cc1cc(N[C@H]2CCC[N@@H+](CCN3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000603424486 469391761 /nfs/dbraw/zinc/39/17/61/469391761.db2.gz YFBKUKUTLWWKHI-KRWDZBQOSA-N 1 1 348.447 2.112 20 5 EEBDMO CN(C(=O)C[N@@H+]1CCC[C@@H](n2ccnc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000609257942 469908048 /nfs/dbraw/zinc/90/80/48/469908048.db2.gz HLEZYFGBKUVSDY-MRXNPFEDSA-N 1 1 343.387 2.091 20 5 EEBDMO CN(C(=O)C[N@H+]1CCC[C@@H](n2ccnc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000609257942 469908051 /nfs/dbraw/zinc/90/80/51/469908051.db2.gz HLEZYFGBKUVSDY-MRXNPFEDSA-N 1 1 343.387 2.091 20 5 EEBDMO C[C@](CO)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000618280683 469949238 /nfs/dbraw/zinc/94/92/38/469949238.db2.gz YHIHEVSPAMAJMQ-QGZVFWFLSA-N 1 1 326.356 2.468 20 5 EEBDMO COc1ccc(CC(=O)NCCNc2cccc(C)[nH+]2)cc1[N+](=O)[O-] ZINC000610340570 470005807 /nfs/dbraw/zinc/00/58/07/470005807.db2.gz FKVUYCMNHSADDH-UHFFFAOYSA-N 1 1 344.371 2.078 20 5 EEBDMO CC1([C@@H]2CCC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)C2)OCCO1 ZINC000183899935 528052606 /nfs/dbraw/zinc/05/26/06/528052606.db2.gz GCCUOMJYHUTZDT-CQSZACIVSA-N 1 1 336.388 2.449 20 5 EEBDMO C[N@H+](CC(=O)OCc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCSC1 ZINC000767111941 577530854 /nfs/dbraw/zinc/53/08/54/577530854.db2.gz NWQLAZMAGNZPGA-GFCCVEGCSA-N 1 1 328.365 2.214 20 5 EEBDMO C[N@@H+](CC(=O)OCc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCSC1 ZINC000767111941 577530855 /nfs/dbraw/zinc/53/08/55/577530855.db2.gz NWQLAZMAGNZPGA-GFCCVEGCSA-N 1 1 328.365 2.214 20 5 EEBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCOC4(CCOCC4)CC3)c2c1 ZINC000768914363 577565651 /nfs/dbraw/zinc/56/56/51/577565651.db2.gz ZBXUWXGAHRTGRP-UHFFFAOYSA-N 1 1 346.387 2.174 20 5 EEBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCOC4(CCOCC4)CC3)c2c1 ZINC000768914363 577565652 /nfs/dbraw/zinc/56/56/52/577565652.db2.gz ZBXUWXGAHRTGRP-UHFFFAOYSA-N 1 1 346.387 2.174 20 5 EEBDMO CNc1ccc(C(=O)NCCn2cc[nH+]c2C(C)C)cc1[N+](=O)[O-] ZINC000744400259 577897284 /nfs/dbraw/zinc/89/72/84/577897284.db2.gz HGPPVCUYNOJDAA-UHFFFAOYSA-N 1 1 331.376 2.386 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000749146891 577971707 /nfs/dbraw/zinc/97/17/07/577971707.db2.gz RYIXBPQRFOJPDO-CYBMUJFWSA-N 1 1 346.431 2.265 20 5 EEBDMO C[C@@H](C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1[C@H](C)CC[C@H]1C ZINC000741021371 578111503 /nfs/dbraw/zinc/11/15/03/578111503.db2.gz DJKBPENXHVLGLJ-UPJWGTAASA-N 1 1 349.387 2.338 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1NC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000891348584 676417088 /nfs/dbraw/zinc/41/70/88/676417088.db2.gz QARRHLYJUUCVJC-CQSZACIVSA-N 1 1 343.387 2.179 20 5 EEBDMO Cn1c2ccccc2c(N[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1=O ZINC000891999426 677890626 /nfs/dbraw/zinc/89/06/26/677890626.db2.gz DWEXXYIJVGLIMD-LLVKDONJSA-N 1 1 328.372 2.095 20 5 EEBDMO Cn1nccc1[C@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCO1 ZINC000896841446 685354466 /nfs/dbraw/zinc/35/44/66/685354466.db2.gz YXTRSBOGGFERAZ-QGZVFWFLSA-N 1 1 339.355 2.454 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21)c1ccoc1 ZINC001025679627 683234860 /nfs/dbraw/zinc/23/48/60/683234860.db2.gz WJCYOMSWAOGTST-FOLVSLTJSA-N 1 1 327.340 2.048 20 5 EEBDMO Cc1cc[nH]c1C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21 ZINC001025763218 683264353 /nfs/dbraw/zinc/26/43/53/683264353.db2.gz OAUMEKFAQJGFIY-HALDLXJZSA-N 1 1 340.383 2.092 20 5 EEBDMO C[C@@H](Nc1nc2ccccc2cc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C ZINC000895246190 684381414 /nfs/dbraw/zinc/38/14/14/684381414.db2.gz MTPRKRBTIYRYLT-MLGOLLRUSA-N 1 1 329.404 2.189 20 5 EEBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000893264532 684386424 /nfs/dbraw/zinc/38/64/24/684386424.db2.gz FUFKGLBZGZQHDA-HZPDHXFCSA-N 1 1 332.404 2.015 20 5 EEBDMO CC(C)c1ccc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)cc1[N+](=O)[O-] ZINC000896542065 685037880 /nfs/dbraw/zinc/03/78/80/685037880.db2.gz BEOJDQVNHDQZKU-DYVFJYSZSA-N 1 1 348.447 2.082 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC3(CC2)OCCO3)cccc1[N+](=O)[O-] ZINC000026936602 686320911 /nfs/dbraw/zinc/32/09/11/686320911.db2.gz WBWYQTWTFAILTF-ZDUSSCGKSA-N 1 1 349.387 2.069 20 5 EEBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CCN(C(=O)c2ncc[nH]2)CC1 ZINC000985422054 686625940 /nfs/dbraw/zinc/62/59/40/686625940.db2.gz WPWFQGNSAWRNSF-UHFFFAOYSA-N 1 1 343.387 2.055 20 5 EEBDMO Cc1ccc(CC[N@H+](C)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC000985425322 686651601 /nfs/dbraw/zinc/65/16/01/686651601.db2.gz FRWHOIOWQRZZIR-QZTJIDSGSA-N 1 1 345.443 2.126 20 5 EEBDMO Cc1ccc(CC[N@@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000985425322 686651604 /nfs/dbraw/zinc/65/16/04/686651604.db2.gz FRWHOIOWQRZZIR-QZTJIDSGSA-N 1 1 345.443 2.126 20 5 EEBDMO Cc1ccc(CC[N@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000985425322 686651606 /nfs/dbraw/zinc/65/16/06/686651606.db2.gz FRWHOIOWQRZZIR-QZTJIDSGSA-N 1 1 345.443 2.126 20 5 EEBDMO C[C@H]1CCC[N@H+]1CCNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000897501540 690750151 /nfs/dbraw/zinc/75/01/51/690750151.db2.gz WGSAXVHZZAXLPZ-AWEZNQCLSA-N 1 1 334.420 2.263 20 5 EEBDMO O=C1[C@@H]([NH2+]CC[N+](=O)[O-])CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000905202831 694567700 /nfs/dbraw/zinc/56/77/00/694567700.db2.gz NLRADIDAJGQDFL-ZDUSSCGKSA-N 1 1 345.321 2.063 20 5 EEBDMO Cc1nc(C(=O)NCC2C[NH+](Cc3cccc([N+](=O)[O-])c3)C2)c(C)o1 ZINC001032065916 1192065397 /nfs/dbraw/zinc/06/53/97/1192065397.db2.gz SGBFOVYPTAONIH-UHFFFAOYSA-N 1 1 344.371 2.061 20 5 EEBDMO COc1ccc(C(=O)NCC2C[NH+](Cc3ccccc3[N+](=O)[O-])C2)o1 ZINC001032070025 1192130072 /nfs/dbraw/zinc/13/00/72/1192130072.db2.gz GZZWFPJZLKJQNJ-UHFFFAOYSA-N 1 1 345.355 2.058 20 5 EEBDMO CCn1cccc1C(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001032188945 1192920597 /nfs/dbraw/zinc/92/05/97/1192920597.db2.gz GVWGVFWGLGEAOZ-UHFFFAOYSA-N 1 1 342.399 2.278 20 5 EEBDMO CON(C)C(=O)[C@@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872091118 1198044605 /nfs/dbraw/zinc/04/46/05/1198044605.db2.gz VYEZNNWMJHCDKG-NXEZZACHSA-N 1 1 327.406 2.376 20 5 EEBDMO CC1=C(C)C[N@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000794878169 1198430341 /nfs/dbraw/zinc/43/03/41/1198430341.db2.gz ASDDCLCSGHGODZ-UHFFFAOYSA-N 1 1 344.371 2.363 20 5 EEBDMO CC1=C(C)C[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000794878169 1198430343 /nfs/dbraw/zinc/43/03/43/1198430343.db2.gz ASDDCLCSGHGODZ-UHFFFAOYSA-N 1 1 344.371 2.363 20 5 EEBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000810118186 1199301970 /nfs/dbraw/zinc/30/19/70/1199301970.db2.gz NIGVLEJKBWNKNC-SNVBAGLBSA-N 1 1 335.451 2.055 20 5 EEBDMO CC(C)(O)C1CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000877753698 1200075797 /nfs/dbraw/zinc/07/57/97/1200075797.db2.gz KQRFIUVOODSMTH-UHFFFAOYSA-N 1 1 336.388 2.349 20 5 EEBDMO C[C@@H]1CN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)C[N@H+]1C ZINC000878335546 1200403483 /nfs/dbraw/zinc/40/34/83/1200403483.db2.gz OKEZPDBTSRENJS-NEPJUHHUSA-N 1 1 331.376 2.169 20 5 EEBDMO Cc1c(C(=O)N2CC[NH2+][C@@H](c3ccc(O)cc3)C2)cccc1[N+](=O)[O-] ZINC000870078128 1200446454 /nfs/dbraw/zinc/44/64/54/1200446454.db2.gz SWUPARSLGJYFKW-MRXNPFEDSA-N 1 1 341.367 2.396 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@](C)(C(=O)OC(C)(C)C)C1 ZINC000878697257 1200625182 /nfs/dbraw/zinc/62/51/82/1200625182.db2.gz COYUJVPKMHMLTM-INIZCTEOSA-N 1 1 338.408 2.153 20 5 EEBDMO C[C@H](C(=O)N1C[C@@H]2CC[N@@H+](C)C[C@@H]2C1)c1ccc([N+](=O)[O-])cc1F ZINC000812330053 1200642623 /nfs/dbraw/zinc/64/26/23/1200642623.db2.gz APRLWZBVHDKYMS-RWMBFGLXSA-N 1 1 335.379 2.248 20 5 EEBDMO COc1cccc([C@@H]2CN(Cc3cc(O)ccc3[N+](=O)[O-])CC[NH2+]2)c1 ZINC000879522458 1201119725 /nfs/dbraw/zinc/11/97/25/1201119725.db2.gz JQGUFYAQUFDVDL-KRWDZBQOSA-N 1 1 343.383 2.456 20 5 EEBDMO C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc2c(c1)CC(=O)N2C ZINC000886109993 1202473597 /nfs/dbraw/zinc/47/35/97/1202473597.db2.gz WCQCMSYFWFJMSS-NSHDSACASA-N 1 1 326.356 2.360 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)NCCCN(C)c1ccc(C)cc1[N+](=O)[O-] ZINC001095680861 1205912801 /nfs/dbraw/zinc/91/28/01/1205912801.db2.gz VLXGYEYMRKMXTP-UHFFFAOYSA-N 1 1 345.403 2.051 20 5 EEBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1CCCOC1 ZINC000796199959 1215509290 /nfs/dbraw/zinc/50/92/90/1215509290.db2.gz UYCYDIAHQYZEKV-GFCCVEGCSA-N 1 1 325.340 2.173 20 5 EEBDMO CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2ccc(CF)cc2)CC1 ZINC001045436274 1233744335 /nfs/dbraw/zinc/74/43/35/1233744335.db2.gz OSZQEXYSTFFQEP-HZPDHXFCSA-N 1 1 349.406 2.292 20 5 EEBDMO O=C(c1ccc[nH]1)N1C[C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001048677139 1238267058 /nfs/dbraw/zinc/26/70/58/1238267058.db2.gz LTRLFYDLRGJHSY-GASCZTMLSA-N 1 1 340.383 2.127 20 5 EEBDMO O=C(NCC1=CC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1)c1cocn1 ZINC001000516879 1240439676 /nfs/dbraw/zinc/43/96/76/1240439676.db2.gz BDCLQAYXGNDTSS-UHFFFAOYSA-N 1 1 342.355 2.145 20 5 EEBDMO O=C(NCC1=CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1)c1cocn1 ZINC001000516879 1240439683 /nfs/dbraw/zinc/43/96/83/1240439683.db2.gz BDCLQAYXGNDTSS-UHFFFAOYSA-N 1 1 342.355 2.145 20 5 EEBDMO [NH3+]CC1(c2ccccc2)CCN(Cc2cccnc2[N+](=O)[O-])CC1 ZINC000903792902 1241987659 /nfs/dbraw/zinc/98/76/59/1241987659.db2.gz JERGYDGDDIUKKN-UHFFFAOYSA-N 1 1 326.400 2.482 20 5 EEBDMO Cc1ocnc1C(=O)NCCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001234998960 1305078679 /nfs/dbraw/zinc/07/86/79/1305078679.db2.gz BWZGFPYSFOAZRM-UHFFFAOYSA-N 1 1 332.360 2.143 20 5 EEBDMO COCC1CC[NH+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000112331565 1292843920 /nfs/dbraw/zinc/84/39/20/1292843920.db2.gz GCXMOAJOMRHIQA-UHFFFAOYSA-N 1 1 331.376 2.169 20 5 EEBDMO NC(=O)c1cc([N+](=O)[O-])ccc1O[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001226166881 1301282207 /nfs/dbraw/zinc/28/22/07/1301282207.db2.gz ZIYZKDOABJFZLI-HNNXBMFYSA-N 1 1 341.367 2.347 20 5 EEBDMO CC[N@H+]1CCC[C@H](Oc2c(OC)cc(C(=O)OC)cc2[N+](=O)[O-])C1 ZINC001226364949 1301379578 /nfs/dbraw/zinc/37/95/78/1301379578.db2.gz UZCYGAAWFIPFTR-LBPRGKRZSA-N 1 1 338.360 2.253 20 5 EEBDMO CC[N@H+]1CCC[C@@H](Oc2c(OC)cc(C(=O)OC)cc2[N+](=O)[O-])C1 ZINC001226364944 1301379765 /nfs/dbraw/zinc/37/97/65/1301379765.db2.gz UZCYGAAWFIPFTR-GFCCVEGCSA-N 1 1 338.360 2.253 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](Oc2ccc3c(c2)oc2cc(=O)ccc-2[n+]3[O-])C1 ZINC001227449413 1301832846 /nfs/dbraw/zinc/83/28/46/1301832846.db2.gz PTZKSMSOJIEAAU-HNNXBMFYSA-N 1 1 340.379 2.393 20 5 EEBDMO CCCSc1nc(O[C@H]2CC[N@@H+](CC)C2)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229790773 1302945905 /nfs/dbraw/zinc/94/59/05/1302945905.db2.gz DGYJRLGYGKSMPF-VIFPVBQESA-N 1 1 328.394 2.066 20 5 EEBDMO CC[N@H+]1CC[C@H](Oc2c([N+](=O)[O-])cc(C)c(OC)c2[N+](=O)[O-])C1 ZINC001229867576 1302970615 /nfs/dbraw/zinc/97/06/15/1302970615.db2.gz AHJLCHMCCXROLH-JTQLQIEISA-N 1 1 325.321 2.293 20 5 EEBDMO O=[N+]([O-])c1ccccc1N1CCC(Oc2[nH+][nH]cc3nncc2-3)CC1 ZINC001230899874 1303534486 /nfs/dbraw/zinc/53/44/86/1303534486.db2.gz BSIBWUNFVWSXDB-UHFFFAOYSA-N 1 1 340.343 2.309 20 5 EEBDMO COCCCCC(=O)NCCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001235338013 1305197357 /nfs/dbraw/zinc/19/73/57/1305197357.db2.gz JUHZKZKAQPCNTI-UHFFFAOYSA-N 1 1 337.420 2.350 20 5 EEBDMO CCS(=O)(=O)CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000831538536 1314597738 /nfs/dbraw/zinc/59/77/38/1314597738.db2.gz DAZYYHOYRXNISD-CQSZACIVSA-N 1 1 326.418 2.209 20 5 EEBDMO CCS(=O)(=O)CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000831538536 1314597741 /nfs/dbraw/zinc/59/77/41/1314597741.db2.gz DAZYYHOYRXNISD-CQSZACIVSA-N 1 1 326.418 2.209 20 5 EEBDMO CO[C@H]1CC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C[C@@H]1C ZINC000840122627 1315302218 /nfs/dbraw/zinc/30/22/18/1315302218.db2.gz ISUMKRZNDHEIOC-WFASDCNBSA-N 1 1 331.376 2.168 20 5 EEBDMO CO[C@H]1CC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C[C@@H]1C ZINC000840122627 1315302223 /nfs/dbraw/zinc/30/22/23/1315302223.db2.gz ISUMKRZNDHEIOC-WFASDCNBSA-N 1 1 331.376 2.168 20 5 EEBDMO Cc1nn(C[N@H+]2CCC[C@H]2[C@@H]2CCCOC2)c2ncc([N+](=O)[O-])cc12 ZINC000842617697 1315733833 /nfs/dbraw/zinc/73/38/33/1315733833.db2.gz RAFPTCJWNZXYQW-CJNGLKHVSA-N 1 1 345.403 2.496 20 5 EEBDMO CC(=O)N(C)[C@H]1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254481291 1318084906 /nfs/dbraw/zinc/08/49/06/1318084906.db2.gz ANQPXOYCCRZYPL-SFHVURJKSA-N 1 1 346.431 2.116 20 5 EEBDMO CCOCc1ncn2c1C[N@@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001254595101 1318138568 /nfs/dbraw/zinc/13/85/68/1318138568.db2.gz IYPGZBBTXKVBDV-MRXNPFEDSA-N 1 1 342.399 2.311 20 5 EEBDMO CCOCc1ncn2c1C[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001254595101 1318138576 /nfs/dbraw/zinc/13/85/76/1318138576.db2.gz IYPGZBBTXKVBDV-MRXNPFEDSA-N 1 1 342.399 2.311 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCN(Cc3ccncc3)CC1)C2 ZINC001254597985 1318138854 /nfs/dbraw/zinc/13/88/54/1318138854.db2.gz FREBBZNLGZQSAS-IBGZPJMESA-N 1 1 338.411 2.275 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1C[C@@H](OCC3CC3)[C@H]3COC[C@H]31)C2 ZINC001254599974 1318141203 /nfs/dbraw/zinc/14/12/03/1318141203.db2.gz NLMHTYFATGRZDR-FCGDIQPGSA-N 1 1 344.411 2.188 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1C[C@@H]3C[C@H]1[C@@H](C(F)(F)F)O3)C2 ZINC001254609572 1318144893 /nfs/dbraw/zinc/14/48/93/1318144893.db2.gz XOYQWUYXDCRYLW-RFGFWPKPSA-N 1 1 328.290 2.466 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1C[C@@H]3C[C@H]1[C@@H](C(F)(F)F)O3)C2 ZINC001254609572 1318144901 /nfs/dbraw/zinc/14/49/01/1318144901.db2.gz XOYQWUYXDCRYLW-RFGFWPKPSA-N 1 1 328.290 2.466 20 5 EEBDMO Cc1[nH+]c(N)ccc1CNc1cc(/C=C/N(C)C)c([N+](=O)[O-])cn1 ZINC001156981216 1318324791 /nfs/dbraw/zinc/32/47/91/1318324791.db2.gz UNIUBHMNHQNOEB-VOTSOKGWSA-N 1 1 328.376 2.420 20 5 EEBDMO COc1cc2ncnc(N3C[C@H]4[C@H](C3)CCC[N@H+]4C)c2cc1[N+](=O)[O-] ZINC001157265622 1318532231 /nfs/dbraw/zinc/53/22/31/1318532231.db2.gz KGDIHVQODPILPL-NHYWBVRUSA-N 1 1 343.387 2.077 20 5 EEBDMO O=[N+]([O-])c1cc(-c2ccc(N3CC[N@H+]4CC[C@@H]4C3)nn2)ccc1F ZINC001158431307 1319234203 /nfs/dbraw/zinc/23/42/03/1319234203.db2.gz OXHDZCXQRANTIP-GFCCVEGCSA-N 1 1 329.335 2.085 20 5 EEBDMO Cc1nc(N(C)CCC[N@@H+](C)Cc2ccncc2)ncc1[N+](=O)[O-] ZINC001262029890 1322224351 /nfs/dbraw/zinc/22/43/51/1322224351.db2.gz NYRJMRLZVMGFGE-UHFFFAOYSA-N 1 1 330.392 2.047 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H]2CCCC[N@@H+]2C)c1 ZINC001262653067 1322337758 /nfs/dbraw/zinc/33/77/58/1322337758.db2.gz YKZFHTYGLIYAKV-CQSZACIVSA-N 1 1 335.404 2.273 20 5 EEBDMO CCC[N@H+]1CC[C@H](Nc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C1 ZINC001307176141 1329075419 /nfs/dbraw/zinc/07/54/19/1329075419.db2.gz WVWUNYGAGRJNKF-NSHDSACASA-N 1 1 345.359 2.369 20 5 EEBDMO CC(C)CCC[N@@H+](C)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC001307871955 1331552405 /nfs/dbraw/zinc/55/24/05/1331552405.db2.gz KFMKCZOMZKMCGA-UHFFFAOYSA-N 1 1 343.449 2.241 20 5 EEBDMO CCOC(=O)[C@H]1C[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)CC12COC2 ZINC001308927043 1331609309 /nfs/dbraw/zinc/60/93/09/1331609309.db2.gz GGKJLXFVBZTPGP-OAHLLOKOSA-N 1 1 348.399 2.223 20 5 EEBDMO CCCC[N@@H+](C)CCNS(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1C ZINC001309171252 1331619909 /nfs/dbraw/zinc/61/99/09/1331619909.db2.gz AMYKQLBHBKLTRQ-UHFFFAOYSA-N 1 1 343.449 2.222 20 5 EEBDMO O=C(NCC[NH+]1CC=CC1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC001318764460 1332591681 /nfs/dbraw/zinc/59/16/81/1332591681.db2.gz AVYSQEPCCCRQNZ-UHFFFAOYSA-N 1 1 344.415 2.187 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)nc1-c1ccncc1 ZINC001319328676 1332685356 /nfs/dbraw/zinc/68/53/56/1332685356.db2.gz PJOCVTRKAYKLIJ-GDBMZVCRSA-N 1 1 343.387 2.312 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)nc1-c1ccncc1 ZINC001319328676 1332685360 /nfs/dbraw/zinc/68/53/60/1332685360.db2.gz PJOCVTRKAYKLIJ-GDBMZVCRSA-N 1 1 343.387 2.312 20 5 EEBDMO COc1cc(-c2nnc(C[NH+](C)C)o2)c([N+](=O)[O-])cc1OC(F)F ZINC001322340836 1333250221 /nfs/dbraw/zinc/25/02/21/1333250221.db2.gz WAWBKIYRZTYGPK-UHFFFAOYSA-N 1 1 344.274 2.316 20 5 EEBDMO C[N@H+]1CCCC[C@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC001337536479 1336712045 /nfs/dbraw/zinc/71/20/45/1336712045.db2.gz UOVBDNJMVOKTKK-HNNXBMFYSA-N 1 1 333.388 2.158 20 5 EEBDMO CN(Cc1ccccc1[N+](=O)[O-])c1nnc([C@H]2CCC[N@@H+]2C)n1C ZINC001338772848 1336906330 /nfs/dbraw/zinc/90/63/30/1336906330.db2.gz ZIFSKICWLPPZSU-CQSZACIVSA-N 1 1 330.392 2.126 20 5 EEBDMO CN(Cc1ccccc1[N+](=O)[O-])c1nnc([C@H]2CCC[N@H+]2C)n1C ZINC001338772848 1336906332 /nfs/dbraw/zinc/90/63/32/1336906332.db2.gz ZIFSKICWLPPZSU-CQSZACIVSA-N 1 1 330.392 2.126 20 5 EEBDMO C[N@@H+]1CCC[C@@H]1c1cc(C(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)n[nH]1 ZINC001353626418 1338306930 /nfs/dbraw/zinc/30/69/30/1338306930.db2.gz OOXWCMYOHLZTBI-MRXNPFEDSA-N 1 1 341.371 2.241 20 5 EEBDMO C[N@H+]1CCC[C@@H]1c1cc(C(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)n[nH]1 ZINC001353626418 1338306931 /nfs/dbraw/zinc/30/69/31/1338306931.db2.gz OOXWCMYOHLZTBI-MRXNPFEDSA-N 1 1 341.371 2.241 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1CCNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590256991 1349231813 /nfs/dbraw/zinc/23/18/13/1349231813.db2.gz OTAKNHYWQLBIJS-LLVKDONJSA-N 1 1 331.380 2.061 20 5 EEBDMO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590337744 1349273749 /nfs/dbraw/zinc/27/37/49/1349273749.db2.gz RSCUEHOQFBXPLR-ZJUUUORDSA-N 1 1 334.405 2.101 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c(-c2nn[nH]n2)c1 ZINC001593478583 1349811410 /nfs/dbraw/zinc/81/14/10/1349811410.db2.gz WENHOTBNSBJJCC-HUUCEWRRSA-N 1 1 343.391 2.204 20 5 EEBDMO Cc1cccc(NCCNc2ccc([N+](=O)[O-])c(-c3nn[nH]n3)c2)[nH+]1 ZINC001605919985 1351253530 /nfs/dbraw/zinc/25/35/30/1351253530.db2.gz VJWNOFADIMIVCW-UHFFFAOYSA-N 1 1 340.347 2.002 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000850433625 1367142826 /nfs/dbraw/zinc/14/28/26/1367142826.db2.gz OXNMDFVLIIVVIM-CFVMTHIKSA-N 1 1 335.404 2.117 20 5 EEBDMO O=C(CCC1CC1)N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21 ZINC001752843303 1406477244 /nfs/dbraw/zinc/47/72/44/1406477244.db2.gz CXRHHMCMUOOIHG-HWWDLCQESA-N 1 1 329.400 2.331 20 5 EEBDMO Cc1ccnc(N2CC[NH+](CCc3ccccn3)CC2)c1[N+](=O)[O-] ZINC001165054250 722009847 /nfs/dbraw/zinc/00/98/47/722009847.db2.gz UOUFXTMDGYKFMF-UHFFFAOYSA-N 1 1 327.388 2.058 20 5 EEBDMO O=[N+]([O-])c1ccc2nc(Cl)nc(N3CCc4[nH+]ccn4CC3)c2c1 ZINC001167178404 757459257 /nfs/dbraw/zinc/45/92/57/757459257.db2.gz YQGMMDJMBJMJAV-UHFFFAOYSA-N 1 1 344.762 2.451 20 5 EEBDMO Cc1cc(C(=O)NCC2C[NH+](Cc3ccccc3[N+](=O)[O-])C2)co1 ZINC001031632677 770489662 /nfs/dbraw/zinc/48/96/62/770489662.db2.gz DZNDMKJCQWMBJE-UHFFFAOYSA-N 1 1 329.356 2.358 20 5 EEBDMO COCc1cc([N+](=O)[O-])ccc1N1CCC([N@@H+](C)CCCO)CC1 ZINC000175125633 773467432 /nfs/dbraw/zinc/46/74/32/773467432.db2.gz LUQCYAPNOGADIC-UHFFFAOYSA-N 1 1 337.420 2.024 20 5 EEBDMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000893913675 780301105 /nfs/dbraw/zinc/30/11/05/780301105.db2.gz HUXDHINFWAXAOM-SNVBAGLBSA-N 1 1 327.319 2.397 20 5 EEBDMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000893913675 780301114 /nfs/dbraw/zinc/30/11/14/780301114.db2.gz HUXDHINFWAXAOM-SNVBAGLBSA-N 1 1 327.319 2.397 20 5 EEBDMO CCn1nc(C)c(C[NH2+][C@@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)n1 ZINC000818344091 785247300 /nfs/dbraw/zinc/24/73/00/785247300.db2.gz ISQCUABLNNTZKG-NSHDSACASA-N 1 1 346.391 2.022 20 5 EEBDMO CC[N@H+](c1ccc(NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1)C(C)C ZINC000819398842 785529756 /nfs/dbraw/zinc/52/97/56/785529756.db2.gz QQSSOMMVXBBMNX-QGZVFWFLSA-N 1 1 347.419 2.499 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC/C=C\CNc1cc(C)ccc1[N+](=O)[O-] ZINC001107321627 786858515 /nfs/dbraw/zinc/85/85/15/786858515.db2.gz HQJXWSSECFSBOF-WAYWQWQTSA-N 1 1 334.420 2.329 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NC/C=C\CNc1ncc(C)cc1[N+](=O)[O-] ZINC001107392109 787107256 /nfs/dbraw/zinc/10/72/56/787107256.db2.gz UOEOQXDESQWFEM-FPLPWBNLSA-N 1 1 349.435 2.113 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)NC/C=C/CNc1cccc(F)c1[N+](=O)[O-] ZINC001107424655 787198427 /nfs/dbraw/zinc/19/84/27/787198427.db2.gz AAVZNPPXPHRIMU-NSCUHMNNSA-N 1 1 347.350 2.023 20 5 EEBDMO Cc1cc([N+](=O)[O-])cnc1NCCCN(C)C(=O)C[N@@H+](C)C1CCC1 ZINC001109653236 805831190 /nfs/dbraw/zinc/83/11/90/805831190.db2.gz PKGKTCBPHDPBFR-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO Cc1[nH+]ccn1CCCN(C)C(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000823973207 788004938 /nfs/dbraw/zinc/00/49/38/788004938.db2.gz FBSTUXPTTHJJED-UHFFFAOYSA-N 1 1 332.364 2.236 20 5 EEBDMO COc1c(F)cc(NCC2([NH+]3CCCC3)COC2)cc1[N+](=O)[O-] ZINC001168451304 795098516 /nfs/dbraw/zinc/09/85/16/795098516.db2.gz HZKGQUKDOZJALH-UHFFFAOYSA-N 1 1 325.340 2.019 20 5 EEBDMO CCN(CCNc1ccc(F)cc1[N+](=O)[O-])C(=O)C[N@@H+](C)C(C)C ZINC001106779083 796522125 /nfs/dbraw/zinc/52/21/25/796522125.db2.gz UQAVTUJRSBAQBW-UHFFFAOYSA-N 1 1 340.399 2.335 20 5 EEBDMO CCOC(=O)[C@@H]1C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCO1 ZINC001172914287 797148453 /nfs/dbraw/zinc/14/84/53/797148453.db2.gz GKCBAJMGVXDANI-WBVHZDCISA-N 1 1 348.399 2.106 20 5 EEBDMO CCOC(=O)[C@@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCO1 ZINC001172914287 797148457 /nfs/dbraw/zinc/14/84/57/797148457.db2.gz GKCBAJMGVXDANI-WBVHZDCISA-N 1 1 348.399 2.106 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)N1CCCN(c2ccccc2[N+](=O)[O-])CC1 ZINC001095197814 797483117 /nfs/dbraw/zinc/48/31/17/797483117.db2.gz JGVCIXZSPIZCLS-UHFFFAOYSA-N 1 1 348.447 2.364 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N1CCC(Nc2ncc([N+](=O)[O-])cc2C)CC1 ZINC001095235709 797569016 /nfs/dbraw/zinc/56/90/16/797569016.db2.gz IFUPTRDTQSEOKR-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO Cc1cccc(C)c1C[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001002782580 798604126 /nfs/dbraw/zinc/60/41/26/798604126.db2.gz LTVVBWFUFXQUHF-NVXWUHKLSA-N 1 1 331.416 2.049 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)[C@@H]2C[C@@H]21 ZINC001169012846 803571095 /nfs/dbraw/zinc/57/10/95/803571095.db2.gz SHGMNRDJJJJWCG-DGAVXFQQSA-N 1 1 325.409 2.125 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)[C@@H]2C[C@@H]21 ZINC001169012846 803571097 /nfs/dbraw/zinc/57/10/97/803571097.db2.gz SHGMNRDJJJJWCG-DGAVXFQQSA-N 1 1 325.409 2.125 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCCn3cnc(COCC4CC4)c3C2)C1 ZINC001169024198 803590091 /nfs/dbraw/zinc/59/00/91/803590091.db2.gz QLHHBPKLUALOJL-HOTGVXAUSA-N 1 1 348.447 2.461 20 5 EEBDMO COC(=O)[C@]1(C)CC[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170355729 809902676 /nfs/dbraw/zinc/90/26/76/809902676.db2.gz QNPVAHZVPPPQJF-SJKOYZFVSA-N 1 1 336.388 2.419 20 5 EEBDMO NC(=O)CC[N@H+](Cc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000178570028 232263603 /nfs/dbraw/zinc/26/36/03/232263603.db2.gz QPDLVXDQBXPIME-QGZVFWFLSA-N 1 1 343.383 2.006 20 5 EEBDMO Cc1[nH+]ccn1CCCCNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000130166305 223128291 /nfs/dbraw/zinc/12/82/91/223128291.db2.gz VCHHIEYIIAYIGK-UHFFFAOYSA-N 1 1 345.403 2.498 20 5 EEBDMO C[C@@H]1C[C@@H](C)C[NH+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000023698136 212390096 /nfs/dbraw/zinc/39/00/96/212390096.db2.gz JYKCQUUXVGEMJY-GHMZBOCLSA-N 1 1 335.360 2.240 20 5 EEBDMO COCC(C)(C)[NH+]1CCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])CC1 ZINC000424999293 241104335 /nfs/dbraw/zinc/10/43/35/241104335.db2.gz KVGZYDRSYFXEMJ-UHFFFAOYSA-N 1 1 335.404 2.086 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000450109059 242724512 /nfs/dbraw/zinc/72/45/12/242724512.db2.gz ZUFBIWNBOOVVOO-LRDDRELGSA-N 1 1 345.399 2.157 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1 ZINC000451637248 243186236 /nfs/dbraw/zinc/18/62/36/243186236.db2.gz XIWZQEHMQHKDHU-OSAQELSMSA-N 1 1 343.387 2.342 20 5 EEBDMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000246826238 243322991 /nfs/dbraw/zinc/32/29/91/243322991.db2.gz ALYZYHKPVVCNDK-CABCVRRESA-N 1 1 346.431 2.116 20 5 EEBDMO C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000456139522 244160865 /nfs/dbraw/zinc/16/08/65/244160865.db2.gz LFJBNQNAZCXSQB-UNEWFSDZSA-N 1 1 331.416 2.499 20 5 EEBDMO CCOC[C@@H]1CCCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000459713925 245222213 /nfs/dbraw/zinc/22/22/13/245222213.db2.gz OFFRFKCSEZTFBG-LSDHHAIUSA-N 1 1 338.404 2.226 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC1 ZINC000078596874 217083311 /nfs/dbraw/zinc/08/33/11/217083311.db2.gz TZEWFKXXXPDRSH-UHFFFAOYSA-N 1 1 346.431 2.363 20 5 EEBDMO C[C@@H](C[NH+]1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000266444062 248304089 /nfs/dbraw/zinc/30/40/89/248304089.db2.gz WQZMPVLSTJAVFG-NSHDSACASA-N 1 1 344.362 2.244 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c1 ZINC000266540497 248351525 /nfs/dbraw/zinc/35/15/25/248351525.db2.gz GUFZDRORXJYZPX-HZPDHXFCSA-N 1 1 334.351 2.128 20 5 EEBDMO CNC(=O)CCC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000093734161 218243587 /nfs/dbraw/zinc/24/35/87/218243587.db2.gz RIEFEQXGNJOKFX-UHFFFAOYSA-N 1 1 331.319 2.154 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093770304 218248872 /nfs/dbraw/zinc/24/88/72/218248872.db2.gz RMYQAZSWQSATBX-CYBMUJFWSA-N 1 1 337.420 2.386 20 5 EEBDMO CN(C)c1cc(NC(=O)CCOc2ccccc2[N+](=O)[O-])cc[nH+]1 ZINC000267377554 256053616 /nfs/dbraw/zinc/05/36/16/256053616.db2.gz YTWYWXNQNLTFMV-UHFFFAOYSA-N 1 1 330.344 2.463 20 5 EEBDMO C[C@@H](c1cccnc1)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000270683123 256160452 /nfs/dbraw/zinc/16/04/52/256160452.db2.gz VNSYDKPSLBVLSY-BBRMVZONSA-N 1 1 331.372 2.423 20 5 EEBDMO CC[N@@H+](CCCO)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000270686140 256160730 /nfs/dbraw/zinc/16/07/30/256160730.db2.gz ATALALDIJWXUKE-JTQLQIEISA-N 1 1 329.784 2.280 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000271283044 256228994 /nfs/dbraw/zinc/22/89/94/256228994.db2.gz CJRYJVXVRWEZBF-CABZTGNLSA-N 1 1 349.416 2.012 20 5 EEBDMO COCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000271349432 256235905 /nfs/dbraw/zinc/23/59/05/256235905.db2.gz SNRKBGKAZPCFJJ-NSHDSACASA-N 1 1 331.319 2.329 20 5 EEBDMO CCOC(=O)c1ccnc(N[C@H](C)C2=CC[N@@H+](C)CC2)c1[N+](=O)[O-] ZINC000272960035 256252457 /nfs/dbraw/zinc/25/24/57/256252457.db2.gz NLFQZJLXISSCCV-LLVKDONJSA-N 1 1 334.376 2.229 20 5 EEBDMO CC1(C)C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@]2(CCOC2)O1 ZINC000328588712 258045419 /nfs/dbraw/zinc/04/54/19/258045419.db2.gz NADVWZASAPKQDH-KRWDZBQOSA-N 1 1 336.388 2.244 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000111352740 142358155 /nfs/dbraw/zinc/35/81/55/142358155.db2.gz CGGOMDRAPSVDKZ-ZDUSSCGKSA-N 1 1 341.433 2.056 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000054645955 292139765 /nfs/dbraw/zinc/13/97/65/292139765.db2.gz HNANKNLPTNUGRS-HNNXBMFYSA-N 1 1 346.387 2.332 20 5 EEBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CC[N@H+](C2CC2)C1 ZINC000354176365 153155311 /nfs/dbraw/zinc/15/53/11/153155311.db2.gz KBJJMYMUTIMGAW-RYUDHWBXSA-N 1 1 335.429 2.428 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOC[C@@H]1C1CC1 ZINC000090009706 159190732 /nfs/dbraw/zinc/19/07/32/159190732.db2.gz YXIJOKXQNRDVKK-MRXNPFEDSA-N 1 1 333.388 2.343 20 5 EEBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000106785235 159321439 /nfs/dbraw/zinc/32/14/39/159321439.db2.gz IVRLTZDMKHMEPP-AWEZNQCLSA-N 1 1 347.415 2.497 20 5 EEBDMO CN(C)c1noc([C@@H]2CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC000194932994 160202550 /nfs/dbraw/zinc/20/25/50/160202550.db2.gz BODHIMPVAWXLPD-CYBMUJFWSA-N 1 1 331.376 2.423 20 5 EEBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@@]3(CCOC3)C2)c([N+](=O)[O-])c1 ZINC000246842677 160297611 /nfs/dbraw/zinc/29/76/11/160297611.db2.gz FBRCSYGHYCZDRG-SJKOYZFVSA-N 1 1 349.387 2.043 20 5 EEBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@@]3(CCOC3)C2)c([N+](=O)[O-])c1 ZINC000246842677 160297614 /nfs/dbraw/zinc/29/76/14/160297614.db2.gz FBRCSYGHYCZDRG-SJKOYZFVSA-N 1 1 349.387 2.043 20 5 EEBDMO Cc1[nH+]ccn1CCCn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000339180184 160834299 /nfs/dbraw/zinc/83/42/99/160834299.db2.gz 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ZINC000280551544 269372095 /nfs/dbraw/zinc/37/20/95/269372095.db2.gz QMTFTRNJGQLNDG-CYBMUJFWSA-N 1 1 338.404 2.465 20 5 EEBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000283666569 269551940 /nfs/dbraw/zinc/55/19/40/269551940.db2.gz FFVCZFYUAFFQOG-LLVKDONJSA-N 1 1 338.383 2.263 20 5 EEBDMO CN(CC[N@@H+](C)C1CC1)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000274604748 274210300 /nfs/dbraw/zinc/21/03/00/274210300.db2.gz UYEQGYKWMAINSY-UHFFFAOYSA-N 1 1 325.796 2.343 20 5 EEBDMO CC(=O)c1ccc(N2CC[N@@H+](CC(C)(C)O)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000275849236 274269327 /nfs/dbraw/zinc/26/93/27/274269327.db2.gz RHIADAUCHMXFRK-LBPRGKRZSA-N 1 1 335.404 2.079 20 5 EEBDMO CC(=O)c1ccc(N2CC[N@H+](CC(C)(C)O)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000275849236 274269330 /nfs/dbraw/zinc/26/93/30/274269330.db2.gz RHIADAUCHMXFRK-LBPRGKRZSA-N 1 1 335.404 2.079 20 5 EEBDMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1ccc([N+](=O)[O-])c2ncccc12 ZINC000419002697 274364309 /nfs/dbraw/zinc/36/43/09/274364309.db2.gz PWLLGJNQRNEWDB-CHWSQXEVSA-N 1 1 330.388 2.034 20 5 EEBDMO O=C([C@H]1CCCc2[nH+]ccn21)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000359630706 275008507 /nfs/dbraw/zinc/00/85/07/275008507.db2.gz GAFSZBZWJAVMSU-CQSZACIVSA-N 1 1 342.355 2.090 20 5 EEBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])C2 ZINC000289447583 275116512 /nfs/dbraw/zinc/11/65/12/275116512.db2.gz FHXKSJZXNFIQGT-ZDUSSCGKSA-N 1 1 328.372 2.321 20 5 EEBDMO COCCOCC[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000290255791 275192730 /nfs/dbraw/zinc/19/27/30/275192730.db2.gz WCSXUIIQPRSRTM-UHFFFAOYSA-N 1 1 348.403 2.090 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1C[C@H](C2CC2)[C@H]1C1CC1 ZINC000453047013 280375976 /nfs/dbraw/zinc/37/59/76/280375976.db2.gz YXKCIWDRQHJJDH-IIDMSEBBSA-N 1 1 332.400 2.455 20 5 EEBDMO C[C@@]1(C(N)=O)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000294133171 293377921 /nfs/dbraw/zinc/37/79/21/293377921.db2.gz NVYAUKDEBOCYIH-CYBMUJFWSA-N 1 1 331.294 2.311 20 5 EEBDMO 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ZINC000420940749 314003759 /nfs/dbraw/zinc/00/37/59/314003759.db2.gz NDXVLFQCSWGJIF-JSGCOSHPSA-N 1 1 335.404 2.182 20 5 EEBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000421703685 314144528 /nfs/dbraw/zinc/14/45/28/314144528.db2.gz MTKZJEZXJDWJTJ-OAHLLOKOSA-N 1 1 346.431 2.361 20 5 EEBDMO CO[C@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)[C@@H](C)C1 ZINC000441376043 315183929 /nfs/dbraw/zinc/18/39/29/315183929.db2.gz IZOMSUHBDFYLPG-JSGCOSHPSA-N 1 1 349.387 2.392 20 5 EEBDMO COC(=O)[C@H](C)C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1 ZINC000444615726 315311542 /nfs/dbraw/zinc/31/15/42/315311542.db2.gz AWQVRUGUVWVEFN-SNVBAGLBSA-N 1 1 332.360 2.245 20 5 EEBDMO COC(=O)[C@H](C)C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1 ZINC000444615726 315311545 /nfs/dbraw/zinc/31/15/45/315311545.db2.gz AWQVRUGUVWVEFN-SNVBAGLBSA-N 1 1 332.360 2.245 20 5 EEBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@H]1CCCC[C@H]1[NH+]1CCOCC1 ZINC000516806195 316595751 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ZINC000600715588 468631150 /nfs/dbraw/zinc/63/11/50/468631150.db2.gz SVUSEQVWZXFNDU-MRXNPFEDSA-N 1 1 334.420 2.162 20 5 EEBDMO COc1ccc(CC(=O)N2CCC[C@@]3(CC[N@@H+](C)C3)C2)cc1[N+](=O)[O-] ZINC000597714165 468649036 /nfs/dbraw/zinc/64/90/36/468649036.db2.gz GWEFSZMQNQNVKI-SFHVURJKSA-N 1 1 347.415 2.090 20 5 EEBDMO C[C@@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C[C@H](C)S1(=O)=O ZINC000601167065 468767799 /nfs/dbraw/zinc/76/77/99/468767799.db2.gz YZMWEWHXANTEBJ-PHIMTYICSA-N 1 1 335.385 2.155 20 5 EEBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000598218529 468795791 /nfs/dbraw/zinc/79/57/91/468795791.db2.gz HIPUGQSXUIZYMD-AWEZNQCLSA-N 1 1 349.435 2.013 20 5 EEBDMO CCC[N@H+]1CC[C@H](NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000595354966 468823562 /nfs/dbraw/zinc/82/35/62/468823562.db2.gz PWJQNBWSCNUERQ-JTQLQIEISA-N 1 1 347.824 2.011 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC([C@H](C)CO)CC1 ZINC000593084455 468864378 /nfs/dbraw/zinc/86/43/78/468864378.db2.gz PKLIZWPTGALQPX-CHWSQXEVSA-N 1 1 335.404 2.262 20 5 EEBDMO C[C@@H](CO)C1CC[NH+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000593084904 468864410 /nfs/dbraw/zinc/86/44/10/468864410.db2.gz RTEZLHUKDTVHKC-QWHCGFSZSA-N 1 1 335.404 2.262 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](N2CCOCC2)CC1 ZINC000595472320 468866656 /nfs/dbraw/zinc/86/66/56/468866656.db2.gz KXCLCJPMMIGCID-INIZCTEOSA-N 1 1 349.431 2.290 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](N2CCOCC2)CC1 ZINC000595472320 468866660 /nfs/dbraw/zinc/86/66/60/468866660.db2.gz KXCLCJPMMIGCID-INIZCTEOSA-N 1 1 349.431 2.290 20 5 EEBDMO COc1ccc(CC(=O)N2CC[NH2+]Cc3ccccc32)cc1[N+](=O)[O-] ZINC000572028410 468875230 /nfs/dbraw/zinc/87/52/30/468875230.db2.gz PZJRRDBMFPJCKY-UHFFFAOYSA-N 1 1 341.367 2.282 20 5 EEBDMO Cc1noc(C[NH+]2CCC(CO)(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000595502498 468879964 /nfs/dbraw/zinc/87/99/64/468879964.db2.gz MLPRBQQSCNIURW-UHFFFAOYSA-N 1 1 331.372 2.417 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000595522029 468887880 /nfs/dbraw/zinc/88/78/80/468887880.db2.gz IBWASSOJFLGSNE-CQSZACIVSA-N 1 1 334.420 2.309 20 5 EEBDMO CC[N@H+]1CCCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](C)C1 ZINC000595535051 468891077 /nfs/dbraw/zinc/89/10/77/468891077.db2.gz LPDADQHUUTZKFE-ZDUSSCGKSA-N 1 1 335.404 2.377 20 5 EEBDMO O=C(COc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598561298 468913799 /nfs/dbraw/zinc/91/37/99/468913799.db2.gz PMFCMQUUSXNIJL-OAHLLOKOSA-N 1 1 347.415 2.212 20 5 EEBDMO C[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1CO ZINC000598646286 468943946 /nfs/dbraw/zinc/94/39/46/468943946.db2.gz RAJVLRJDZNDAEA-AAEUAGOBSA-N 1 1 332.360 2.095 20 5 EEBDMO C[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1CO ZINC000598646286 468943950 /nfs/dbraw/zinc/94/39/50/468943950.db2.gz RAJVLRJDZNDAEA-AAEUAGOBSA-N 1 1 332.360 2.095 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])C1 ZINC000595705704 468963673 /nfs/dbraw/zinc/96/36/73/468963673.db2.gz YACDQPGDMDXRKV-ZDUSSCGKSA-N 1 1 349.435 2.179 20 5 EEBDMO O=[N+]([O-])c1ccc(CN2CCC[N@@H+](C[C@H]3CCCO3)CC2)c(F)c1 ZINC000610476232 468978934 /nfs/dbraw/zinc/97/89/34/468978934.db2.gz JVQKANCYSYMWQP-MRXNPFEDSA-N 1 1 337.395 2.421 20 5 EEBDMO Cc1noc(C[N@@H+]2CC[C@H](c3ccccc3)[C@H](CO)C2)c1[N+](=O)[O-] ZINC000595748913 468986830 /nfs/dbraw/zinc/98/68/30/468986830.db2.gz ZULANRZZOKZKQB-LSDHHAIUSA-N 1 1 331.372 2.489 20 5 EEBDMO Cc1noc(C[N@H+]2CC[C@H](c3ccccc3)[C@H](CO)C2)c1[N+](=O)[O-] ZINC000595748913 468986838 /nfs/dbraw/zinc/98/68/38/468986838.db2.gz ZULANRZZOKZKQB-LSDHHAIUSA-N 1 1 331.372 2.489 20 5 EEBDMO COCCO[C@@H]1C[C@@H](CO)C[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000562588006 468998172 /nfs/dbraw/zinc/99/81/72/468998172.db2.gz AOIYQDGSKHUKST-RRFJBIMHSA-N 1 1 338.404 2.002 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000602777474 469067034 /nfs/dbraw/zinc/06/70/34/469067034.db2.gz GIHBKRCALRQXGA-NSHDSACASA-N 1 1 336.314 2.143 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000602777474 469067042 /nfs/dbraw/zinc/06/70/42/469067042.db2.gz GIHBKRCALRQXGA-NSHDSACASA-N 1 1 336.314 2.143 20 5 EEBDMO CCO[C@@H]1C[C@@](CO)([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C1(C)C ZINC000614926370 469096108 /nfs/dbraw/zinc/09/61/08/469096108.db2.gz UEUSFGOKKZGUSE-PBHICJAKSA-N 1 1 349.387 2.392 20 5 EEBDMO O=[N+]([O-])c1cccc(Br)c1NCCC[NH+]1CCOCC1 ZINC000596051071 469128890 /nfs/dbraw/zinc/12/88/90/469128890.db2.gz KXESVYSGWOFFBM-UHFFFAOYSA-N 1 1 344.209 2.492 20 5 EEBDMO NC(=O)c1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000596055316 469130180 /nfs/dbraw/zinc/13/01/80/469130180.db2.gz WDNMCSFZUCXJET-HNNXBMFYSA-N 1 1 340.383 2.380 20 5 EEBDMO Nc1ccc(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)nc1[N+](=O)[O-] ZINC000596100927 469155001 /nfs/dbraw/zinc/15/50/01/469155001.db2.gz DPEAGYBMYIPSDK-LBPRGKRZSA-N 1 1 347.444 2.958 20 5 EEBDMO CC[N@@H+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000611088241 469158205 /nfs/dbraw/zinc/15/82/05/469158205.db2.gz KZONQPSZFIXSMB-GFCCVEGCSA-N 1 1 332.404 2.335 20 5 EEBDMO CC[N@H+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000611088241 469158211 /nfs/dbraw/zinc/15/82/11/469158211.db2.gz KZONQPSZFIXSMB-GFCCVEGCSA-N 1 1 332.404 2.335 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@H+](CC[C@@H]2CCS(=O)(=O)C2)C2CC2)cc1 ZINC000611211207 469194299 /nfs/dbraw/zinc/19/42/99/469194299.db2.gz CHQAQFLMICUOBJ-CQSZACIVSA-N 1 1 338.429 2.384 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC[C@@H]2CCS(=O)(=O)C2)C2CC2)cc1 ZINC000611211207 469194303 /nfs/dbraw/zinc/19/43/03/469194303.db2.gz CHQAQFLMICUOBJ-CQSZACIVSA-N 1 1 338.429 2.384 20 5 EEBDMO O=[N+]([O-])c1cccc2c1ccnc2N1CCC[C@@H]([NH+]2CCOCC2)C1 ZINC000596248379 469220866 /nfs/dbraw/zinc/22/08/66/469220866.db2.gz WOIKSKFXQHMUCD-CQSZACIVSA-N 1 1 342.399 2.444 20 5 EEBDMO CCC(O)(CC)C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000599672980 469333481 /nfs/dbraw/zinc/33/34/81/469333481.db2.gz HTQUNUKDIMIZHQ-UHFFFAOYSA-N 1 1 339.392 2.025 20 5 EEBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](C[C@H]4CCOC4)CC3)nc2c1 ZINC000614185468 469873794 /nfs/dbraw/zinc/87/37/94/469873794.db2.gz SNEVKDOLTORFQU-CYBMUJFWSA-N 1 1 345.403 2.020 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1Cc1ccccc1 ZINC000159708240 534320875 /nfs/dbraw/zinc/32/08/75/534320875.db2.gz HZJFBXFIPAKWOB-INIZCTEOSA-N 1 1 327.384 2.464 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000132118574 534321020 /nfs/dbraw/zinc/32/10/20/534321020.db2.gz QHWXZMWNCGDWDD-HNNXBMFYSA-N 1 1 345.374 2.460 20 5 EEBDMO CCN1CC[NH+](C[C@@H](C)CNc2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000153601303 529147109 /nfs/dbraw/zinc/14/71/09/529147109.db2.gz LJJVDYGVCPONSR-LBPRGKRZSA-N 1 1 341.843 2.329 20 5 EEBDMO CC[N@@H+](C[C@H]1CCOC1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738080566 576430152 /nfs/dbraw/zinc/43/01/52/576430152.db2.gz GWDRMPUNVZMIHS-CYBMUJFWSA-N 1 1 331.376 2.169 20 5 EEBDMO COC(=O)C[C@@]1([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCOC1 ZINC000767033110 577529376 /nfs/dbraw/zinc/52/93/76/577529376.db2.gz SPUYZUVHVPJJSF-AWEZNQCLSA-N 1 1 328.752 2.060 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)OCCC[NH+]1CCOCC1 ZINC000769886093 577586333 /nfs/dbraw/zinc/58/63/33/577586333.db2.gz DGWIWIPWDIWXDR-UHFFFAOYSA-N 1 1 336.388 2.399 20 5 EEBDMO Cc1cc(N2CC[NH+](CCCCO)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000750178817 577988468 /nfs/dbraw/zinc/98/84/68/577988468.db2.gz KDLDKOZBVACQQW-UHFFFAOYSA-N 1 1 327.812 2.451 20 5 EEBDMO CN(C[C@H]1CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC000741243261 578115265 /nfs/dbraw/zinc/11/52/65/578115265.db2.gz ULJCGNQTWRAOEC-ZDUSSCGKSA-N 1 1 346.431 2.265 20 5 EEBDMO Cn1c2ccccc2c(NC[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1=O ZINC000891781968 676829228 /nfs/dbraw/zinc/82/92/28/676829228.db2.gz OBNJNTJDLZMEAY-GFCCVEGCSA-N 1 1 342.399 2.343 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCCN1c1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000894464193 682908079 /nfs/dbraw/zinc/90/80/79/682908079.db2.gz IIPQLKFVIREDKF-ZDUSSCGKSA-N 1 1 344.415 2.367 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[C@H]([C@@H]2CCC[N@@H+](CC[N+](=O)[O-])C2)C1 ZINC000930655127 684328157 /nfs/dbraw/zinc/32/81/57/684328157.db2.gz NTBUSZVTTKFNHT-KGLIPLIRSA-N 1 1 327.425 2.232 20 5 EEBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC000864942131 1198010467 /nfs/dbraw/zinc/01/04/67/1198010467.db2.gz YNWCLDQQASPJKY-LLVKDONJSA-N 1 1 334.351 2.234 20 5 EEBDMO CNC(=O)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2C(F)F)CC1 ZINC000865438516 1198217043 /nfs/dbraw/zinc/21/70/43/1198217043.db2.gz ZMTMIOICAANTFE-UHFFFAOYSA-N 1 1 342.346 2.155 20 5 EEBDMO CCOC(=O)Cc1ccc(N2CC[C@H](C[N@@H+](C)CC)C2)c([N+](=O)[O-])c1 ZINC000825791109 1199246414 /nfs/dbraw/zinc/24/64/14/1199246414.db2.gz YCJGVSAVMCYNGC-OAHLLOKOSA-N 1 1 349.431 2.478 20 5 EEBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000825909827 1199774141 /nfs/dbraw/zinc/77/41/41/1199774141.db2.gz JUSPVKQMEGWGRT-GOEBONIOSA-N 1 1 335.404 2.009 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878335549 1200405382 /nfs/dbraw/zinc/40/53/82/1200405382.db2.gz OKEZPDBTSRENJS-VXGBXAGGSA-N 1 1 331.376 2.169 20 5 EEBDMO C[C@H]1C[C@@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CO1 ZINC000813174440 1201142077 /nfs/dbraw/zinc/14/20/77/1201142077.db2.gz SSSQAYGNUSBHON-BJJXKVORSA-N 1 1 334.372 2.137 20 5 EEBDMO C[C@H]1C[C@@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CO1 ZINC000813174440 1201142082 /nfs/dbraw/zinc/14/20/82/1201142082.db2.gz SSSQAYGNUSBHON-BJJXKVORSA-N 1 1 334.372 2.137 20 5 EEBDMO CN(C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1)C1Cc2ccccc2C1 ZINC000867942735 1201711141 /nfs/dbraw/zinc/71/11/41/1201711141.db2.gz VPQNIKZJKNCDEH-LJQANCHMSA-N 1 1 339.395 2.395 20 5 EEBDMO COCC[N@@H+]1[C@H](C)CN(CCOc2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000130236619 1201952849 /nfs/dbraw/zinc/95/28/49/1201952849.db2.gz XIZYFWJIJWVLDQ-GASCZTMLSA-N 1 1 337.420 2.015 20 5 EEBDMO COCCN1[C@H](C)C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000130236619 1201952850 /nfs/dbraw/zinc/95/28/50/1201952850.db2.gz XIZYFWJIJWVLDQ-GASCZTMLSA-N 1 1 337.420 2.015 20 5 EEBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCS[C@H]3COCC[C@@H]32)c1 ZINC000131147410 1202024779 /nfs/dbraw/zinc/02/47/79/1202024779.db2.gz IPTYOFBNEOEKBW-GJZGRUSLSA-N 1 1 334.401 2.108 20 5 EEBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCS[C@H]3COCC[C@@H]32)c1 ZINC000131147410 1202024783 /nfs/dbraw/zinc/02/47/83/1202024783.db2.gz IPTYOFBNEOEKBW-GJZGRUSLSA-N 1 1 334.401 2.108 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2 ZINC000931724491 1207449427 /nfs/dbraw/zinc/44/94/27/1207449427.db2.gz BPPYCZOYXQIDDN-XPKDYRNWSA-N 1 1 332.404 2.090 20 5 EEBDMO Cc1cc(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c(N)c([N+](=O)[O-])c1 ZINC000245908318 1211997621 /nfs/dbraw/zinc/99/76/21/1211997621.db2.gz NQRUGDVJMUWEGQ-YPMHNXCESA-N 1 1 334.420 2.336 20 5 EEBDMO Cn1ccnc1[C@@H](O)C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000089926052 1212089490 /nfs/dbraw/zinc/08/94/90/1212089490.db2.gz WMNZZZRDDRITNX-INIZCTEOSA-N 1 1 348.378 2.413 20 5 EEBDMO CC(C)([NH2+]CC(=O)NCc1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000795216978 1212115642 /nfs/dbraw/zinc/11/56/42/1212115642.db2.gz ACJPZLFGLMQZOF-UHFFFAOYSA-N 1 1 328.372 2.131 20 5 EEBDMO O=[N+]([O-])c1cnn(CN2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1 ZINC000795718654 1215014699 /nfs/dbraw/zinc/01/46/99/1215014699.db2.gz MFNVOJXDZZNUGA-SFHVURJKSA-N 1 1 341.415 2.347 20 5 EEBDMO C[N@@H+](CCCNC(=O)C(F)(F)F)CCc1ccccc1[N+](=O)[O-] ZINC000796111821 1215306309 /nfs/dbraw/zinc/30/63/09/1215306309.db2.gz GNJSTWOURQSKBH-UHFFFAOYSA-N 1 1 333.310 2.138 20 5 EEBDMO COc1cn(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000902269787 1237318337 /nfs/dbraw/zinc/31/83/37/1237318337.db2.gz MPAHQYVODXZFRT-UHFFFAOYSA-N 1 1 331.372 2.206 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N[C@H]1C[C@@H](Nc2cccc(F)c2[N+](=O)[O-])C1 ZINC001097203815 1243819022 /nfs/dbraw/zinc/81/90/22/1243819022.db2.gz YHOMQJOBALVEBC-TXEJJXNPSA-N 1 1 338.383 2.135 20 5 EEBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000827462668 1248127340 /nfs/dbraw/zinc/12/73/40/1248127340.db2.gz LSVJQAQUMPAETF-WMLDXEAASA-N 1 1 349.431 2.112 20 5 EEBDMO O=[N+]([O-])c1cccc2c1ccnc2NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000827497066 1248229516 /nfs/dbraw/zinc/22/95/16/1248229516.db2.gz SFQGZKNTNHVBBA-CHWSQXEVSA-N 1 1 328.372 2.418 20 5 EEBDMO Cc1cc(C(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c(N)c([N+](=O)[O-])c1 ZINC000104148276 1284917260 /nfs/dbraw/zinc/91/72/60/1284917260.db2.gz NQRUGDVJMUWEGQ-WCQYABFASA-N 1 1 334.420 2.336 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C)CCN1Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1 ZINC000853498717 1292401945 /nfs/dbraw/zinc/40/19/45/1292401945.db2.gz QEXHVWBWQMRLIH-OAHLLOKOSA-N 1 1 344.419 2.083 20 5 EEBDMO COC(=O)c1cccc(CO[C@@H]2CCc3[nH+]ccn3C2)c1[N+](=O)[O-] ZINC001223662125 1300216150 /nfs/dbraw/zinc/21/61/50/1300216150.db2.gz BCNJKDLUZUKCTH-GFCCVEGCSA-N 1 1 331.328 2.110 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1C[C@H](C)Oc1ccc(C(=[NH2+])NO)c(F)c1 ZINC001229082496 1302601336 /nfs/dbraw/zinc/60/13/36/1302601336.db2.gz FTEYUSHPAXASGR-QMMMGPOBSA-N 1 1 337.311 2.010 20 5 EEBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3ccc(/C=C/[N+](=O)[O-])cc3)C[C@H]1[N@H+]2C ZINC001229113814 1302624138 /nfs/dbraw/zinc/62/41/38/1302624138.db2.gz FMJUNRQZMZVJFG-VKNWSKTCSA-N 1 1 346.383 2.480 20 5 EEBDMO C[N@H+]1CC[C@@H](Oc2cc(I)ccc2[N+](=O)[O-])C1 ZINC001229150724 1302643397 /nfs/dbraw/zinc/64/33/97/1302643397.db2.gz AHONYOVWXDOVNM-SECBINFHSA-N 1 1 348.140 2.282 20 5 EEBDMO CN1CCO[C@H](COc2ccc3c(c2)oc(=O)c2cc(O)ccc32)C1 ZINC001229797518 1302949024 /nfs/dbraw/zinc/94/90/24/1302949024.db2.gz DQESHIPZMUUPNI-AWEZNQCLSA-N 1 1 341.363 2.361 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCC1(Nc2nc(C)ccc2[N+](=O)[O-])CCC1 ZINC001111828137 1303957304 /nfs/dbraw/zinc/95/73/04/1303957304.db2.gz SAWGYKDRENZKTB-UHFFFAOYSA-N 1 1 349.435 2.091 20 5 EEBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2C[C@H](O)C[C@@H]2c2ccccc2)c1 ZINC000839635740 1315223752 /nfs/dbraw/zinc/22/37/52/1315223752.db2.gz JSPQXIOIKUHHMX-KZNAEPCWSA-N 1 1 328.368 2.436 20 5 EEBDMO Cc1nc(N2CC[N@@H+]3CCc4ccccc4[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001155103675 1317458704 /nfs/dbraw/zinc/45/87/04/1317458704.db2.gz SHDNBPMVYOMYOB-INIZCTEOSA-N 1 1 325.372 2.113 20 5 EEBDMO Cc1nc(N2CC[N@H+]3CCc4ccccc4[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001155103675 1317458709 /nfs/dbraw/zinc/45/87/09/1317458709.db2.gz SHDNBPMVYOMYOB-INIZCTEOSA-N 1 1 325.372 2.113 20 5 EEBDMO COc1ccc(NC(=O)N2CCC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC001254465882 1318081334 /nfs/dbraw/zinc/08/13/34/1318081334.db2.gz ITEWBQOOCXTFLC-ZDUSSCGKSA-N 1 1 334.376 2.305 20 5 EEBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CC([C@@H](N)C(=O)OC(C)(C)C)C1 ZINC001254550370 1318118855 /nfs/dbraw/zinc/11/88/55/1318118855.db2.gz ILMUJHFOBIZGIY-MLGOLLRUSA-N 1 1 349.431 2.127 20 5 EEBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])N1CC([C@@H]([NH3+])C(=O)OC(C)(C)C)C1 ZINC001254550370 1318118859 /nfs/dbraw/zinc/11/88/59/1318118859.db2.gz ILMUJHFOBIZGIY-MLGOLLRUSA-N 1 1 349.431 2.127 20 5 EEBDMO Cc1ccnc(O[C@H]2CC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254612154 1318145978 /nfs/dbraw/zinc/14/59/78/1318145978.db2.gz VKNKWIHBVJKAJB-SJORKVTESA-N 1 1 340.383 2.314 20 5 EEBDMO COc1cnc(-n2ccc(C[NH2+]Cc3ccccc3)n2)c([N+](=O)[O-])c1 ZINC001157609440 1318745477 /nfs/dbraw/zinc/74/54/77/1318745477.db2.gz MNJWNUFGZPHVAP-UHFFFAOYSA-N 1 1 339.355 2.474 20 5 EEBDMO Cc1cc(N2CC[N@H+]3CC[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001158430303 1319234471 /nfs/dbraw/zinc/23/44/71/1319234471.db2.gz CWMPZAYHXINKFA-OAHLLOKOSA-N 1 1 325.372 2.255 20 5 EEBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2ncc([N+](=O)[O-])cc2C)CC1 ZINC001165108079 1321456588 /nfs/dbraw/zinc/45/65/88/1321456588.db2.gz KTPNELPIGOBDEP-OAHLLOKOSA-N 1 1 334.420 2.378 20 5 EEBDMO CCOC(=O)c1cc([N+](=O)[O-])cnc1N1CC[N@@H+](C(C)C)[C@H](C)C1 ZINC001165199614 1321470020 /nfs/dbraw/zinc/47/00/20/1321470020.db2.gz DWDOFSHOLWNZSQ-GFCCVEGCSA-N 1 1 336.392 2.085 20 5 EEBDMO COc1cc(C[NH2+][C@H](CO)CC(F)(F)F)c([N+](=O)[O-])cc1OC ZINC001262107349 1322235933 /nfs/dbraw/zinc/23/59/33/1322235933.db2.gz KIAYASDEMSZMJX-VIFPVBQESA-N 1 1 338.282 2.015 20 5 EEBDMO COC(=O)[C@@H]1CCC[C@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC001321102941 1333019720 /nfs/dbraw/zinc/01/97/20/1333019720.db2.gz BTHBGVGACUBZBG-CHWSQXEVSA-N 1 1 346.343 2.076 20 5 EEBDMO Cc1nn(CCc2nc([C@@H]([NH3+])c3ccccc3)no2)c(C)c1[N+](=O)[O-] ZINC001329412643 1334644591 /nfs/dbraw/zinc/64/45/91/1334644591.db2.gz XBOIQKMKFZUJGZ-AWEZNQCLSA-N 1 1 342.359 2.082 20 5 EEBDMO C[N@H+]1CCCC[C@H](CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001333781661 1336131788 /nfs/dbraw/zinc/13/17/88/1336131788.db2.gz JEVGIWSGJQFOAM-CQSZACIVSA-N 1 1 346.431 2.394 20 5 EEBDMO C[C@H]1CN(Cc2cc([N+](=O)[O-])ccc2Br)CC[N@H+]1C ZINC001333874117 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/nfs/dbraw/zinc/63/56/75/1350635675.db2.gz CRWHPHSVNFJTOG-NSHDSACASA-N 1 1 331.380 2.060 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)Nc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-] ZINC001604182003 1350886060 /nfs/dbraw/zinc/88/60/60/1350886060.db2.gz VXZLBJZTDNWTTE-NSHDSACASA-N 1 1 333.396 2.307 20 5 EEBDMO CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1N)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286170119 1367316036 /nfs/dbraw/zinc/31/60/36/1367316036.db2.gz KBWMLZSKLKJYNN-FOSCPWQOSA-N 1 1 336.367 2.013 20 5 EEBDMO CO[C@]1(C)CCC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1 ZINC000853511458 1369343302 /nfs/dbraw/zinc/34/33/02/1369343302.db2.gz POWFKZJKNRZDFN-MRXNPFEDSA-N 1 1 331.376 2.312 20 5 EEBDMO CO[C@]1(C)CCC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1 ZINC000853511458 1369343305 /nfs/dbraw/zinc/34/33/05/1369343305.db2.gz POWFKZJKNRZDFN-MRXNPFEDSA-N 1 1 331.376 2.312 20 5 EEBDMO COC1CC(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000860779997 1369478216 /nfs/dbraw/zinc/47/82/16/1369478216.db2.gz CUJZXBPVEQZPDT-SIWZUTFBSA-N 1 1 334.372 2.137 20 5 EEBDMO COC1CC(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000860779997 1369478219 /nfs/dbraw/zinc/47/82/19/1369478219.db2.gz CUJZXBPVEQZPDT-SIWZUTFBSA-N 1 1 334.372 2.137 20 5 EEBDMO CC[C@H]1C[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CCCO1 ZINC000799164805 1371634160 /nfs/dbraw/zinc/63/41/60/1371634160.db2.gz UXRNBCTZZCABAX-AWEZNQCLSA-N 1 1 348.403 2.295 20 5 EEBDMO CC[C@H]1C[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CCCO1 ZINC000799164805 1371634163 /nfs/dbraw/zinc/63/41/63/1371634163.db2.gz UXRNBCTZZCABAX-AWEZNQCLSA-N 1 1 348.403 2.295 20 5 EEBDMO C[C@@H]1CN(Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C[C@H](C)[N@@H+]1C ZINC000840090988 1372921832 /nfs/dbraw/zinc/92/18/32/1372921832.db2.gz XFSQPQGAZNAGFM-OKILXGFUSA-N 1 1 329.404 2.440 20 5 EEBDMO Cc1cccc(C(=O)NCC2C[NH+](Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC001031554684 769582491 /nfs/dbraw/zinc/58/24/91/769582491.db2.gz GFHPROBMQUYLEQ-UHFFFAOYSA-N 1 1 340.383 2.160 20 5 EEBDMO 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ZINC000817131603 784527513 /nfs/dbraw/zinc/52/75/13/784527513.db2.gz GLGXYYDVHXRAJY-CQSZACIVSA-N 1 1 332.404 2.017 20 5 EEBDMO CCc1ccccc1C[NH2+]CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000997771383 791040495 /nfs/dbraw/zinc/04/04/95/791040495.db2.gz GZDWVZQHWJOYSY-QZTJIDSGSA-N 1 1 345.443 2.242 20 5 EEBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)[N@H+]1CCCC[C@@H]1C ZINC000801816400 785719896 /nfs/dbraw/zinc/71/98/96/785719896.db2.gz DMEYLDYJDKHSNN-QWRGUYRKSA-N 1 1 338.383 2.309 20 5 EEBDMO Cc1cc(NC/C=C/CNC(=O)C[N@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC001107232830 786546891 /nfs/dbraw/zinc/54/68/91/786546891.db2.gz JCLJHKAUAIZXLV-AATRIKPKSA-N 1 1 334.420 2.328 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NC/C=C\CNc1nc(C)ccc1[N+](=O)[O-] ZINC001107277242 786691788 /nfs/dbraw/zinc/69/17/88/786691788.db2.gz YZSYEFZDLKSTTN-WAYWQWQTSA-N 1 1 349.435 2.114 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)cc1[N+](=O)[O-] ZINC000843849726 788688666 /nfs/dbraw/zinc/68/86/66/788688666.db2.gz 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ZINC000282898843 464992843 /nfs/dbraw/zinc/99/28/43/464992843.db2.gz TYZBTBDMCQMBFS-OLZOCXBDSA-N 1 1 333.388 2.302 20 5 EEBDMO COc1ccc(CNC(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000298912381 465540118 /nfs/dbraw/zinc/54/01/18/465540118.db2.gz DSQMMNSQQJRKEB-UONOGXRCSA-N 1 1 348.403 2.029 20 5 EEBDMO CCN1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ncc[nH]1 ZINC000348366820 465568904 /nfs/dbraw/zinc/56/89/04/465568904.db2.gz IYVYFCHDGNTBHI-INIZCTEOSA-N 1 1 329.404 2.239 20 5 EEBDMO CCc1[nH]nc(C(=O)N(C)CC[NH+](C(C)C)C(C)C)c1[N+](=O)[O-] ZINC000357059005 465734247 /nfs/dbraw/zinc/73/42/47/465734247.db2.gz MRRSDPRBSGKOMT-UHFFFAOYSA-N 1 1 325.413 2.071 20 5 EEBDMO C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000340119076 465782508 /nfs/dbraw/zinc/78/25/08/465782508.db2.gz GNKGQIGQWONXBO-SECBINFHSA-N 1 1 331.294 2.390 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000340119076 465782513 /nfs/dbraw/zinc/78/25/13/465782513.db2.gz GNKGQIGQWONXBO-SECBINFHSA-N 1 1 331.294 2.390 20 5 EEBDMO COc1c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)cccc1[N+](=O)[O-] ZINC000357141647 465807517 /nfs/dbraw/zinc/80/75/17/465807517.db2.gz IGIOMFUJJGWUIM-ZDUSSCGKSA-N 1 1 333.388 2.350 20 5 EEBDMO CNc1c(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000361161282 465808371 /nfs/dbraw/zinc/80/83/71/465808371.db2.gz HYHHQWJJUQQOOU-CYBMUJFWSA-N 1 1 334.420 2.487 20 5 EEBDMO CN1CCN(CCC[N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000349315168 466062487 /nfs/dbraw/zinc/06/24/87/466062487.db2.gz KTADBOZNJZPYAQ-YVMONPNESA-N 1 1 332.448 2.177 20 5 EEBDMO CN1CCN(CCC[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000349315168 466062494 /nfs/dbraw/zinc/06/24/94/466062494.db2.gz KTADBOZNJZPYAQ-YVMONPNESA-N 1 1 332.448 2.177 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000331422188 466077646 /nfs/dbraw/zinc/07/76/46/466077646.db2.gz UNRMNWZYLLCSKS-BJOHPYRUSA-N 1 1 339.342 2.014 20 5 EEBDMO CC(C)[N@@H+](C)CCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000338428351 466119960 /nfs/dbraw/zinc/11/99/60/466119960.db2.gz YOCMMXYZONDTRT-UHFFFAOYSA-N 1 1 334.420 2.265 20 5 EEBDMO C[C@H](O)C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000594064172 468476600 /nfs/dbraw/zinc/47/66/00/468476600.db2.gz LADWYABLFHWUBE-VIFPVBQESA-N 1 1 327.768 2.032 20 5 EEBDMO C[C@H](O)C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000594064172 468476606 /nfs/dbraw/zinc/47/66/06/468476606.db2.gz LADWYABLFHWUBE-VIFPVBQESA-N 1 1 327.768 2.032 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](n2cccn2)C1 ZINC000338725162 466337912 /nfs/dbraw/zinc/33/79/12/466337912.db2.gz RJWZIJLCQRNXQJ-CZUORRHYSA-N 1 1 343.387 2.455 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](n2cccn2)C1 ZINC000338725162 466337918 /nfs/dbraw/zinc/33/79/18/466337918.db2.gz RJWZIJLCQRNXQJ-CZUORRHYSA-N 1 1 343.387 2.455 20 5 EEBDMO CC(C)[C@@H]1CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC[N@H+]1C ZINC000332034082 466355900 /nfs/dbraw/zinc/35/59/00/466355900.db2.gz WOYFHPOWFRDHMU-HNNXBMFYSA-N 1 1 330.388 2.488 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@H](O)C1CC1 ZINC000305748365 466446461 /nfs/dbraw/zinc/44/64/61/466446461.db2.gz QJMXCDICYHNIBE-OTYXRUKQSA-N 1 1 341.795 2.278 20 5 EEBDMO COc1cc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cc([N+](=O)[O-])c1C ZINC000332301798 466499011 /nfs/dbraw/zinc/49/90/11/466499011.db2.gz KTOJTYRZHFAXLJ-UONOGXRCSA-N 1 1 333.388 2.268 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@H]1C ZINC000354354860 466500976 /nfs/dbraw/zinc/50/09/76/466500976.db2.gz RNPGPXVJUJACQE-TZMCWYRMSA-N 1 1 334.420 2.263 20 5 EEBDMO CS(=O)(=O)c1cccc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-] ZINC000322579910 466633364 /nfs/dbraw/zinc/63/33/64/466633364.db2.gz RPPBVTNWXBQQRV-VXGBXAGGSA-N 1 1 339.417 2.037 20 5 EEBDMO Cc1ccccc1C[N@H+]1CCCN(c2ncc([N+](=O)[O-])cn2)CC1 ZINC000363914160 466652143 /nfs/dbraw/zinc/65/21/43/466652143.db2.gz VCYXNFNUXVHPQG-UHFFFAOYSA-N 1 1 327.388 2.406 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH2+][C@@H]3CCO[C@@H]3C3CC3)o2)cc1 ZINC000365199607 466742748 /nfs/dbraw/zinc/74/27/48/466742748.db2.gz GILGNUNINAETOD-UKRRQHHQSA-N 1 1 330.344 2.302 20 5 EEBDMO O=C1CCC[C@@H]1[C@H]1COCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000373690308 466889240 /nfs/dbraw/zinc/88/92/40/466889240.db2.gz SPBZKSXSCBDBCN-IAGOWNOFSA-N 1 1 348.399 2.434 20 5 EEBDMO O=C1CCC[C@@H]1[C@H]1COCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000373690308 466889243 /nfs/dbraw/zinc/88/92/43/466889243.db2.gz SPBZKSXSCBDBCN-IAGOWNOFSA-N 1 1 348.399 2.434 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@@H]2[C@@H](O)c2ccccc2)n1 ZINC000377954104 467170622 /nfs/dbraw/zinc/17/06/22/467170622.db2.gz NICSZXVPSDCPTL-WBVHZDCISA-N 1 1 330.388 2.379 20 5 EEBDMO C[N@H+]1CCC[C@H](CCNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000413449398 467244977 /nfs/dbraw/zinc/24/49/77/467244977.db2.gz XLCUNUAWCCGYKY-SNVBAGLBSA-N 1 1 347.462 2.204 20 5 EEBDMO C[C@H]1C[C@H]1[N@H+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429018805 467291814 /nfs/dbraw/zinc/29/18/14/467291814.db2.gz IAMCSJWRNGYNKZ-JKIFEVAISA-N 1 1 346.431 2.195 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCO)[C@H]1CCCSC1 ZINC000433209058 467307547 /nfs/dbraw/zinc/30/75/47/467307547.db2.gz PDYFXYHNKGOHHT-AWEZNQCLSA-N 1 1 326.418 2.293 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@H](CCCO)C3)n2)cc1 ZINC000452114762 467328737 /nfs/dbraw/zinc/32/87/37/467328737.db2.gz DYAYNIDKKFKDCC-LBPRGKRZSA-N 1 1 332.360 2.239 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(NC[C@H]3CCCC[N@H+]3C3CC3)n2)cc1 ZINC000433810540 467354984 /nfs/dbraw/zinc/35/49/84/467354984.db2.gz KTZHBTSVDGAHJF-OAHLLOKOSA-N 1 1 343.387 3.074 20 5 EEBDMO Cc1c(NC(=O)CC[NH2+][C@H]2[C@@H](C)NCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000420381203 467386031 /nfs/dbraw/zinc/38/60/31/467386031.db2.gz ZAEHVLAUVVTJBI-XTQGRXLLSA-N 1 1 334.420 2.208 20 5 EEBDMO CNc1c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)cccc1[N+](=O)[O-] ZINC000434418924 467397254 /nfs/dbraw/zinc/39/72/54/467397254.db2.gz GXHYASLXZMDMOV-ZDUSSCGKSA-N 1 1 332.404 2.383 20 5 EEBDMO NC(=O)c1cccc([N+](=O)[O-])c1N1CC[NH+](Cc2ccccc2)CC1 ZINC000420584463 467428729 /nfs/dbraw/zinc/42/87/29/467428729.db2.gz MMOSJXQHAYEDNN-UHFFFAOYSA-N 1 1 340.383 2.016 20 5 EEBDMO Cn1cc(CN2CCC[N@@H+](C)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000435250866 467455102 /nfs/dbraw/zinc/45/51/02/467455102.db2.gz VAZFMBVJVFTOGZ-UHFFFAOYSA-N 1 1 329.404 2.133 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@@H]21 ZINC000453010457 467455790 /nfs/dbraw/zinc/45/57/90/467455790.db2.gz PVSHFGXKINBEED-RNCFNFMXSA-N 1 1 343.305 2.390 20 5 EEBDMO C[N@@H+](CCCCNC(=O)NCCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000454362083 467587960 /nfs/dbraw/zinc/58/79/60/467587960.db2.gz QVINGVIUVYKUTO-UHFFFAOYSA-N 1 1 334.420 2.311 20 5 EEBDMO Cc1cc(OCC(=O)NCCCC[N@H+](C)C2CC2)ccc1[N+](=O)[O-] ZINC000457171029 467770439 /nfs/dbraw/zinc/77/04/39/467770439.db2.gz RHZPEGIXNLVRQX-UHFFFAOYSA-N 1 1 335.404 2.273 20 5 EEBDMO C[C@@H]1C[N@@H+](CCN(C)C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000492960641 467805673 /nfs/dbraw/zinc/80/56/73/467805673.db2.gz WLPPLZKBHKBOAB-VUEDLFODSA-N 1 1 347.415 2.176 20 5 EEBDMO C[C@@H]1C[N@H+](CCN(C)C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000492960641 467805677 /nfs/dbraw/zinc/80/56/77/467805677.db2.gz WLPPLZKBHKBOAB-VUEDLFODSA-N 1 1 347.415 2.176 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](N3CCOCC3)CC2)c(F)c1 ZINC000594616436 468637851 /nfs/dbraw/zinc/63/78/51/468637851.db2.gz BTSZVVOEVPDPSS-HNNXBMFYSA-N 1 1 337.395 2.421 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](N3CCOCC3)CC2)c(F)c1 ZINC000594616436 468637857 /nfs/dbraw/zinc/63/78/57/468637857.db2.gz BTSZVVOEVPDPSS-HNNXBMFYSA-N 1 1 337.395 2.421 20 5 EEBDMO COc1cc(C(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000597921948 468711931 /nfs/dbraw/zinc/71/19/31/468711931.db2.gz IGCUPGMLFLOXLT-JTQLQIEISA-N 1 1 339.367 2.345 20 5 EEBDMO CNC(=O)[C@H](CCSC)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595052246 468749194 /nfs/dbraw/zinc/74/91/94/468749194.db2.gz RXVBBFVFZLLPJF-MFKMUULPSA-N 1 1 341.433 2.122 20 5 EEBDMO C[N@@H+]1CC[C@@]2(C1)CCCN(CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000595505364 468881008 /nfs/dbraw/zinc/88/10/08/468881008.db2.gz SMKZIDHWLAFJDW-GOSISDBHSA-N 1 1 346.431 2.341 20 5 EEBDMO C[N@H+]1CC[C@@]2(C1)CCCN(CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000595505364 468881012 /nfs/dbraw/zinc/88/10/12/468881012.db2.gz SMKZIDHWLAFJDW-GOSISDBHSA-N 1 1 346.431 2.341 20 5 EEBDMO C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1CCO ZINC000595698628 468959315 /nfs/dbraw/zinc/95/93/15/468959315.db2.gz NGVOXNIUTXOCMR-UKRRQHHQSA-N 1 1 335.404 2.406 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]2NC(=O)CC[C@H]2C1 ZINC000595743891 468983403 /nfs/dbraw/zinc/98/34/03/468983403.db2.gz SCOIFVIJFOSYAT-BBRMVZONSA-N 1 1 347.415 2.483 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+](C)CC1=CCCOC1 ZINC000595752983 468990037 /nfs/dbraw/zinc/99/00/37/468990037.db2.gz NUMKGCHUYVIXRL-LBPRGKRZSA-N 1 1 349.387 2.209 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)CC1=CCCOC1 ZINC000595752983 468990045 /nfs/dbraw/zinc/99/00/45/468990045.db2.gz NUMKGCHUYVIXRL-LBPRGKRZSA-N 1 1 349.387 2.209 20 5 EEBDMO C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@H]1C[N@H+](C)CCO1 ZINC000610901132 469108543 /nfs/dbraw/zinc/10/85/43/469108543.db2.gz GIALCVJWTQUUPQ-GXFFZTMASA-N 1 1 349.412 2.258 20 5 EEBDMO C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@H]1C[N@@H+](C)CCO1 ZINC000610901132 469108547 /nfs/dbraw/zinc/10/85/47/469108547.db2.gz GIALCVJWTQUUPQ-GXFFZTMASA-N 1 1 349.412 2.258 20 5 EEBDMO O=C(c1cc(N[C@@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000596087088 469149359 /nfs/dbraw/zinc/14/93/59/469149359.db2.gz DHIRYSCHCZFOFY-CQSZACIVSA-N 1 1 344.415 2.479 20 5 EEBDMO CC[N@@H+](C[C@@H]1CCOC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000611205149 469191630 /nfs/dbraw/zinc/19/16/30/469191630.db2.gz JPINBAUHFJIUMO-XJKSGUPXSA-N 1 1 333.388 2.059 20 5 EEBDMO COc1cc(C[N@@H+](CCO)CC(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000611269397 469214649 /nfs/dbraw/zinc/21/46/49/469214649.db2.gz GUJXNSCKATXFHX-UHFFFAOYSA-N 1 1 326.393 2.452 20 5 EEBDMO C[C@@H]1CN(c2cc[nH]c(=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000596270355 469228698 /nfs/dbraw/zinc/22/86/98/469228698.db2.gz FLURXMLIGGXFIH-CYBMUJFWSA-N 1 1 328.372 2.406 20 5 EEBDMO CCOC(=O)c1ccnc(N[C@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000596336705 469246477 /nfs/dbraw/zinc/24/64/77/469246477.db2.gz RSONGVLDBOZOJG-NSHDSACASA-N 1 1 336.392 2.451 20 5 EEBDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1(C)COC1 ZINC000599571286 469295960 /nfs/dbraw/zinc/29/59/60/469295960.db2.gz BCCOSDNIQNYGDY-UHFFFAOYSA-N 1 1 327.768 2.155 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1(C)COC1 ZINC000599571286 469295964 /nfs/dbraw/zinc/29/59/64/469295964.db2.gz BCCOSDNIQNYGDY-UHFFFAOYSA-N 1 1 327.768 2.155 20 5 EEBDMO CN(C)[C@@]1(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCSC1 ZINC000602563960 469362807 /nfs/dbraw/zinc/36/28/07/469362807.db2.gz JMRHENBXVCTBHO-OAHLLOKOSA-N 1 1 336.417 2.263 20 5 EEBDMO C[C@H](C(=O)N1CC[NH+](C[C@@H]2CCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000617688915 469759350 /nfs/dbraw/zinc/75/93/50/469759350.db2.gz SQQXLGCDQYDKRQ-YOEHRIQHSA-N 1 1 347.415 2.022 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594204037 485602825 /nfs/dbraw/zinc/60/28/25/485602825.db2.gz WMXKGKQVJHIPQQ-CABCVRRESA-N 1 1 333.388 2.350 20 5 EEBDMO COc1ccc(C[N@H+]2CC[C@@H](CN3CCCC3=O)C2)cc1[N+](=O)[O-] ZINC000595830107 485610432 /nfs/dbraw/zinc/61/04/32/485610432.db2.gz AAPPFIVGHFRCOU-CQSZACIVSA-N 1 1 333.388 2.048 20 5 EEBDMO C[C@@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CCS1 ZINC000192186623 534025300 /nfs/dbraw/zinc/02/53/00/534025300.db2.gz MXWISKZCLMCJLN-GFCCVEGCSA-N 1 1 335.429 2.311 20 5 EEBDMO C[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CCS1 ZINC000192186623 534025311 /nfs/dbraw/zinc/02/53/11/534025311.db2.gz MXWISKZCLMCJLN-GFCCVEGCSA-N 1 1 335.429 2.311 20 5 EEBDMO CC1(C)CC[C@@H](C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)O1 ZINC000187267873 529019931 /nfs/dbraw/zinc/01/99/31/529019931.db2.gz AJHSPSUJUAYVRB-INIZCTEOSA-N 1 1 347.415 2.310 20 5 EEBDMO CC(C)[N@H+](Cc1cccc(F)c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266648253 535096754 /nfs/dbraw/zinc/09/67/54/535096754.db2.gz XYGUCOYVJVQJPK-INIZCTEOSA-N 1 1 336.367 2.202 20 5 EEBDMO CC[C@H](C)C[N@@H+](C)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000732183406 577153999 /nfs/dbraw/zinc/15/39/99/577153999.db2.gz PBVVEWVGFWYLMR-LBPRGKRZSA-N 1 1 334.376 2.299 20 5 EEBDMO C[N@H+](Cc1ccc([S@](C)=O)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776588806 577463512 /nfs/dbraw/zinc/46/35/12/577463512.db2.gz BXKXWXWMFRUWIR-OSPHWJPCSA-N 1 1 348.424 2.498 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H](O)C[NH+]2CCC(O)(C(F)(F)F)CC2)cc1 ZINC000776593849 577463851 /nfs/dbraw/zinc/46/38/51/577463851.db2.gz 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CC(=O)c1cc(N2CCC([N@@H+](C)CCCO)CC2)ccc1[N+](=O)[O-] ZINC000283884198 293008522 /nfs/dbraw/zinc/00/85/22/293008522.db2.gz VJSJFVRZHDUDBL-UHFFFAOYSA-N 1 1 335.404 2.080 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000293584185 293244472 /nfs/dbraw/zinc/24/44/72/293244472.db2.gz ANCKSMUKWRGCEI-MRXNPFEDSA-N 1 1 337.807 2.345 20 5 EEBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)NCCc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000297392482 294231617 /nfs/dbraw/zinc/23/16/17/294231617.db2.gz RCSVHTQNXAZEMP-GOSISDBHSA-N 1 1 346.431 2.265 20 5 EEBDMO C[C@@H]1C[C@@H](C(=O)OC(C)(C)C)C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1 ZINC000421028349 314031354 /nfs/dbraw/zinc/03/13/54/314031354.db2.gz UGWVCLHJCRJQJQ-CHWSQXEVSA-N 1 1 338.408 2.091 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCO)[C@@H]1CCCSC1 ZINC000439006780 315063214 /nfs/dbraw/zinc/06/32/14/315063214.db2.gz HGZQWYFLOOERKS-CQSZACIVSA-N 1 1 326.418 2.293 20 5 EEBDMO CC1(C)CCC[N@@H+](CCNC(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000444620589 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462978816 /nfs/dbraw/zinc/97/88/16/462978816.db2.gz JOGJMWYUGADMIX-UHFFFAOYSA-N 1 1 345.403 2.374 20 5 EEBDMO COc1ccc(OCC[N@@H+](C)[C@@H](CO)C(C)(C)C)c([N+](=O)[O-])c1 ZINC000134407151 463035918 /nfs/dbraw/zinc/03/59/18/463035918.db2.gz ILYLJNGTPPQCEY-HNNXBMFYSA-N 1 1 326.393 2.321 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000094069737 463057148 /nfs/dbraw/zinc/05/71/48/463057148.db2.gz IQZUGRULKUSYKD-CABCVRRESA-N 1 1 347.415 2.113 20 5 EEBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1 ZINC000590776657 468336088 /nfs/dbraw/zinc/33/60/88/468336088.db2.gz YESSFWOTJIKNHS-TYNCELHUSA-N 1 1 335.429 2.238 20 5 EEBDMO CCCC[N@@H+](CCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000078665034 463138348 /nfs/dbraw/zinc/13/83/48/463138348.db2.gz DMVHIFZIKCZYRL-UHFFFAOYSA-N 1 1 329.784 2.281 20 5 EEBDMO C[N@@H+](CCOc1ccccc1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000026712013 463168921 /nfs/dbraw/zinc/16/89/21/463168921.db2.gz UZKLJVOIRWTXBB-INIZCTEOSA-N 1 1 346.383 2.345 20 5 EEBDMO CCCC[N@@H+](C)CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000122645347 463281920 /nfs/dbraw/zinc/28/19/20/463281920.db2.gz AGIVVOBHNJPURX-UHFFFAOYSA-N 1 1 329.422 2.142 20 5 EEBDMO O=C(c1ccccn1)N1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000138993210 463315760 /nfs/dbraw/zinc/31/57/60/463315760.db2.gz PAIKNWDHORTDBV-UHFFFAOYSA-N 1 1 340.383 2.338 20 5 EEBDMO O=C(c1ccccn1)N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000138993210 463315766 /nfs/dbraw/zinc/31/57/66/463315766.db2.gz PAIKNWDHORTDBV-UHFFFAOYSA-N 1 1 340.383 2.338 20 5 EEBDMO CC[N@@H+](CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000102183766 463384614 /nfs/dbraw/zinc/38/46/14/463384614.db2.gz YCAMKBIQYJNCDY-UHFFFAOYSA-N 1 1 347.824 2.011 20 5 EEBDMO C[C@@H](CNC(=O)COc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1C ZINC000032730720 463390379 /nfs/dbraw/zinc/39/03/79/463390379.db2.gz ZTYLLFOTBHDYCF-KBPBESRZSA-N 1 1 335.404 2.353 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[N@@H+](C)[C@H](C(C)C)C1 ZINC000553245685 468357123 /nfs/dbraw/zinc/35/71/23/468357123.db2.gz GBCHMCHVWDKTJN-INIZCTEOSA-N 1 1 335.404 2.466 20 5 EEBDMO NC(=O)[C@H]1CCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104662414 463416976 /nfs/dbraw/zinc/41/69/76/463416976.db2.gz DONDXZUOWKPLFS-CQSZACIVSA-N 1 1 344.371 2.132 20 5 EEBDMO C[C@H](c1cccc(S(N)(=O)=O)c1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000057842467 463524022 /nfs/dbraw/zinc/52/40/22/463524022.db2.gz KIYONJQPUWBWJT-GFCCVEGCSA-N 1 1 349.412 2.435 20 5 EEBDMO C[C@H](c1cccc(S(N)(=O)=O)c1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000057842467 463524023 /nfs/dbraw/zinc/52/40/23/463524023.db2.gz KIYONJQPUWBWJT-GFCCVEGCSA-N 1 1 349.412 2.435 20 5 EEBDMO COC(=O)CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(C)C ZINC000072633245 463526788 /nfs/dbraw/zinc/52/67/88/463526788.db2.gz NTUHDLJJTQTDPZ-UHFFFAOYSA-N 1 1 337.376 2.115 20 5 EEBDMO Cc1[nH+]ccn1CCCN(C)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000084290886 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1 349.387 2.197 20 5 EEBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000287218772 463836996 /nfs/dbraw/zinc/83/69/96/463836996.db2.gz FRTWNSLBGSRMGD-RDJZCZTQSA-N 1 1 346.431 2.406 20 5 EEBDMO CC[NH+]1CCN(C[C@H](C)CNc2cc(OC)ccc2[N+](=O)[O-])CC1 ZINC000277059997 463860939 /nfs/dbraw/zinc/86/09/39/463860939.db2.gz HUKKEABMEHBKFC-CQSZACIVSA-N 1 1 336.436 2.289 20 5 EEBDMO C[N@H+]1CCC[C@@H]1CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000194712205 463914555 /nfs/dbraw/zinc/91/45/55/463914555.db2.gz LUOVEDIESLFANB-OAHLLOKOSA-N 1 1 349.434 2.365 20 5 EEBDMO CCC[C@H]1CN(C(=O)c2c(C)cccc2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000278864266 464002222 /nfs/dbraw/zinc/00/22/22/464002222.db2.gz XMXJUKGGFLMUQM-HNNXBMFYSA-N 1 1 349.431 2.476 20 5 EEBDMO CCC[C@H]1CN(C(=O)c2c(C)cccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000278864266 464002229 /nfs/dbraw/zinc/00/22/29/464002229.db2.gz XMXJUKGGFLMUQM-HNNXBMFYSA-N 1 1 349.431 2.476 20 5 EEBDMO COC(=O)C[C@H]1CCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000179126169 464061717 /nfs/dbraw/zinc/06/17/17/464061717.db2.gz TVFUEEQBACDNLA-GFCCVEGCSA-N 1 1 346.343 2.172 20 5 EEBDMO COC(=O)C[C@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000179126169 464061724 /nfs/dbraw/zinc/06/17/24/464061724.db2.gz TVFUEEQBACDNLA-GFCCVEGCSA-N 1 1 346.343 2.172 20 5 EEBDMO Cc1ccc(NCCCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)[nH+]c1 ZINC000172361695 464062679 /nfs/dbraw/zinc/06/26/79/464062679.db2.gz GCLUSNYBHWTDBZ-UHFFFAOYSA-N 1 1 347.350 2.252 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)C[C@H]2CCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000270043508 464169221 /nfs/dbraw/zinc/16/92/21/464169221.db2.gz DNUNCMLRGLSIJH-ZENOOKHLSA-N 1 1 335.404 2.323 20 5 EEBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCC[C@@H]1O ZINC000270154307 464201695 /nfs/dbraw/zinc/20/16/95/464201695.db2.gz ROMBIGUKZKGLRW-JSGCOSHPSA-N 1 1 332.360 2.238 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1CCC[C@@H]1O ZINC000270202316 464218480 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2.481 20 5 EEBDMO COc1cc(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cc([N+](=O)[O-])c1C ZINC000189213369 464457367 /nfs/dbraw/zinc/45/73/67/464457367.db2.gz XHWDBXLGOFOKDR-GFCCVEGCSA-N 1 1 333.388 2.126 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)c1 ZINC000281484938 464473587 /nfs/dbraw/zinc/47/35/87/464473587.db2.gz HCMUEKRLVIVLCW-CQSZACIVSA-N 1 1 347.415 2.439 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CN(C)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000175392233 464539458 /nfs/dbraw/zinc/53/94/58/464539458.db2.gz AYTXQAKXIRSBPL-ZDUSSCGKSA-N 1 1 341.433 2.008 20 5 EEBDMO CCCCC[N@@H+](CCCOC)CCn1cc([N+](=O)[O-])ccc1=O ZINC000272588314 464670013 /nfs/dbraw/zinc/67/00/13/464670013.db2.gz PBEZBLWECSPDRB-UHFFFAOYSA-N 1 1 325.409 2.285 20 5 EEBDMO CC(C)[N@@H+](C)CCCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000272611047 464679771 /nfs/dbraw/zinc/67/97/71/464679771.db2.gz WUDSSRNIOGPRQX-UHFFFAOYSA-N 1 1 337.405 2.060 20 5 EEBDMO COC[C@@]1(C(=O)OC)CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000295033296 464684460 /nfs/dbraw/zinc/68/44/60/464684460.db2.gz LYAHPCYRFHGQIN-OAHLLOKOSA-N 1 1 342.779 2.260 20 5 EEBDMO COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000295033296 464684465 /nfs/dbraw/zinc/68/44/65/464684465.db2.gz LYAHPCYRFHGQIN-OAHLLOKOSA-N 1 1 342.779 2.260 20 5 EEBDMO COc1cc(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1F ZINC000295170198 464730837 /nfs/dbraw/zinc/73/08/37/464730837.db2.gz RPPITLUZRLEWNY-UWVGGRQHSA-N 1 1 337.351 2.098 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)c1 ZINC000282373546 464793665 /nfs/dbraw/zinc/79/36/65/464793665.db2.gz ABEOJGMULRSTPO-GOEBONIOSA-N 1 1 333.388 2.350 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1N1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000286257575 464857702 /nfs/dbraw/zinc/85/77/02/464857702.db2.gz GJTHZISQFVKBEN-SFHVURJKSA-N 1 1 341.415 2.431 20 5 EEBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](O)[C@H](C)C1 ZINC000249572839 464892738 /nfs/dbraw/zinc/89/27/38/464892738.db2.gz OSCXYTJYPQFULF-UHIISALHSA-N 1 1 332.360 2.409 20 5 EEBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](O)[C@H](C)C1 ZINC000249572839 464892744 /nfs/dbraw/zinc/89/27/44/464892744.db2.gz OSCXYTJYPQFULF-UHIISALHSA-N 1 1 332.360 2.409 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](O)CC(C)(C)C1 ZINC000295617334 464904211 /nfs/dbraw/zinc/90/42/11/464904211.db2.gz YWHBLGCMNPRQCZ-QWHCGFSZSA-N 1 1 335.404 2.405 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](O)CC(C)(C)C1 ZINC000295617334 464904213 /nfs/dbraw/zinc/90/42/13/464904213.db2.gz YWHBLGCMNPRQCZ-QWHCGFSZSA-N 1 1 335.404 2.405 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000282908670 464998224 /nfs/dbraw/zinc/99/82/24/464998224.db2.gz YKSPRMOYAHWJRT-CXAGYDPISA-N 1 1 346.431 2.261 20 5 EEBDMO CC(=O)c1cc(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000286667814 464999366 /nfs/dbraw/zinc/99/93/66/464999366.db2.gz MKEODNCIIVYXPJ-GFCCVEGCSA-N 1 1 335.404 2.079 20 5 EEBDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337424510 465361064 /nfs/dbraw/zinc/36/10/64/465361064.db2.gz RIYDNWCMJVHYBI-DVOMOZLQSA-N 1 1 335.404 2.405 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CCO[C@@H](C)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000298363017 465374464 /nfs/dbraw/zinc/37/44/64/465374464.db2.gz GBNMOHOHJTVAGL-RYUDHWBXSA-N 1 1 337.376 2.041 20 5 EEBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000356884033 465599722 /nfs/dbraw/zinc/59/97/22/465599722.db2.gz QVFCXNIEBPTRRB-NWDGAFQWSA-N 1 1 330.388 2.170 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CC[N@H+](C3CC3)C2)c1 ZINC000344538839 465654593 /nfs/dbraw/zinc/65/45/93/465654593.db2.gz YBSQDVVDSNLKCW-ZDUSSCGKSA-N 1 1 333.388 2.025 20 5 EEBDMO C[N@@H+]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@H](c2ccccc2)C1 ZINC000371276635 465682461 /nfs/dbraw/zinc/68/24/61/465682461.db2.gz YJMDURMPFPCANY-STQMWFEESA-N 1 1 331.397 2.484 20 5 EEBDMO C[N@H+]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@H](c2ccccc2)C1 ZINC000371276635 465682471 /nfs/dbraw/zinc/68/24/71/465682471.db2.gz YJMDURMPFPCANY-STQMWFEESA-N 1 1 331.397 2.484 20 5 EEBDMO C[C@@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1 ZINC000338063026 465792219 /nfs/dbraw/zinc/79/22/19/465792219.db2.gz XBHXHCNGHPOKCN-CQSZACIVSA-N 1 1 346.431 2.429 20 5 EEBDMO Cn1c(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000348787830 465792535 /nfs/dbraw/zinc/79/25/35/465792535.db2.gz SYSVVAPEPUZGTB-HNNXBMFYSA-N 1 1 342.399 2.185 20 5 EEBDMO CC[C@@H](NCCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000361184472 465821533 /nfs/dbraw/zinc/82/15/33/465821533.db2.gz QRNYEUDOSSOSOD-NVXWUHKLSA-N 1 1 348.447 2.223 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C)CCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000330960584 465874477 /nfs/dbraw/zinc/87/44/77/465874477.db2.gz FOUTUMYHYISWCS-OAHLLOKOSA-N 1 1 345.403 2.417 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CN(CC[NH+](C)C)Cc1cccc([N+](=O)[O-])c1 ZINC000349061806 465945105 /nfs/dbraw/zinc/94/51/05/465945105.db2.gz KHPSXOAVQGAKBK-SFHVURJKSA-N 1 1 334.464 2.443 20 5 EEBDMO COc1c(C(=O)NC[C@H](c2ccco2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000353534483 465959654 /nfs/dbraw/zinc/95/96/54/465959654.db2.gz KRWUKKJNOMLCKE-CYBMUJFWSA-N 1 1 333.344 2.229 20 5 EEBDMO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC[C@@H]1N1CCN(C)CC1 ZINC000367026823 466080199 /nfs/dbraw/zinc/08/01/99/466080199.db2.gz DDCPDWHIKUAGFS-APWZRJJASA-N 1 1 346.475 2.095 20 5 EEBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC[C@@H]1N1CCN(C)CC1 ZINC000367026823 466080207 /nfs/dbraw/zinc/08/02/07/466080207.db2.gz DDCPDWHIKUAGFS-APWZRJJASA-N 1 1 346.475 2.095 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1c[nH+]c2n1CCCC2 ZINC000367026720 466081282 /nfs/dbraw/zinc/08/12/82/466081282.db2.gz OENJYIQSDGDMGM-UHFFFAOYSA-N 1 1 345.359 2.458 20 5 EEBDMO C[C@@H](CNC(=O)CN(C)c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC000361534244 466082444 /nfs/dbraw/zinc/08/24/44/466082444.db2.gz WSACCULKAZYDQY-GJZGRUSLSA-N 1 1 348.447 2.410 20 5 EEBDMO C[C@@H]1CN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC[N@H+]1CC(C)(C)O ZINC000302493762 466146841 /nfs/dbraw/zinc/14/68/41/466146841.db2.gz LCOUQWVRWDHCPB-CYBMUJFWSA-N 1 1 344.415 2.424 20 5 EEBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@@H+](C)Cc1ccccc1 ZINC000346857878 466203731 /nfs/dbraw/zinc/20/37/31/466203731.db2.gz XCNOJYIOYZPGIW-ZDUSSCGKSA-N 1 1 330.388 2.184 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H]([C@H](C)O)C2)cccc1[N+](=O)[O-] ZINC000305631333 466412228 /nfs/dbraw/zinc/41/22/28/466412228.db2.gz FTGCUDHCNHKNFN-UONOGXRCSA-N 1 1 335.404 2.325 20 5 EEBDMO NC(=O)C[C@H]1CCCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000332249905 466471175 /nfs/dbraw/zinc/47/11/75/466471175.db2.gz LOGMTGOBHYWOSZ-CYBMUJFWSA-N 1 1 346.387 2.264 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000347218893 466485509 /nfs/dbraw/zinc/48/55/09/466485509.db2.gz YJBNSSFIMVVNQU-CQSZACIVSA-N 1 1 335.404 2.134 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H](CNc2ncnc3cccc([N+](=O)[O-])c32)C1 ZINC000347402913 466613941 /nfs/dbraw/zinc/61/39/41/466613941.db2.gz GPOSJTXFNJARMI-ZDUSSCGKSA-N 1 1 329.404 3.070 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH2+][C@H]3CCO[C@@H]3C3CC3)o2)cc1 ZINC000365199187 466742795 /nfs/dbraw/zinc/74/27/95/466742795.db2.gz GILGNUNINAETOD-DZGCQCFKSA-N 1 1 330.344 2.302 20 5 EEBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411717076 466886580 /nfs/dbraw/zinc/88/65/80/466886580.db2.gz HUMSBOGVNHZPAD-IKOBMHHLSA-N 1 1 345.399 2.279 20 5 EEBDMO COc1ccc(OCC[N@H+]2C[C@@H]3CC[C@H](O)C[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000412051047 466982693 /nfs/dbraw/zinc/98/26/93/466982693.db2.gz VKEAAEGGPZGBQM-MJBXVCDLSA-N 1 1 336.388 2.075 20 5 EEBDMO CC(C)NC(=O)c1ccc(N2CCC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000377636847 467103023 /nfs/dbraw/zinc/10/30/23/467103023.db2.gz LLZVNRFOCQRYHN-OAHLLOKOSA-N 1 1 346.431 2.408 20 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ZINC001254465881 1318081017 /nfs/dbraw/zinc/08/10/17/1318081017.db2.gz ITEWBQOOCXTFLC-CYBMUJFWSA-N 1 1 334.376 2.305 20 5 EEBDMO CC(C)N1CC[N@@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1=O ZINC001254480729 1318083620 /nfs/dbraw/zinc/08/36/20/1318083620.db2.gz MLWPEFVXBCTZJB-UHFFFAOYSA-N 1 1 346.431 2.116 20 5 EEBDMO CC(C)N1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1=O ZINC001254480729 1318083631 /nfs/dbraw/zinc/08/36/31/1318083631.db2.gz MLWPEFVXBCTZJB-UHFFFAOYSA-N 1 1 346.431 2.116 20 5 EEBDMO C[C@@H]1C[N@@H+](CCc2nnc(Cc3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC001258013779 1319127704 /nfs/dbraw/zinc/12/77/04/1319127704.db2.gz YNZIPSDWKYCVAN-BETUJISGSA-N 1 1 346.387 2.220 20 5 EEBDMO C[C@@H]1C[N@H+](CCc2nnc(Cc3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC001258013779 1319127713 /nfs/dbraw/zinc/12/77/13/1319127713.db2.gz YNZIPSDWKYCVAN-BETUJISGSA-N 1 1 346.387 2.220 20 5 EEBDMO O=[N+]([O-])c1ccc2ncc(N[C@H]3CCC[C@@H]3[NH+]3CCOCC3)nc2c1 ZINC001160724569 1320249261 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332.404 2.383 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC001330851452 1334914513 /nfs/dbraw/zinc/91/45/13/1334914513.db2.gz TZXMMDDFQUQOPP-QGZVFWFLSA-N 1 1 332.404 2.194 20 5 EEBDMO Cc1cn2cc(Nc3cc(-c4nn[nH]n4)ccc3[N+](=O)[O-])ccc2[nH+]1 ZINC001609439883 1351978045 /nfs/dbraw/zinc/97/80/45/1351978045.db2.gz LYKGFCIMKZSNHC-UHFFFAOYSA-N 1 1 336.315 2.475 20 5 EEBDMO CCC[C@@H]([NH2+]CC[N+](=O)[O-])C(=O)Nc1cccc(N2CCCC2)c1 ZINC001335409457 1336372268 /nfs/dbraw/zinc/37/22/68/1336372268.db2.gz UDDKTNCFDUHPGS-MRXNPFEDSA-N 1 1 334.420 2.260 20 5 EEBDMO CCN(CCNC(=O)C[N@@H+](C)C(C)C)c1cccc(F)c1[N+](=O)[O-] ZINC001100546648 1338490949 /nfs/dbraw/zinc/49/09/49/1338490949.db2.gz JOGJECLDLPJKKV-UHFFFAOYSA-N 1 1 340.399 2.017 20 5 EEBDMO Cc1cccn2c(NC(=O)[C@@](C)([NH3+])c3cccc([N+](=O)[O-])c3)cnc12 ZINC001579806401 1344416034 /nfs/dbraw/zinc/41/60/34/1344416034.db2.gz AOBHGUOGAMTBMK-KRWDZBQOSA-N 1 1 339.355 2.364 20 5 EEBDMO 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Cc1[nH]ccc1C(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001031606088 770136744 /nfs/dbraw/zinc/13/67/44/770136744.db2.gz XGTKVCSVGRVQNA-UHFFFAOYSA-N 1 1 328.372 2.093 20 5 EEBDMO CCc1nc(C(=O)NCC2C[NH+](Cc3ccc([N+](=O)[O-])cc3)C2)co1 ZINC001031623339 770391556 /nfs/dbraw/zinc/39/15/56/770391556.db2.gz CFDKFIQBFMLGPY-UHFFFAOYSA-N 1 1 344.371 2.007 20 5 EEBDMO CC(C)c1ccc(C[NH+]2CC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC001031661763 770721902 /nfs/dbraw/zinc/72/19/02/770721902.db2.gz HWASPQXTMIUHPL-IAGOWNOFSA-N 1 1 331.416 2.023 20 5 EEBDMO CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)C[N@@H+](C)C1CC1 ZINC000809955261 783559452 /nfs/dbraw/zinc/55/94/52/783559452.db2.gz FSVMJHLUAQZKNX-CQSZACIVSA-N 1 1 327.812 2.135 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2nccc(C(F)(F)F)n2)cc1 ZINC000819367961 785535413 /nfs/dbraw/zinc/53/54/13/785535413.db2.gz MEJWBMOLCOPEBZ-LLVKDONJSA-N 1 1 342.277 2.227 20 5 EEBDMO CC(C)[N@@H+](C)C[C@@H](O)CN(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000821390835 786723764 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VEDZVOPOPPXQSA-CZUORRHYSA-N 1 1 328.372 2.469 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC000916979173 798008362 /nfs/dbraw/zinc/00/83/62/798008362.db2.gz KBMIXTOBKBEANG-AWEZNQCLSA-N 1 1 332.404 2.383 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CC3=CCCCC3)C[C@H]2CC1 ZINC000946589426 801543529 /nfs/dbraw/zinc/54/35/29/801543529.db2.gz YQADDKKVWJHTKI-XMTFNYHQSA-N 1 1 347.459 2.322 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](CC3=CCCCC3)C[C@H]2CC1 ZINC000946589426 801543535 /nfs/dbraw/zinc/54/35/35/801543535.db2.gz YQADDKKVWJHTKI-XMTFNYHQSA-N 1 1 347.459 2.322 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CC3=CCCCC3)C[C@H]2CC1 ZINC000946589426 801543545 /nfs/dbraw/zinc/54/35/45/801543545.db2.gz YQADDKKVWJHTKI-XMTFNYHQSA-N 1 1 347.459 2.322 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CC[C@]3(C[C@H](Oc4cccnc4)CO3)C2)C1 ZINC001169020721 803588401 /nfs/dbraw/zinc/58/84/01/803588401.db2.gz MCCFRAUDVFFDSV-LAQRGFTBSA-N 1 1 347.415 2.139 20 5 EEBDMO COc1ccc(O[C@@H]2CCC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)nc1 ZINC001169050618 803595355 /nfs/dbraw/zinc/59/53/55/803595355.db2.gz BYRBVNDDNZMDKD-IJEWVQPXSA-N 1 1 335.404 2.379 20 5 EEBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000789332609 807953088 /nfs/dbraw/zinc/95/30/88/807953088.db2.gz RJSJTLUYMWTSFX-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO CN(CC[N@H+]1CCOC(C)(C)C1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000789332609 807953096 /nfs/dbraw/zinc/95/30/96/807953096.db2.gz RJSJTLUYMWTSFX-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO Cc1cnc(COC(=O)C[N@@H+](C)[C@@H]2CCSC2)c(C)c1[N+](=O)[O-] ZINC000789446922 808014266 /nfs/dbraw/zinc/01/42/66/808014266.db2.gz VZMOHJXQGPMXNV-GFCCVEGCSA-N 1 1 339.417 2.087 20 5 EEBDMO Cc1cnc(COC(=O)C[N@H+](C)[C@@H]2CCSC2)c(C)c1[N+](=O)[O-] ZINC000789446922 808014271 /nfs/dbraw/zinc/01/42/71/808014271.db2.gz VZMOHJXQGPMXNV-GFCCVEGCSA-N 1 1 339.417 2.087 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3ncncc3C2)c([N+](=O)[O-])c1 ZINC001170345826 809916088 /nfs/dbraw/zinc/91/60/88/809916088.db2.gz MLSVJHCOXZTPHO-LBPRGKRZSA-N 1 1 328.372 2.383 20 5 EEBDMO O=C(COC(F)(F)F)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001518881268 1119065970 /nfs/dbraw/zinc/06/59/70/1119065970.db2.gz WNHLUAMIPLLYFI-LBPRGKRZSA-N 1 1 348.277 2.249 20 5 EEBDMO O=C(COC(F)(F)F)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001518881268 1119065974 /nfs/dbraw/zinc/06/59/74/1119065974.db2.gz WNHLUAMIPLLYFI-LBPRGKRZSA-N 1 1 348.277 2.249 20 5 EEBDMO C[N@H+]1CC[C@H](CNC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000159055531 529804383 /nfs/dbraw/zinc/80/43/83/529804383.db2.gz OZEBXLYTHDGQPL-SECBINFHSA-N 1 1 342.193 2.039 20 5 EEBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1CCSC1 ZINC000129441071 529871432 /nfs/dbraw/zinc/87/14/32/529871432.db2.gz QGFGLNHRNWQKKD-LLVKDONJSA-N 1 1 327.381 2.500 20 5 EEBDMO C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@H]1CCCC[C@@H]1O ZINC000181430376 529980124 /nfs/dbraw/zinc/98/01/24/529980124.db2.gz 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CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1[N@@H+](C)CCCC1(C)C ZINC000447807834 242320392 /nfs/dbraw/zinc/32/03/92/242320392.db2.gz RQFFPUXQKKYACR-HNNXBMFYSA-N 1 1 334.420 2.487 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCC[C@@H]1C[C@H](C)O ZINC000447825918 242322689 /nfs/dbraw/zinc/32/26/89/242322689.db2.gz FMVPSILPBQPURI-UONOGXRCSA-N 1 1 335.404 2.467 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCCC[C@@H]1C[C@H](C)O ZINC000447825918 242322692 /nfs/dbraw/zinc/32/26/92/242322692.db2.gz FMVPSILPBQPURI-UONOGXRCSA-N 1 1 335.404 2.467 20 5 EEBDMO C[C@H]1CN(CC[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000451542805 243150568 /nfs/dbraw/zinc/15/05/68/243150568.db2.gz AFZWQBIWXHZHRK-RDJZCZTQSA-N 1 1 333.432 2.495 20 5 EEBDMO C[C@@H]1COCCN1CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549159 243152510 /nfs/dbraw/zinc/15/25/10/243152510.db2.gz PBLGVRACBIXSIF-NVXWUHKLSA-N 1 1 333.432 2.495 20 5 EEBDMO C[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)CC[N@@H+](Cc2ccccc2)C1 ZINC000451705190 243215836 /nfs/dbraw/zinc/21/58/36/243215836.db2.gz HYPPSSMAXZOGOK-MRXNPFEDSA-N 1 1 343.431 2.245 20 5 EEBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000456352020 244226525 /nfs/dbraw/zinc/22/65/25/244226525.db2.gz MXWPPHMINDWRGZ-CQSZACIVSA-N 1 1 335.404 2.306 20 5 EEBDMO CCOCC[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000111707189 220182722 /nfs/dbraw/zinc/18/27/22/220182722.db2.gz CCIOGDCJGRTCKA-UHFFFAOYSA-N 1 1 336.392 2.089 20 5 EEBDMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-] ZINC000491842224 246175493 /nfs/dbraw/zinc/17/54/93/246175493.db2.gz GLFXIYLWWJSOOH-VQOXYXNASA-N 1 1 333.363 2.442 20 5 EEBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2N2CCOC2=O)CC[N@H+]1C ZINC000491986781 246245729 /nfs/dbraw/zinc/24/57/29/246245729.db2.gz NGUWITJSPGOWBD-VXGBXAGGSA-N 1 1 334.376 2.446 20 5 EEBDMO CC[C@@H](O)[C@H]1CCCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000265048233 247161517 /nfs/dbraw/zinc/16/15/17/247161517.db2.gz PDLZDTBYFFQEJM-IAGOWNOFSA-N 1 1 347.415 2.109 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000266103245 248098331 /nfs/dbraw/zinc/09/83/31/248098331.db2.gz SGYATZCGUONJGY-ZBEGNZNMSA-N 1 1 330.388 2.488 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(NC[C@H](C(C)C)N2CC[NH+](C)CC2)c1 ZINC000266134951 248121338 /nfs/dbraw/zinc/12/13/38/248121338.db2.gz FKBZXKOSPGCMTB-QGZVFWFLSA-N 1 1 336.436 2.287 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@@H]2Cc2ccccc2)c1 ZINC000266528398 248346491 /nfs/dbraw/zinc/34/64/91/248346491.db2.gz LEFPNSAJAPSSQG-SJLPKXTDSA-N 1 1 344.415 2.249 20 5 EEBDMO COC(=O)[C@H](C)C[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000091985109 218097725 /nfs/dbraw/zinc/09/77/25/218097725.db2.gz FFSVNLIIEYZVHP-GFCCVEGCSA-N 1 1 346.387 2.236 20 5 EEBDMO COc1cc[nH+]c(N2CCN(Cc3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000267085886 256025399 /nfs/dbraw/zinc/02/53/99/256025399.db2.gz ZKQMSABMFTWRFX-UHFFFAOYSA-N 1 1 346.362 2.460 20 5 EEBDMO COc1cc(C(=O)Nc2cc[nH+]c(N(C)C)c2)c([N+](=O)[O-])cc1OC ZINC000267288386 256045764 /nfs/dbraw/zinc/04/57/64/256045764.db2.gz XVDVCHPKGMMNMM-UHFFFAOYSA-N 1 1 346.343 2.325 20 5 EEBDMO Cn1cc(C[N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000119664748 221371271 /nfs/dbraw/zinc/37/12/71/221371271.db2.gz QSOFCTZMKCJTBZ-UHFFFAOYSA-N 1 1 340.387 2.361 20 5 EEBDMO Cn1cc(C[N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000119664748 221371272 /nfs/dbraw/zinc/37/12/72/221371272.db2.gz QSOFCTZMKCJTBZ-UHFFFAOYSA-N 1 1 340.387 2.361 20 5 EEBDMO CCCN(CCC)C(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072665126 292168004 /nfs/dbraw/zinc/16/80/04/292168004.db2.gz CRCXYQZHHWQQGD-AWEZNQCLSA-N 1 1 349.435 2.125 20 5 EEBDMO CCCN(CCC)C(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072665126 292168005 /nfs/dbraw/zinc/16/80/05/292168005.db2.gz CRCXYQZHHWQQGD-AWEZNQCLSA-N 1 1 349.435 2.125 20 5 EEBDMO CC[N@@H+](C[C@H](C)O)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000352203504 153003030 /nfs/dbraw/zinc/00/30/30/153003030.db2.gz SGMIVMSDLNGPAZ-UWVGGRQHSA-N 1 1 329.784 2.278 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](C)[C@@H]1CO ZINC000305457661 160516729 /nfs/dbraw/zinc/51/67/29/160516729.db2.gz ULTONUJWAOTMQA-BBRMVZONSA-N 1 1 335.404 2.325 20 5 EEBDMO C[N@H+]1CCC[C@@H](CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000132220188 292398664 /nfs/dbraw/zinc/39/86/64/292398664.db2.gz ACOFDBZIWQMDDS-LBPRGKRZSA-N 1 1 330.388 2.077 20 5 EEBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000367272585 165936817 /nfs/dbraw/zinc/93/68/17/165936817.db2.gz VJVMTXNSWISQFC-JKSUJKDBSA-N 1 1 346.431 2.406 20 5 EEBDMO CC[N@H+]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000341772319 161012265 /nfs/dbraw/zinc/01/22/65/161012265.db2.gz LGQIZFVRAZMADD-CQSZACIVSA-N 1 1 334.420 2.340 20 5 EEBDMO COC[C@H]1CCCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000342705234 161084455 /nfs/dbraw/zinc/08/44/55/161084455.db2.gz 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342.399 2.478 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(c3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])C2)C1 ZINC000368304825 166086531 /nfs/dbraw/zinc/08/65/31/166086531.db2.gz QMQLJFBFBLOGJU-GOSISDBHSA-N 1 1 344.415 2.019 20 5 EEBDMO C[N@H+]1CCCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC1 ZINC000279536106 269285981 /nfs/dbraw/zinc/28/59/81/269285981.db2.gz HTEYCSFIODHEDU-UHFFFAOYSA-N 1 1 329.759 2.094 20 5 EEBDMO C[C@]1(O)CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000280202239 269337782 /nfs/dbraw/zinc/33/77/82/269337782.db2.gz UQLCRWGARBTWKT-INIZCTEOSA-N 1 1 332.360 2.382 20 5 EEBDMO C[C@@H]1C[N@@H+](CCN(C)C(=O)/C=C/c2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000194758909 274071878 /nfs/dbraw/zinc/07/18/78/274071878.db2.gz JQUFFPABPCELEH-LAELXIFRSA-N 1 1 347.415 2.176 20 5 EEBDMO C[C@@H]1C[N@H+](CCN(C)C(=O)/C=C/c2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000194758909 274071880 /nfs/dbraw/zinc/07/18/80/274071880.db2.gz JQUFFPABPCELEH-LAELXIFRSA-N 1 1 347.415 2.176 20 5 EEBDMO 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ZINC000291600384 275321638 /nfs/dbraw/zinc/32/16/38/275321638.db2.gz RTKIYQWVXKCRDH-LLVKDONJSA-N 1 1 333.392 2.321 20 5 EEBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000291600384 275321639 /nfs/dbraw/zinc/32/16/39/275321639.db2.gz RTKIYQWVXKCRDH-LLVKDONJSA-N 1 1 333.392 2.321 20 5 EEBDMO C[C@@H]1CN(C(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000292098058 275375794 /nfs/dbraw/zinc/37/57/94/275375794.db2.gz HPMWNSKFIDVMEA-CHWSQXEVSA-N 1 1 335.404 2.055 20 5 EEBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000365389797 277211605 /nfs/dbraw/zinc/21/16/05/277211605.db2.gz LKGDXQFLCRCPTK-OAHLLOKOSA-N 1 1 341.367 2.277 20 5 EEBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000365389797 277211607 /nfs/dbraw/zinc/21/16/07/277211607.db2.gz LKGDXQFLCRCPTK-OAHLLOKOSA-N 1 1 341.367 2.277 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(=O)N2CCCC2)C1 ZINC000287481703 293064171 /nfs/dbraw/zinc/06/41/71/293064171.db2.gz SHTUEGNIIHKUQN-AWEZNQCLSA-N 1 1 347.415 2.438 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+](C2CCC2)C1 ZINC000293694584 293272916 /nfs/dbraw/zinc/27/29/16/293272916.db2.gz MSZYQQUJVXRAAZ-LBPRGKRZSA-N 1 1 333.388 2.247 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000293694584 293272917 /nfs/dbraw/zinc/27/29/17/293272917.db2.gz MSZYQQUJVXRAAZ-LBPRGKRZSA-N 1 1 333.388 2.247 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C[C@H](C)[N@H+]1C ZINC000293848570 293309890 /nfs/dbraw/zinc/30/98/90/293309890.db2.gz AJCBUTMJKSTPNE-OKILXGFUSA-N 1 1 346.431 2.360 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C[C@H](C)[N@@H+]1C ZINC000293848570 293309892 /nfs/dbraw/zinc/30/98/92/293309892.db2.gz AJCBUTMJKSTPNE-OKILXGFUSA-N 1 1 346.431 2.360 20 5 EEBDMO CC(C)[NH+]1CC(NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000297143594 294162983 /nfs/dbraw/zinc/16/29/83/294162983.db2.gz QZHPWBDZRBDLKI-UHFFFAOYSA-N 1 1 342.193 2.180 20 5 EEBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)CC(C)(C)O ZINC000158200001 311325439 /nfs/dbraw/zinc/32/54/39/311325439.db2.gz YQDVKNIDNWLBTP-UHFFFAOYSA-N 1 1 339.392 2.025 20 5 EEBDMO CCC[N@H+]1CCC[C@@H]1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000332419739 312004869 /nfs/dbraw/zinc/00/48/69/312004869.db2.gz PUNMJSUXDNVTOM-QGZVFWFLSA-N 1 1 346.431 2.118 20 5 EEBDMO CC[C@@H]1C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1 ZINC000439482244 315081386 /nfs/dbraw/zinc/08/13/86/315081386.db2.gz SDFVXRYWLIDHKJ-HZPDHXFCSA-N 1 1 333.388 2.201 20 5 EEBDMO CC[C@@H]1C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1 ZINC000439482244 315081388 /nfs/dbraw/zinc/08/13/88/315081388.db2.gz SDFVXRYWLIDHKJ-HZPDHXFCSA-N 1 1 333.388 2.201 20 5 EEBDMO CC[N@H+]1CCC[C@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000448825697 315388365 /nfs/dbraw/zinc/38/83/65/315388365.db2.gz XFIBRAHRGUJGEA-CQSZACIVSA-N 1 1 347.415 2.406 20 5 EEBDMO C[C@]1(NC(=O)c2cc([N+](=O)[O-])c[nH]2)CC[N@@H+](Cc2ccccc2)C1 ZINC000566312556 319273858 /nfs/dbraw/zinc/27/38/58/319273858.db2.gz ODWZSTBEFAYMJP-KRWDZBQOSA-N 1 1 328.372 2.317 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000578040665 320290954 /nfs/dbraw/zinc/29/09/54/320290954.db2.gz HIUDCTIEGKHFRS-CYBMUJFWSA-N 1 1 330.388 2.171 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000580873738 324143359 /nfs/dbraw/zinc/14/33/59/324143359.db2.gz FPTCLKSWFBSILF-AWEZNQCLSA-N 1 1 347.415 2.404 20 5 EEBDMO CC[N@H+]1CCC[C@@H](CNC(=O)NCc2cccc([N+](=O)[O-])c2C)C1 ZINC000358443539 465126280 /nfs/dbraw/zinc/12/62/80/465126280.db2.gz LOBYMBVNPCFPTP-AWEZNQCLSA-N 1 1 334.420 2.434 20 5 EEBDMO Cc1c(CNC(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cccc1[N+](=O)[O-] ZINC000358680345 465261211 /nfs/dbraw/zinc/26/12/11/465261211.db2.gz JXAGITNHAGAUCG-GJZGRUSLSA-N 1 1 332.404 2.329 20 5 EEBDMO COC(=O)[C@@H](C)C[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000153741630 462685839 /nfs/dbraw/zinc/68/58/39/462685839.db2.gz XSURIXMAVGMASD-LBPRGKRZSA-N 1 1 349.387 2.115 20 5 EEBDMO COC(=O)[C@@H](C)C[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000153741630 462685845 /nfs/dbraw/zinc/68/58/45/462685845.db2.gz XSURIXMAVGMASD-LBPRGKRZSA-N 1 1 349.387 2.115 20 5 EEBDMO C[C@@H]1CN(c2ncnc3ccc([N+](=O)[O-])cc32)CC[N@H+](C2CC2)C1 ZINC000590703700 468312785 /nfs/dbraw/zinc/31/27/85/468312785.db2.gz VUVGDGRXLLYWMW-LBPRGKRZSA-N 1 1 327.388 2.459 20 5 EEBDMO CC[N@H+](CCC(=O)OC)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000064570664 462710097 /nfs/dbraw/zinc/71/00/97/462710097.db2.gz DWAWXDQQNJVYSR-UHFFFAOYSA-N 1 1 343.767 2.072 20 5 EEBDMO CC[N@@H+](CCC(=O)OC)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000064570664 462710099 /nfs/dbraw/zinc/71/00/99/462710099.db2.gz DWAWXDQQNJVYSR-UHFFFAOYSA-N 1 1 343.767 2.072 20 5 EEBDMO COc1ccccc1C[C@H](C)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000090550915 462797600 /nfs/dbraw/zinc/79/76/00/462797600.db2.gz HFNSNDFGNMLSGG-AWEZNQCLSA-N 1 1 345.399 2.328 20 5 EEBDMO C[NH+](C)[C@H](CNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000010088616 462812017 /nfs/dbraw/zinc/81/20/17/462812017.db2.gz IFNLFQQHPBHXAV-OAHLLOKOSA-N 1 1 349.412 2.176 20 5 EEBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCN(Cc3cscn3)CC2)cc1 ZINC000065952739 462841784 /nfs/dbraw/zinc/84/17/84/462841784.db2.gz QDMRLQAHYJTPFD-UHFFFAOYSA-N 1 1 332.429 2.412 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000066140300 462855123 /nfs/dbraw/zinc/85/51/23/462855123.db2.gz GRWUDDMWBGZCCK-ZDUSSCGKSA-N 1 1 332.404 2.396 20 5 EEBDMO COc1ccc(NC(=O)C[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000155404888 462887101 /nfs/dbraw/zinc/88/71/01/462887101.db2.gz DOLWYSPOUPBSHC-MLGOLLRUSA-N 1 1 349.387 2.043 20 5 EEBDMO COc1ccc(NC(=O)C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000155404888 462887102 /nfs/dbraw/zinc/88/71/02/462887102.db2.gz DOLWYSPOUPBSHC-MLGOLLRUSA-N 1 1 349.387 2.043 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2ccccc2)[C@H](CO)C2CC2)n1 ZINC000156019297 462969221 /nfs/dbraw/zinc/96/92/21/462969221.db2.gz UEEZLJJHCGMHTN-MRXNPFEDSA-N 1 1 330.388 2.064 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000049992637 462983516 /nfs/dbraw/zinc/98/35/16/462983516.db2.gz DSOKRZKIQAOMGO-ZDUSSCGKSA-N 1 1 348.359 2.122 20 5 EEBDMO COc1cc(C[N@@H+]2CC[C@@H](O)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000590762466 468331881 /nfs/dbraw/zinc/33/18/81/468331881.db2.gz YYQCDFPNGGQFDA-LDYMZIIASA-N 1 1 332.303 2.160 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@@H](O)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000590762466 468331887 /nfs/dbraw/zinc/33/18/87/468331887.db2.gz YYQCDFPNGGQFDA-LDYMZIIASA-N 1 1 332.303 2.160 20 5 EEBDMO CCc1nn(C)c(NCC[N@@H+]2CCc3sccc3C2)c1[N+](=O)[O-] ZINC000094149567 463061194 /nfs/dbraw/zinc/06/11/94/463061194.db2.gz HXNKPSHURFDZQD-UHFFFAOYSA-N 1 1 335.433 2.422 20 5 EEBDMO CCc1nn(C)c(NCC[N@H+]2CCc3sccc3C2)c1[N+](=O)[O-] ZINC000094149567 463061200 /nfs/dbraw/zinc/06/12/00/463061200.db2.gz HXNKPSHURFDZQD-UHFFFAOYSA-N 1 1 335.433 2.422 20 5 EEBDMO Cc1[nH+]ccn1CCCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000078333078 463105220 /nfs/dbraw/zinc/10/52/20/463105220.db2.gz ICBXVECTBRFTKA-UHFFFAOYSA-N 1 1 343.387 2.494 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000068468085 463140172 /nfs/dbraw/zinc/14/01/72/463140172.db2.gz APRADSQYVGRMFQ-CQSZACIVSA-N 1 1 344.415 2.396 20 5 EEBDMO NC(=O)c1ccc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000027348663 463188072 /nfs/dbraw/zinc/18/80/72/463188072.db2.gz WPUCCXKQVFRGHF-UHFFFAOYSA-N 1 1 340.383 2.016 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000137231518 463284732 /nfs/dbraw/zinc/28/47/32/463284732.db2.gz WXMPDZNDDSWIDZ-RDJZCZTQSA-N 1 1 346.431 2.263 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000055172962 463291767 /nfs/dbraw/zinc/29/17/67/463291767.db2.gz YDIKHXYXSYURGD-HNNXBMFYSA-N 1 1 346.387 2.409 20 5 EEBDMO Cc1c(NC(=O)N2CC[NH+](C[C@H]3CCCO3)CC2)cccc1[N+](=O)[O-] ZINC000069775302 463322060 /nfs/dbraw/zinc/32/20/60/463322060.db2.gz TXMNXVPLCLYVAS-CQSZACIVSA-N 1 1 348.403 2.232 20 5 EEBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000124487718 463429966 /nfs/dbraw/zinc/42/99/66/463429966.db2.gz SBUAURFPFLZKMT-HNNXBMFYSA-N 1 1 349.431 2.458 20 5 EEBDMO Cc1cc([C@@H]2CCC[N@@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)no1 ZINC000044591189 463685042 /nfs/dbraw/zinc/68/50/42/463685042.db2.gz VQIQSPKAMOTHCI-YOEHRIQHSA-N 1 1 347.371 2.468 20 5 EEBDMO Cc1cc([C@@H]2CCC[N@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)no1 ZINC000044591189 463685046 /nfs/dbraw/zinc/68/50/46/463685046.db2.gz VQIQSPKAMOTHCI-YOEHRIQHSA-N 1 1 347.371 2.468 20 5 EEBDMO CCCC[N@@H+](C)CCNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000112363970 463699996 /nfs/dbraw/zinc/69/99/96/463699996.db2.gz YPAZYXNGUYREFV-UHFFFAOYSA-N 1 1 349.840 2.258 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC[C@@H]21 ZINC000194073784 463786786 /nfs/dbraw/zinc/78/67/86/463786786.db2.gz QYPWDFFRHUAGKW-DOMZBBRYSA-N 1 1 334.376 2.419 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000261870006 463883165 /nfs/dbraw/zinc/88/31/65/463883165.db2.gz XHEBEVHIANORDL-MRXNPFEDSA-N 1 1 326.356 2.085 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(c3cc(Br)ccc3[N+](=O)[O-])C[C@H]2C1 ZINC000278760668 463982157 /nfs/dbraw/zinc/98/21/57/463982157.db2.gz NMVZCOFCJONLHQ-AOOOYVTPSA-N 1 1 326.194 2.355 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCCCCO ZINC000278867573 464004084 /nfs/dbraw/zinc/00/40/84/464004084.db2.gz LVKHJTWQVFGWPI-UHFFFAOYSA-N 1 1 339.392 2.026 20 5 EEBDMO COc1ccc(CN(C)CCN2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000195315648 464037465 /nfs/dbraw/zinc/03/74/65/464037465.db2.gz ZGFXNKNKISSWPP-OKILXGFUSA-N 1 1 337.420 2.144 20 5 EEBDMO COc1ccc(CN(C)CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000195315648 464037472 /nfs/dbraw/zinc/03/74/72/464037472.db2.gz ZGFXNKNKISSWPP-OKILXGFUSA-N 1 1 337.420 2.144 20 5 EEBDMO COc1ccc(CN(C)CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000195315648 464037475 /nfs/dbraw/zinc/03/74/75/464037475.db2.gz ZGFXNKNKISSWPP-OKILXGFUSA-N 1 1 337.420 2.144 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@]12CCOC2=O ZINC000186641898 464039876 /nfs/dbraw/zinc/03/98/76/464039876.db2.gz NFHKXVWLLZJAGQ-KRWDZBQOSA-N 1 1 347.371 2.013 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@]12CCOC2=O ZINC000186641898 464039880 /nfs/dbraw/zinc/03/98/80/464039880.db2.gz NFHKXVWLLZJAGQ-KRWDZBQOSA-N 1 1 347.371 2.013 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H](OCCO)C3)co2)cc1 ZINC000179202014 464080579 /nfs/dbraw/zinc/08/05/79/464080579.db2.gz QAOJFCTYYHDZFH-MRXNPFEDSA-N 1 1 347.371 2.223 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@@H](OCCO)C3)co2)cc1 ZINC000179202014 464080586 /nfs/dbraw/zinc/08/05/86/464080586.db2.gz QAOJFCTYYHDZFH-MRXNPFEDSA-N 1 1 347.371 2.223 20 5 EEBDMO C[C@]12CC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C[C@H]1C2(Cl)Cl ZINC000284374212 464168964 /nfs/dbraw/zinc/16/89/64/464168964.db2.gz FFEYDBJCJPTXDK-YPMHNXCESA-N 1 1 346.214 2.272 20 5 EEBDMO CSC[C@@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000292276715 464181612 /nfs/dbraw/zinc/18/16/12/464181612.db2.gz BLODZKXLVMTDFR-HIFRSBDPSA-N 1 1 340.445 2.410 20 5 EEBDMO C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C1([NH+]2CCOCC2)CCCC1 ZINC000173184259 464206800 /nfs/dbraw/zinc/20/68/00/464206800.db2.gz HAELBTUUIGNSHZ-CQSZACIVSA-N 1 1 347.415 2.358 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000292651013 464299412 /nfs/dbraw/zinc/29/94/12/464299412.db2.gz XSJJSNAZDHDPDQ-GOSISDBHSA-N 1 1 331.416 2.427 20 5 EEBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@H]1COc2ccccc2O1 ZINC000174819182 464454812 /nfs/dbraw/zinc/45/48/12/464454812.db2.gz GPJNOIJWELHARQ-HNNXBMFYSA-N 1 1 346.387 2.343 20 5 EEBDMO C[N@@H+]1CC=C(CNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272169465 464504122 /nfs/dbraw/zinc/50/41/22/464504122.db2.gz IZUMKTJBZRFWMG-UHFFFAOYSA-N 1 1 325.315 2.065 20 5 EEBDMO CC[N@@H+](CCNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000272449967 464614024 /nfs/dbraw/zinc/61/40/24/464614024.db2.gz CECXPPCMDYAUOD-UHFFFAOYSA-N 1 1 327.331 2.287 20 5 EEBDMO Cc1nc(CC[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)n[nH]1 ZINC000272450317 464614682 /nfs/dbraw/zinc/61/46/82/464614682.db2.gz SMDCFBUTDXCVTI-UHFFFAOYSA-N 1 1 344.400 2.477 20 5 EEBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCOc3cc(O)ccc3C2)c1 ZINC000285582365 464618022 /nfs/dbraw/zinc/61/80/22/464618022.db2.gz UCVODWYGIOCDHW-MRXNPFEDSA-N 1 1 330.340 2.228 20 5 EEBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCOc3cc(O)ccc3C2)c1 ZINC000285582365 464618027 /nfs/dbraw/zinc/61/80/27/464618027.db2.gz UCVODWYGIOCDHW-MRXNPFEDSA-N 1 1 330.340 2.228 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272459719 464620306 /nfs/dbraw/zinc/62/03/06/464620306.db2.gz DFKRMCSZZQNXPN-ZDUSSCGKSA-N 1 1 327.331 2.287 20 5 EEBDMO Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272472793 464624240 /nfs/dbraw/zinc/62/42/40/464624240.db2.gz PRVFWXSKDKDZFC-CQSZACIVSA-N 1 1 340.383 2.181 20 5 EEBDMO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]Cc1nnc(C2CC2)[nH]1 ZINC000294871975 464633264 /nfs/dbraw/zinc/63/32/64/464633264.db2.gz UUQRGKXJFSBWCI-JTQLQIEISA-N 1 1 344.375 2.097 20 5 EEBDMO C[C@@H]1CSCC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000190415207 464639287 /nfs/dbraw/zinc/63/92/87/464639287.db2.gz VQFNOKYIPJJTMA-LBPRGKRZSA-N 1 1 335.429 2.169 20 5 EEBDMO C[C@@H]1CSCC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000190415207 464639295 /nfs/dbraw/zinc/63/92/95/464639295.db2.gz VQFNOKYIPJJTMA-LBPRGKRZSA-N 1 1 335.429 2.169 20 5 EEBDMO C[C@@H]([N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C(C)(C)O ZINC000295086633 464699972 /nfs/dbraw/zinc/69/99/72/464699972.db2.gz DVVGAJPSKMIPQL-SNVBAGLBSA-N 1 1 327.356 2.154 20 5 EEBDMO CO[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1(C)C ZINC000295157827 464727156 /nfs/dbraw/zinc/72/71/56/464727156.db2.gz AUDCUFMKEHWJLP-HNNXBMFYSA-N 1 1 335.404 2.305 20 5 EEBDMO CO[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1(C)C ZINC000295157827 464727163 /nfs/dbraw/zinc/72/71/63/464727163.db2.gz AUDCUFMKEHWJLP-HNNXBMFYSA-N 1 1 335.404 2.305 20 5 EEBDMO CCC[N@@H+](CC)CCNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000295309196 464784229 /nfs/dbraw/zinc/78/42/29/464784229.db2.gz OBOLDCBICDBKAW-UHFFFAOYSA-N 1 1 327.356 2.204 20 5 EEBDMO COc1cccc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)c1[N+](=O)[O-] ZINC000248884420 464814853 /nfs/dbraw/zinc/81/48/53/464814853.db2.gz UEVVBNDIAKBMBD-JSGCOSHPSA-N 1 1 333.388 2.160 20 5 EEBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000282542046 464859013 /nfs/dbraw/zinc/85/90/13/464859013.db2.gz RNCBNKVEANXACG-CYBMUJFWSA-N 1 1 337.395 2.419 20 5 EEBDMO CCn1cc(CC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)cn1 ZINC000276262849 464868285 /nfs/dbraw/zinc/86/82/85/464868285.db2.gz BLGOGVSGLLCDBX-UHFFFAOYSA-N 1 1 329.404 2.176 20 5 EEBDMO C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])c2cccnc21 ZINC000286316161 464877335 /nfs/dbraw/zinc/87/73/35/464877335.db2.gz KOAZZELAROTNEH-KBPBESRZSA-N 1 1 342.399 2.442 20 5 EEBDMO C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])c2cccnc21 ZINC000286316167 464878086 /nfs/dbraw/zinc/87/80/86/464878086.db2.gz KOAZZELAROTNEH-UONOGXRCSA-N 1 1 342.399 2.442 20 5 EEBDMO COCCCn1nccc1C[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000282789898 464950741 /nfs/dbraw/zinc/95/07/41/464950741.db2.gz YKMGNEZUVRJFFI-UHFFFAOYSA-N 1 1 334.376 2.126 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H](CO)c1ccccc1 ZINC000359524835 465432023 /nfs/dbraw/zinc/43/20/23/465432023.db2.gz YGUKYARKQJMGHT-CQSZACIVSA-N 1 1 329.356 2.165 20 5 EEBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000351943393 465455452 /nfs/dbraw/zinc/45/54/52/465455452.db2.gz LQBLMKIRKQQTAD-JTQLQIEISA-N 1 1 343.330 2.362 20 5 EEBDMO C[C@H]1C[N@H+](Cc2cccc(CNc3c([N+](=O)[O-])ncn3C)c2)CCO1 ZINC000299224495 465653741 /nfs/dbraw/zinc/65/37/41/465653741.db2.gz IRJCKMSXCNGTPT-ZDUSSCGKSA-N 1 1 345.403 2.161 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2cccc(CNc3c([N+](=O)[O-])ncn3C)c2)CCO1 ZINC000299224495 465653747 /nfs/dbraw/zinc/65/37/47/465653747.db2.gz IRJCKMSXCNGTPT-ZDUSSCGKSA-N 1 1 345.403 2.161 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c1 ZINC000330678296 465757322 /nfs/dbraw/zinc/75/73/22/465757322.db2.gz JXGFTWAJLNHHLU-KGLIPLIRSA-N 1 1 335.404 2.223 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCN(C)c2[nH+]cccc21 ZINC000348959568 465892785 /nfs/dbraw/zinc/89/27/85/465892785.db2.gz WRTGDWFORWOFRD-UHFFFAOYSA-N 1 1 341.371 2.193 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000366825154 465956083 /nfs/dbraw/zinc/95/60/83/465956083.db2.gz UHUTVUFBVSLAIC-LSDHHAIUSA-N 1 1 347.415 2.415 20 5 EEBDMO C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000366884737 465995417 /nfs/dbraw/zinc/99/54/17/465995417.db2.gz OHIBZRWAPJMGBQ-KYJSFNMBSA-N 1 1 344.415 2.420 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@H]2C[N@@H+](C3CC3)CCO2)c(OC(F)F)c1 ZINC000302062621 466090427 /nfs/dbraw/zinc/09/04/27/466090427.db2.gz UMLUREVRGFAIOU-LBPRGKRZSA-N 1 1 343.330 2.471 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@H]2C[N@H+](C3CC3)CCO2)c(OC(F)F)c1 ZINC000302062621 466090435 /nfs/dbraw/zinc/09/04/35/466090435.db2.gz UMLUREVRGFAIOU-LBPRGKRZSA-N 1 1 343.330 2.471 20 5 EEBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])n2C)C1 ZINC000340506290 466138288 /nfs/dbraw/zinc/13/82/88/466138288.db2.gz JNAHEVXNNDMYLM-HZSPNIEDSA-N 1 1 334.420 2.411 20 5 EEBDMO CCCC[N@@H+](C)CCNc1c(Br)cncc1[N+](=O)[O-] ZINC000346812242 466171528 /nfs/dbraw/zinc/17/15/28/466171528.db2.gz ANRBSWGLHATKHF-UHFFFAOYSA-N 1 1 331.214 2.318 20 5 EEBDMO CC(C)c1[nH+]ccn1CCC(=O)N1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000349697847 466195998 /nfs/dbraw/zinc/19/59/98/466195998.db2.gz SROJXDQXFXCHBA-UHFFFAOYSA-N 1 1 343.387 2.285 20 5 EEBDMO COc1c(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000331912111 466302686 /nfs/dbraw/zinc/30/26/86/466302686.db2.gz IECDFAOUCBJKFO-GFCCVEGCSA-N 1 1 333.388 2.350 20 5 EEBDMO NC(=O)[C@@H]1Cc2ccccc2C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000373021431 466667089 /nfs/dbraw/zinc/66/70/89/466667089.db2.gz FUWOVEWDKYIDIE-KRWDZBQOSA-N 1 1 325.368 2.050 20 5 EEBDMO NC(=O)[C@@H]1Cc2ccccc2C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000373021431 466667091 /nfs/dbraw/zinc/66/70/91/466667091.db2.gz FUWOVEWDKYIDIE-KRWDZBQOSA-N 1 1 325.368 2.050 20 5 EEBDMO Cn1ccnc1[C@@H](NCC1(C)CC[NH2+]CC1)c1ccc([N+](=O)[O-])cc1 ZINC000423340218 466722999 /nfs/dbraw/zinc/72/29/99/466722999.db2.gz VNTSTBWCWXZEFB-INIZCTEOSA-N 1 1 343.431 2.397 20 5 EEBDMO C[C@H](CO)[N@H+]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432172105 467221359 /nfs/dbraw/zinc/22/13/59/467221359.db2.gz KBYGJZVLOAIXIJ-CYBMUJFWSA-N 1 1 330.388 2.036 20 5 EEBDMO C[C@@H](c1ccccc1)[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])C(N)=O ZINC000428862887 467277410 /nfs/dbraw/zinc/27/74/10/467277410.db2.gz WIDMXHZXLFQBSW-ZBEGNZNMSA-N 1 1 331.347 2.481 20 5 EEBDMO Cc1cc(F)ccc1[C@H]1CCC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000451976549 467292909 /nfs/dbraw/zinc/29/29/09/467292909.db2.gz YORXCMMQYZHUNR-NVXWUHKLSA-N 1 1 348.378 2.437 20 5 EEBDMO C[N@@H+](CCCNC(=O)C1CCC1)CCOc1ccccc1[N+](=O)[O-] ZINC000429549416 467345397 /nfs/dbraw/zinc/34/53/97/467345397.db2.gz TVHQWTIRLHUSQY-UHFFFAOYSA-N 1 1 335.404 2.212 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])C[C@@H]21 ZINC000452969400 467448684 /nfs/dbraw/zinc/44/86/84/467448684.db2.gz DKTXFVGOMQEHHV-RNCFNFMXSA-N 1 1 343.305 2.390 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)C[C@@H]1C ZINC000430785030 467466650 /nfs/dbraw/zinc/46/66/50/467466650.db2.gz SNFOSYDQZICHIU-UONOGXRCSA-N 1 1 335.404 2.223 20 5 EEBDMO C[C@@H]1CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@@H]1[NH3+] ZINC000430934333 467478013 /nfs/dbraw/zinc/47/80/13/467478013.db2.gz LRRAYKMWXZFNQZ-DOMZBBRYSA-N 1 1 330.388 2.461 20 5 EEBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1C[C@@H](C)[N@@H+](CCO)[C@@H](C)C1 ZINC000449530018 467659148 /nfs/dbraw/zinc/65/91/48/467659148.db2.gz BNSIRENDRRUNNB-ODEWBEPCSA-N 1 1 333.432 2.385 20 5 EEBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@@H](C)N(CCO)[C@@H](C)C1 ZINC000449530018 467659151 /nfs/dbraw/zinc/65/91/51/467659151.db2.gz BNSIRENDRRUNNB-ODEWBEPCSA-N 1 1 333.432 2.385 20 5 EEBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H](C)N(CCO)[C@@H](C)C1 ZINC000449530018 467659155 /nfs/dbraw/zinc/65/91/55/467659155.db2.gz BNSIRENDRRUNNB-ODEWBEPCSA-N 1 1 333.432 2.385 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1 ZINC000455363883 467670728 /nfs/dbraw/zinc/67/07/28/467670728.db2.gz UNFLTZWWGDYMDE-SMDDNHRTSA-N 1 1 334.376 2.161 20 5 EEBDMO CN(C)C(=O)N[C@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000449744084 467704836 /nfs/dbraw/zinc/70/48/36/467704836.db2.gz DSAYFJJJYACXAB-PXTSUWAFSA-N 1 1 332.404 2.344 20 5 EEBDMO CN(C)C(=O)N[C@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000449744084 467704839 /nfs/dbraw/zinc/70/48/39/467704839.db2.gz DSAYFJJJYACXAB-PXTSUWAFSA-N 1 1 332.404 2.344 20 5 EEBDMO CCOC(=O)c1ccnc(N2CC[N@H+](C3CC3)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000450547609 467868776 /nfs/dbraw/zinc/86/87/76/467868776.db2.gz ODPRQZBTASNWLJ-GFCCVEGCSA-N 1 1 348.403 2.087 20 5 EEBDMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCc1c[nH+]c2n1CCCC2 ZINC000493837172 467993730 /nfs/dbraw/zinc/99/37/30/467993730.db2.gz OJHBMHOBNJMHOZ-TWGQIWQCSA-N 1 1 326.356 2.457 20 5 EEBDMO COCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCC[C@@H]1C ZINC000488036518 468068469 /nfs/dbraw/zinc/06/84/69/468068469.db2.gz RPBNPIIPGMOKHK-SWLSCSKDSA-N 1 1 335.404 2.331 20 5 EEBDMO O=C(CCN[C@@H]1CC[N@H+]2CCCC[C@H]12)Nc1ccccc1[N+](=O)[O-] ZINC000517732883 468094717 /nfs/dbraw/zinc/09/47/17/468094717.db2.gz RDQHWOAOPBLSJI-UKRRQHHQSA-N 1 1 332.404 2.140 20 5 EEBDMO O=C(CC[NH2+][C@@H]1CCN2CCCC[C@H]12)Nc1ccccc1[N+](=O)[O-] ZINC000517732883 468094724 /nfs/dbraw/zinc/09/47/24/468094724.db2.gz RDQHWOAOPBLSJI-UKRRQHHQSA-N 1 1 332.404 2.140 20 5 EEBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000532138094 468099808 /nfs/dbraw/zinc/09/98/08/468099808.db2.gz KMQWWWXDKQFEJY-CQSZACIVSA-N 1 1 340.383 2.336 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000532138094 468099811 /nfs/dbraw/zinc/09/98/11/468099811.db2.gz KMQWWWXDKQFEJY-CQSZACIVSA-N 1 1 340.383 2.336 20 5 EEBDMO O=C(NCc1ccccc1[N+](=O)[O-])N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594215683 468515357 /nfs/dbraw/zinc/51/53/57/468515357.db2.gz STXBCCJLUGEHTL-GOEBONIOSA-N 1 1 332.404 2.411 20 5 EEBDMO COc1cc(C[NH2+][C@H]2c3ccccc3C[C@@H]2O)c([N+](=O)[O-])cc1O ZINC000594518878 468614345 /nfs/dbraw/zinc/61/43/45/468614345.db2.gz QBWXRKSEQDKFDY-RDJZCZTQSA-N 1 1 330.340 2.057 20 5 EEBDMO COC(=O)c1cnc(N[C@H]2CCC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1 ZINC000594599330 468631834 /nfs/dbraw/zinc/63/18/34/468631834.db2.gz JELZCMQHSRAJCT-QWHCGFSZSA-N 1 1 334.376 2.205 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]C[C@@H](CO)CC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000595088516 468756152 /nfs/dbraw/zinc/75/61/52/468756152.db2.gz IYRFQSJGCSZMBV-WMLDXEAASA-N 1 1 344.415 2.416 20 5 EEBDMO CC(C)(C)N1CC[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1=O ZINC000601182277 468773425 /nfs/dbraw/zinc/77/34/25/468773425.db2.gz SEILMAMAEZFPKG-HNNXBMFYSA-N 1 1 328.372 2.376 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1c1nc(C)cc(C(=O)OC)c1[N+](=O)[O-] ZINC000601188214 468775409 /nfs/dbraw/zinc/77/54/09/468775409.db2.gz DPOFIUHCIBCZNU-GFCCVEGCSA-N 1 1 336.392 2.005 20 5 EEBDMO Cc1noc(C[N@@H+]2CC[C@@](CO)(Cc3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000595492052 468875205 /nfs/dbraw/zinc/87/52/05/468875205.db2.gz ZSHRWFRYZJPPLU-QGZVFWFLSA-N 1 1 349.362 2.457 20 5 EEBDMO Cc1noc(C[N@H+]2CC[C@@](CO)(Cc3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000595492052 468875208 /nfs/dbraw/zinc/87/52/08/468875208.db2.gz ZSHRWFRYZJPPLU-QGZVFWFLSA-N 1 1 349.362 2.457 20 5 EEBDMO CC[N@H+]1CCCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000595536701 468891816 /nfs/dbraw/zinc/89/18/16/468891816.db2.gz SYDSLAYZOCWDRK-CQSZACIVSA-N 1 1 334.420 2.258 20 5 EEBDMO COC(=O)c1ccnc(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-] ZINC000598642006 468942404 /nfs/dbraw/zinc/94/24/04/468942404.db2.gz QIQXZBROFPXSPY-ZDUSSCGKSA-N 1 1 348.403 2.310 20 5 EEBDMO CC1(C)C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1ccccc1 ZINC000610505866 468989620 /nfs/dbraw/zinc/98/96/20/468989620.db2.gz ZNXMJTLKOYXONA-CVEARBPZSA-N 1 1 330.388 2.235 20 5 EEBDMO C[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1csnn1 ZINC000602695026 469017038 /nfs/dbraw/zinc/01/70/38/469017038.db2.gz VKMUSLSHIPJPFT-JTQLQIEISA-N 1 1 334.405 2.161 20 5 EEBDMO C[N@@H+](CCOC(C)(C)C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000610859873 469093801 /nfs/dbraw/zinc/09/38/01/469093801.db2.gz 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ZINC000332488981 312015174 /nfs/dbraw/zinc/01/51/74/312015174.db2.gz ODHCXERDXVXJES-ZBFHGGJFSA-N 1 1 346.431 2.400 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccn(CC)c1=O ZINC000433173907 314749708 /nfs/dbraw/zinc/74/97/08/314749708.db2.gz JHPBYRIOWGQYTJ-UHFFFAOYSA-N 1 1 331.372 2.465 20 5 EEBDMO COCC[N@@H+](C)CC[C@H](Nc1c([N+](=O)[O-])ncn1C)c1ccccc1 ZINC000505569653 316363412 /nfs/dbraw/zinc/36/34/12/316363412.db2.gz ACFZXBMXCRXSTR-HNNXBMFYSA-N 1 1 347.419 2.450 20 5 EEBDMO CCn1nc(C)c(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1C ZINC000534336811 317942645 /nfs/dbraw/zinc/94/26/45/317942645.db2.gz DMIKHBWKXRHHPG-UHFFFAOYSA-N 1 1 344.419 2.145 20 5 EEBDMO C[C@H]1CC[N@H+](CCNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000540802097 318078505 /nfs/dbraw/zinc/07/85/05/318078505.db2.gz DYFIUGCUMJXWNH-AWEZNQCLSA-N 1 1 343.431 2.427 20 5 EEBDMO C[C@H]1CC[N@@H+](CCNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000540802097 318078507 /nfs/dbraw/zinc/07/85/07/318078507.db2.gz 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ZINC000052192647 463068439 /nfs/dbraw/zinc/06/84/39/463068439.db2.gz WBRVBIWCGFTEJY-NSHDSACASA-N 1 1 334.401 2.397 20 5 EEBDMO CNC(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000069631695 463292679 /nfs/dbraw/zinc/29/26/79/463292679.db2.gz WJZJDIJLMSOLAD-UHFFFAOYSA-N 1 1 335.404 2.340 20 5 EEBDMO COCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000144588937 463377437 /nfs/dbraw/zinc/37/74/37/463377437.db2.gz DLTVDAFOWFKLTH-ZBFHGGJFSA-N 1 1 349.431 2.000 20 5 EEBDMO Cc1ccc(S(=O)(=O)NCC[N@H+](C)C2CCCC2)cc1[N+](=O)[O-] ZINC000104755751 463421353 /nfs/dbraw/zinc/42/13/53/463421353.db2.gz ZJTRSHUYXRABDB-UHFFFAOYSA-N 1 1 341.433 2.056 20 5 EEBDMO CC[C@@H](C[NH+]1CCCC1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000072289212 463499973 /nfs/dbraw/zinc/49/99/73/463499973.db2.gz QHEDSQFLCWBXHE-LBPRGKRZSA-N 1 1 341.433 2.285 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1 ZINC000073900278 463668630 /nfs/dbraw/zinc/66/86/30/463668630.db2.gz WLUFVXRJNUOHMZ-HNNXBMFYSA-N 1 1 334.420 2.468 20 5 EEBDMO COC(=O)[C@]1(C)CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000177449574 463707468 /nfs/dbraw/zinc/70/74/68/463707468.db2.gz KNVVRAUNMFGACQ-QGZVFWFLSA-N 1 1 349.387 2.117 20 5 EEBDMO CN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000287329594 463871175 /nfs/dbraw/zinc/87/11/75/463871175.db2.gz WWWGUOJZDGMGLU-SJPCQFCGSA-N 1 1 346.431 2.404 20 5 EEBDMO Cc1n[nH]c(C(=O)N2CC[NH2+]C[C@@H]2c2ccccc2Cl)c1[N+](=O)[O-] ZINC000261902558 463894121 /nfs/dbraw/zinc/89/41/21/463894121.db2.gz GSOABGJMRKKVFW-GFCCVEGCSA-N 1 1 349.778 2.066 20 5 EEBDMO Cc1[nH]nc(C(=O)N2CC[NH2+]C[C@@H]2c2ccccc2Cl)c1[N+](=O)[O-] ZINC000261902558 463894123 /nfs/dbraw/zinc/89/41/23/463894123.db2.gz GSOABGJMRKKVFW-GFCCVEGCSA-N 1 1 349.778 2.066 20 5 EEBDMO CCOC(=O)CC[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000178559884 463920686 /nfs/dbraw/zinc/92/06/86/463920686.db2.gz QNCPBOSDEQJZNY-UHFFFAOYSA-N 1 1 334.332 2.030 20 5 EEBDMO CCOC(=O)CC[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000178559884 463920693 /nfs/dbraw/zinc/92/06/93/463920693.db2.gz QNCPBOSDEQJZNY-UHFFFAOYSA-N 1 1 334.332 2.030 20 5 EEBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000279270216 464085469 /nfs/dbraw/zinc/08/54/69/464085469.db2.gz JCBIIQIJRYWLGS-CHWSQXEVSA-N 1 1 333.388 2.350 20 5 EEBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000269785284 464093661 /nfs/dbraw/zinc/09/36/61/464093661.db2.gz HQYIJHIGSYTLRZ-AAEUAGOBSA-N 1 1 332.360 2.380 20 5 EEBDMO CCOc1ccc(NC(=O)C[N@H+](C)C(C)(C)COC)c([N+](=O)[O-])c1 ZINC000292285175 464184201 /nfs/dbraw/zinc/18/42/01/464184201.db2.gz LUNUYKPEBDMCBN-UHFFFAOYSA-N 1 1 339.392 2.289 20 5 EEBDMO CCOc1ccc(NC(=O)C[N@@H+](C)C(C)(C)COC)c([N+](=O)[O-])c1 ZINC000292285175 464184204 /nfs/dbraw/zinc/18/42/04/464184204.db2.gz LUNUYKPEBDMCBN-UHFFFAOYSA-N 1 1 339.392 2.289 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@@H]1CCC[C@H]1O ZINC000270117189 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330.384 2.431 20 5 EEBDMO COC[C@@H](CCO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000265821661 464699485 /nfs/dbraw/zinc/69/94/85/464699485.db2.gz XYPJXGLSGFYKGX-GFCCVEGCSA-N 1 1 337.401 2.205 20 5 EEBDMO CC(C)(C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000265851461 464708822 /nfs/dbraw/zinc/70/88/22/464708822.db2.gz XOFZMIXCJHOAQV-ZDUSSCGKSA-N 1 1 331.416 2.473 20 5 EEBDMO COc1cc(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1F ZINC000295170207 464730496 /nfs/dbraw/zinc/73/04/96/464730496.db2.gz RPPITLUZRLEWNY-ZJUUUORDSA-N 1 1 337.351 2.098 20 5 EEBDMO C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1 ZINC000295237493 464756992 /nfs/dbraw/zinc/75/69/92/464756992.db2.gz CMJCBIROQXAWBE-LLVKDONJSA-N 1 1 348.359 2.059 20 5 EEBDMO COCC[N@H+](Cc1cccnc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000191237427 464804537 /nfs/dbraw/zinc/80/45/37/464804537.db2.gz MCDDNWJJLLCWSG-KRWDZBQOSA-N 1 1 331.372 2.172 20 5 EEBDMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000248876284 464813203 /nfs/dbraw/zinc/81/32/03/464813203.db2.gz QUWICSMAZFSXCI-OLZOCXBDSA-N 1 1 333.388 2.302 20 5 EEBDMO Cc1cc(N2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)ncc1[N+](=O)[O-] ZINC000266860170 464849660 /nfs/dbraw/zinc/84/96/60/464849660.db2.gz WJFGXFBFKBZBHW-IYBDPMFKSA-N 1 1 347.463 2.293 20 5 EEBDMO C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc2ncccc2c1[N+](=O)[O-] ZINC000286324804 464880467 /nfs/dbraw/zinc/88/04/67/464880467.db2.gz LBPPEUYFOSCRIN-UONOGXRCSA-N 1 1 342.399 2.442 20 5 EEBDMO O=C(NCC1CC1)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000276331421 464892376 /nfs/dbraw/zinc/89/23/76/464892376.db2.gz RBBMLDWTHPCYJF-AWEZNQCLSA-N 1 1 335.379 2.472 20 5 EEBDMO Nc1c(C(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000176950605 464892772 /nfs/dbraw/zinc/89/27/72/464892772.db2.gz JHQLOMDRZPERFF-ZDUSSCGKSA-N 1 1 332.404 2.171 20 5 EEBDMO CN1CCN(CCC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192618935 464958535 /nfs/dbraw/zinc/95/85/35/464958535.db2.gz PIIDOKAEOFYFOA-GOSISDBHSA-N 1 1 332.448 2.199 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000286627702 464984773 /nfs/dbraw/zinc/98/47/73/464984773.db2.gz NABUGQTYNGUHEU-UHFFFAOYSA-N 1 1 345.403 2.374 20 5 EEBDMO CCC[N@@H+](CCc1cccs1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000184508219 464986426 /nfs/dbraw/zinc/98/64/26/464986426.db2.gz ODDCEAOMABVMKS-CQSZACIVSA-N 1 1 338.433 2.168 20 5 EEBDMO Cc1ccccc1C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 ZINC000298855138 465524732 /nfs/dbraw/zinc/52/47/32/465524732.db2.gz DWUMYJFXLOAFNW-UHFFFAOYSA-N 1 1 328.372 2.189 20 5 EEBDMO C[N@H+]1CCC[C@@H]1CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000299225282 465653351 /nfs/dbraw/zinc/65/33/51/465653351.db2.gz ABCUTTGYUXFSNL-SNVBAGLBSA-N 1 1 344.318 2.412 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c1 ZINC000299241492 465661755 /nfs/dbraw/zinc/66/17/55/465661755.db2.gz XDBBIMOHHFUBLB-OLZOCXBDSA-N 1 1 335.404 2.454 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000356975625 465671868 /nfs/dbraw/zinc/67/18/68/465671868.db2.gz BHZMMZDPADIIAZ-GHMZBOCLSA-N 1 1 340.811 2.211 20 5 EEBDMO Cc1c(NC(=O)CCN2CC[N@H+](C)[C@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000356980241 465675446 /nfs/dbraw/zinc/67/54/46/465675446.db2.gz OTWVWEMDIPWESO-ZIAGYGMSSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCN(C)[C@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000356980241 465675453 /nfs/dbraw/zinc/67/54/53/465675453.db2.gz OTWVWEMDIPWESO-ZIAGYGMSSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCN(C)[C@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000356980241 465675459 /nfs/dbraw/zinc/67/54/59/465675459.db2.gz OTWVWEMDIPWESO-ZIAGYGMSSA-N 1 1 334.420 2.256 20 5 EEBDMO C[N@H+]1CCCC[C@H]1CCn1cc(Br)cc([N+](=O)[O-])c1=O ZINC000330501715 465683240 /nfs/dbraw/zinc/68/32/40/465683240.db2.gz AVBXTSJWYMJGAH-NSHDSACASA-N 1 1 344.209 2.393 20 5 EEBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000361047247 465727736 /nfs/dbraw/zinc/72/77/36/465727736.db2.gz WUJOXBNVLCJSCK-ZDUSSCGKSA-N 1 1 332.408 2.312 20 5 EEBDMO CC(C)C[N@H+]1CC[C@H](CNc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000362559372 465830355 /nfs/dbraw/zinc/83/03/55/465830355.db2.gz DKUGZSDPIPIVIR-CYBMUJFWSA-N 1 1 345.403 3.035 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C)CCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000331012429 465896290 /nfs/dbraw/zinc/89/62/90/465896290.db2.gz WITUFMZAWQKUPA-OAHLLOKOSA-N 1 1 345.403 2.417 20 5 EEBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000301114813 465905551 /nfs/dbraw/zinc/90/55/51/465905551.db2.gz PDMKUSHVMJWOIS-STQMWFEESA-N 1 1 334.420 2.487 20 5 EEBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)CC[C@H]1CCCC[N@H+]1C ZINC000301456620 465966810 /nfs/dbraw/zinc/96/68/10/465966810.db2.gz MYVOIOHQRAYHHE-CYBMUJFWSA-N 1 1 334.420 2.265 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000548747532 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O=C(/C=C\C1CC1)N1C[C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001048734827 1238467158 /nfs/dbraw/zinc/46/71/58/1238467158.db2.gz XQWLKGYXKFSHDD-UGZFAFSNSA-N 1 1 341.411 2.451 20 5 EEBDMO CC1(C(=O)N2C[C@@H]3C[N@@H+](Cc4csc([N+](=O)[O-])c4)C[C@@H]3C2)CC1 ZINC001048831720 1238791295 /nfs/dbraw/zinc/79/12/95/1238791295.db2.gz BDNXSWGAEYSPFV-BETUJISGSA-N 1 1 335.429 2.347 20 5 EEBDMO CC1(C(=O)N2C[C@@H]3C[N@H+](Cc4csc([N+](=O)[O-])c4)C[C@@H]3C2)CC1 ZINC001048831720 1238791364 /nfs/dbraw/zinc/79/13/64/1238791364.db2.gz BDNXSWGAEYSPFV-BETUJISGSA-N 1 1 335.429 2.347 20 5 EEBDMO C[N@@H+](CC(=O)N1CCC(Nc2ccc([N+](=O)[O-])cc2)CC1)C1CCC1 ZINC001057446321 1243801622 /nfs/dbraw/zinc/80/16/22/1243801622.db2.gz KTHGQKPCKFQFQF-UHFFFAOYSA-N 1 1 346.431 2.482 20 5 EEBDMO CC(C)C[NH2+]CC(C)(C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001101541549 1245944829 /nfs/dbraw/zinc/94/48/29/1245944829.db2.gz KOSCLVZSCKGVOU-HUUCEWRRSA-N 1 1 325.453 2.162 20 5 EEBDMO 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O=[N+]([O-])c1ccc2c(c1)ncnc2N[C@H]1CCC[C@@H]1[NH+]1CCOCC1 ZINC001160725385 1320249308 /nfs/dbraw/zinc/24/93/08/1320249308.db2.gz ULDOHHAUMJOSMU-HOCLYGCPSA-N 1 1 343.387 2.203 20 5 EEBDMO C[NH+](C)/C=C/c1cc(NCC2(c3cnccn3)CC2)ncc1[N+](=O)[O-] ZINC001161625840 1320563149 /nfs/dbraw/zinc/56/31/49/1320563149.db2.gz GKZZORTUXZJUJF-FPYGCLRLSA-N 1 1 340.387 2.456 20 5 EEBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1cc([N+](=O)[O-])c3cc[nH]c3n1)CC2 ZINC001166035290 1321640323 /nfs/dbraw/zinc/64/03/23/1321640323.db2.gz XGEKBWKAONGAEE-UHFFFAOYSA-N 1 1 344.375 2.106 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](C(=O)NC2CC2)C1 ZINC001319946712 1332800528 /nfs/dbraw/zinc/80/05/28/1332800528.db2.gz FBRYQZXXQXEELJ-CYBMUJFWSA-N 1 1 347.415 2.484 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])c(-c2nn[nH]n2)c1 ZINC001609227041 1351901669 /nfs/dbraw/zinc/90/16/69/1351901669.db2.gz AMZVCNVDHCHFPD-LBPRGKRZSA-N 1 1 331.380 2.061 20 5 EEBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[N@H+]1CCC[C@@H](C)C1 ZINC001590259682 1349235273 /nfs/dbraw/zinc/23/52/73/1349235273.db2.gz LWXMNDAFVBQVST-VXGBXAGGSA-N 1 1 345.407 2.307 20 5 EEBDMO O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC001593471997 1349807248 /nfs/dbraw/zinc/80/72/48/1349807248.db2.gz XIJGWTKVRBOFGU-ZDUSSCGKSA-N 1 1 343.391 2.204 20 5 EEBDMO CC1(C)C[NH2+][C@@H]1C1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 ZINC001576469360 1403575486 /nfs/dbraw/zinc/57/54/86/1403575486.db2.gz MDJJZODIFJHMQF-OAHLLOKOSA-N 1 1 333.388 2.151 20 5 EEBDMO Cc1cc([N+](=O)[O-])cnc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164782871 721390333 /nfs/dbraw/zinc/39/03/33/721390333.db2.gz GLCDMCOBSZBMMN-STQMWFEESA-N 1 1 345.428 2.323 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)cnc1N1CC[NH+](CCc2ccccn2)CC1 ZINC001165054557 722008521 /nfs/dbraw/zinc/00/85/21/722008521.db2.gz QSSGEPASLDNDHE-UHFFFAOYSA-N 1 1 347.806 2.403 20 5 EEBDMO CCN(CCNC(=O)C[N@@H+](C)C(C)C)c1ccc([N+](=O)[O-])cc1F ZINC001100546913 760001220 /nfs/dbraw/zinc/00/12/20/760001220.db2.gz XVOLWUQNODAMPJ-UHFFFAOYSA-N 1 1 340.399 2.017 20 5 EEBDMO CC[N@H+](CCc1ccccn1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000920256434 770639946 /nfs/dbraw/zinc/63/99/46/770639946.db2.gz GNBLBYXLTDOMIL-UHFFFAOYSA-N 1 1 328.372 2.493 20 5 EEBDMO CC[N@@H+](CCc1ccccn1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000920256434 770639951 /nfs/dbraw/zinc/63/99/51/770639951.db2.gz GNBLBYXLTDOMIL-UHFFFAOYSA-N 1 1 328.372 2.493 20 5 EEBDMO Cc1noc([C@H]2CCC[N@H+](Cn3ncc4cc([N+](=O)[O-])ccc43)C2)n1 ZINC000921049332 770949738 /nfs/dbraw/zinc/94/97/38/770949738.db2.gz SHYLUZQKCHBERW-LBPRGKRZSA-N 1 1 342.359 2.473 20 5 EEBDMO Cc1noc([C@H]2CCC[N@@H+](Cn3ncc4cc([N+](=O)[O-])ccc43)C2)n1 ZINC000921049332 770949744 /nfs/dbraw/zinc/94/97/44/770949744.db2.gz SHYLUZQKCHBERW-LBPRGKRZSA-N 1 1 342.359 2.473 20 5 EEBDMO C[C@@H](NC(=O)N[C@@H]1C[N@H+](C2CC2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000921434973 773370420 /nfs/dbraw/zinc/37/04/20/773370420.db2.gz SAWINLYTUKPPDE-HWWQOWPSSA-N 1 1 332.404 2.438 20 5 EEBDMO CCCc1ccc(C[N@H+]2CCCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC000981136844 776582069 /nfs/dbraw/zinc/58/20/69/776582069.db2.gz IPYUMDATPUJCRF-QZTJIDSGSA-N 1 1 345.443 2.339 20 5 EEBDMO CCCc1ccc(C[N@@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000981136844 776582077 /nfs/dbraw/zinc/58/20/77/776582077.db2.gz IPYUMDATPUJCRF-QZTJIDSGSA-N 1 1 345.443 2.339 20 5 EEBDMO CCCc1ccc(C[N@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000981136844 776582086 /nfs/dbraw/zinc/58/20/86/776582086.db2.gz IPYUMDATPUJCRF-QZTJIDSGSA-N 1 1 345.443 2.339 20 5 EEBDMO COC(=O)[C@]12C[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C[C@H]1CCCC2 ZINC000847016793 790835407 /nfs/dbraw/zinc/83/54/07/790835407.db2.gz FUGWXPBHWIRAPA-QGPMSJSTSA-N 1 1 348.399 2.293 20 5 EEBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC000906711818 784094172 /nfs/dbraw/zinc/09/41/72/784094172.db2.gz SGZPRSXELGCFCF-JTQLQIEISA-N 1 1 340.811 2.244 20 5 EEBDMO CCc1ccc(C[NH2+]CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000997773524 791046956 /nfs/dbraw/zinc/04/69/56/791046956.db2.gz VYBTYOUZSMSRMI-QZTJIDSGSA-N 1 1 345.443 2.242 20 5 EEBDMO C[N@H+]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC12CCCCC2 ZINC000908573905 785539557 /nfs/dbraw/zinc/53/95/57/785539557.db2.gz VNBKELFOHZVNAY-UHFFFAOYSA-N 1 1 332.404 2.268 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NC/C=C\CNc1ccc([N+](=O)[O-])c(C)n1 ZINC001107391984 787105699 /nfs/dbraw/zinc/10/56/99/787105699.db2.gz QVLNWFIHFANPNW-FPLPWBNLSA-N 1 1 349.435 2.113 20 5 EEBDMO O=[N+]([O-])c1ccc(CNC[C@@H]2CCC[N@H+]2CCCO)cc1Cl ZINC000824565479 788216824 /nfs/dbraw/zinc/21/68/24/788216824.db2.gz WTRAXPUDLCNBGV-ZDUSSCGKSA-N 1 1 327.812 2.185 20 5 EEBDMO O=[N+]([O-])c1ccc(CNC[C@@H]2CCC[N@@H+]2CCCO)cc1Cl ZINC000824565479 788216831 /nfs/dbraw/zinc/21/68/31/788216831.db2.gz WTRAXPUDLCNBGV-ZDUSSCGKSA-N 1 1 327.812 2.185 20 5 EEBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000923292905 789324187 /nfs/dbraw/zinc/32/41/87/789324187.db2.gz ZROVCTAPQOWTQI-GXTWGEPZSA-N 1 1 337.807 2.486 20 5 EEBDMO [NH3+]CCCN(Cc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000923344725 789421473 /nfs/dbraw/zinc/42/14/73/789421473.db2.gz HZOFTQHVTDBKKF-SFHVURJKSA-N 1 1 329.400 2.479 20 5 EEBDMO CC(C)[C@H](C)[N@@H+](C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000915208569 795736746 /nfs/dbraw/zinc/73/67/46/795736746.db2.gz GKWPEMZBJXNZDT-SJCJKPOMSA-N 1 1 348.403 2.296 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCc3c(ncn3C)C2)c1F ZINC001173196970 797283354 /nfs/dbraw/zinc/28/33/54/797283354.db2.gz RBBQNGFXUMIILT-NSHDSACASA-N 1 1 348.378 2.465 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCc3c(ncn3C)C2)c1F ZINC001173196970 797283358 /nfs/dbraw/zinc/28/33/58/797283358.db2.gz RBBQNGFXUMIILT-NSHDSACASA-N 1 1 348.378 2.465 20 5 EEBDMO Cc1ncn(-c2ccc3[nH]cnc3c2[N+](=O)[O-])c1CSCC[NH3+] ZINC001168790860 803340810 /nfs/dbraw/zinc/34/08/10/803340810.db2.gz XABVAWSGXKTRIV-UHFFFAOYSA-N 1 1 332.389 2.157 20 5 EEBDMO CC(C)[C@H](C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000787960112 807315621 /nfs/dbraw/zinc/31/56/21/807315621.db2.gz HDSFOPQECGKFRE-SMDDNHRTSA-N 1 1 337.376 2.051 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@H+]2CCc3c(cnn3C)C2)c([N+](=O)[O-])c1 ZINC001170355217 809902829 /nfs/dbraw/zinc/90/28/29/809902829.db2.gz XTJZLEJMHSSQRF-GFCCVEGCSA-N 1 1 330.388 2.326 20 5 EEBDMO Cc1c(CC[NH3+])c(=O)[nH]n1-c1nccc2c1ccc(C)c2[N+](=O)[O-] ZINC001170339516 809912979 /nfs/dbraw/zinc/91/29/79/809912979.db2.gz CKVJYWJUKPOJLC-UHFFFAOYSA-N 1 1 327.344 2.152 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)NNc1ccc([N+](=O)[O-])cc1C ZINC000806589077 811943027 /nfs/dbraw/zinc/94/30/27/811943027.db2.gz BFKZNIOYFLNENC-CYBMUJFWSA-N 1 1 337.449 2.179 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(c2nnc([C@H](C)[N+](=O)[O-])n2CC(C)C)C[C@H]1C ZINC001517388993 1119032680 /nfs/dbraw/zinc/03/26/80/1119032680.db2.gz CFENIANFRDCTPB-RDBSUJKOSA-N 1 1 338.456 2.191 20 5 EEBDMO Cc1cc(CN2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)no1 ZINC000051903140 214108471 /nfs/dbraw/zinc/10/84/71/214108471.db2.gz YRSHBEWVZZVDCL-UHFFFAOYSA-N 1 1 330.388 2.252 20 5 EEBDMO CN1CCN(CCC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000162489409 529771685 /nfs/dbraw/zinc/77/16/85/529771685.db2.gz ZOZOHEIJXZZXFZ-SFHVURJKSA-N 1 1 346.475 2.143 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)CCOc3ccccc3[N+](=O)[O-])CC[C@@H]21 ZINC000155052254 530058183 /nfs/dbraw/zinc/05/81/83/530058183.db2.gz ZARRWDMQFQEXIC-CABCVRRESA-N 1 1 347.415 2.306 20 5 EEBDMO Cc1c(NC(=O)N[C@@H](C)CCN2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000183940753 235266564 /nfs/dbraw/zinc/26/65/64/235266564.db2.gz VQPHNMBABQJZCX-ZDUSSCGKSA-N 1 1 349.435 2.051 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](CC(C)(C)O)[C@H](C)C1 ZINC000421875468 240040171 /nfs/dbraw/zinc/04/01/71/240040171.db2.gz QAXFZXFUJCMJCE-CQSZACIVSA-N 1 1 349.431 2.129 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000426888672 241354394 /nfs/dbraw/zinc/35/43/94/241354394.db2.gz IZEKJVCLQPNHLN-QWHCGFSZSA-N 1 1 335.404 2.454 20 5 EEBDMO C[C@@]1(C(N)=O)CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000235437697 242283483 /nfs/dbraw/zinc/28/34/83/242283483.db2.gz AYSYPUYRTKTNEL-CYBMUJFWSA-N 1 1 342.193 2.055 20 5 EEBDMO C[C@@]1(C(N)=O)CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000235437697 242283488 /nfs/dbraw/zinc/28/34/88/242283488.db2.gz AYSYPUYRTKTNEL-CYBMUJFWSA-N 1 1 342.193 2.055 20 5 EEBDMO C[C@@H]1[C@H](Nc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])CCC[N@H+]1C ZINC000447803872 242317670 /nfs/dbraw/zinc/31/76/70/242317670.db2.gz CGYJVQSENZEGOF-GDBMZVCRSA-N 1 1 348.447 2.322 20 5 EEBDMO CC[C@@]1(CO)CCC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000249586168 243700852 /nfs/dbraw/zinc/70/08/52/243700852.db2.gz TVGXGQWUWAQNHF-FUHWJXTLSA-N 1 1 347.415 2.185 20 5 EEBDMO CC[C@@]1(CO)CCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000249586168 243700858 /nfs/dbraw/zinc/70/08/58/243700858.db2.gz TVGXGQWUWAQNHF-FUHWJXTLSA-N 1 1 347.415 2.185 20 5 EEBDMO COCC[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000347931399 285138934 /nfs/dbraw/zinc/13/89/34/285138934.db2.gz LSXUOJLUFUPNKD-CYBMUJFWSA-N 1 1 333.344 2.154 20 5 EEBDMO C[C@H]1CCC[C@H](CO)[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000270515004 256143123 /nfs/dbraw/zinc/14/31/23/256143123.db2.gz SDVZCJJEPSNVIA-SMDDNHRTSA-N 1 1 332.360 2.380 20 5 EEBDMO C[C@H]1CCC[C@H](CO)[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000270515004 256143124 /nfs/dbraw/zinc/14/31/24/256143124.db2.gz SDVZCJJEPSNVIA-SMDDNHRTSA-N 1 1 332.360 2.380 20 5 EEBDMO Cc1ccc(C[N@H+](C)C[C@@H](O)COCCOC(C)C)cc1[N+](=O)[O-] ZINC000271124092 256210471 /nfs/dbraw/zinc/21/04/71/256210471.db2.gz GHKQSNRKMMNIGB-MRXNPFEDSA-N 1 1 340.420 2.138 20 5 EEBDMO CCCc1[nH]nc(C(=O)N(CC)CCC[NH+](CC)CC)c1[N+](=O)[O-] ZINC000276496479 256438535 /nfs/dbraw/zinc/43/85/35/256438535.db2.gz TYSSCRSARHGXKM-UHFFFAOYSA-N 1 1 339.440 2.464 20 5 EEBDMO COc1cccc(C(=O)N(C)CCCn2cc[nH+]c2C)c1[N+](=O)[O-] ZINC000192808934 533393038 /nfs/dbraw/zinc/39/30/38/533393038.db2.gz VWYJQTBYISXWFW-UHFFFAOYSA-N 1 1 332.360 2.271 20 5 EEBDMO COC(=O)CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000114476228 140761784 /nfs/dbraw/zinc/76/17/84/140761784.db2.gz WZYFYQDLDDVIIH-UHFFFAOYSA-N 1 1 337.376 2.115 20 5 EEBDMO C[N@H+]1CCC[C@@H](CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC000087136931 292206122 /nfs/dbraw/zinc/20/61/22/292206122.db2.gz AMBHQOHVZYPBAB-ZDUSSCGKSA-N 1 1 332.404 2.004 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])cc1OC ZINC000377236725 154099265 /nfs/dbraw/zinc/09/92/65/154099265.db2.gz GHJGLRAQMLNAJI-QWHCGFSZSA-N 1 1 336.388 2.470 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)C1 ZINC000081362000 159152134 /nfs/dbraw/zinc/15/21/34/159152134.db2.gz RTTJPKFWZFFQDX-CYBMUJFWSA-N 1 1 335.404 2.407 20 5 EEBDMO CNC(=O)[C@H](C)C[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000081527696 159154752 /nfs/dbraw/zinc/15/47/52/159154752.db2.gz UOKUTSQYUZNWKG-GFCCVEGCSA-N 1 1 346.387 2.106 20 5 EEBDMO COc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1O ZINC000093534399 159235861 /nfs/dbraw/zinc/23/58/61/159235861.db2.gz DMCDCAWKYFFUGM-ZDUSSCGKSA-N 1 1 344.371 2.390 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000246915024 160300993 /nfs/dbraw/zinc/30/09/93/160300993.db2.gz MTFYVIBNGJBYCB-CPUCHLNUSA-N 1 1 346.431 2.338 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000247328154 160320513 /nfs/dbraw/zinc/32/05/13/160320513.db2.gz WSHKYJMGWAPUTH-YCPHGPKFSA-N 1 1 346.431 2.338 20 5 EEBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000341690925 161005422 /nfs/dbraw/zinc/00/54/22/161005422.db2.gz WTVZKGNADPAZRU-XHSDSOJGSA-N 1 1 348.447 2.094 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](CC3CCCC3)C2)n1 ZINC000342295012 161054408 /nfs/dbraw/zinc/05/44/08/161054408.db2.gz PBWQWAPZRWWIOG-ZDUSSCGKSA-N 1 1 348.403 2.453 20 5 EEBDMO C[N@@H+](CCNc1cccc(C(N)=O)c1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000342792412 161091300 /nfs/dbraw/zinc/09/13/00/161091300.db2.gz WHOGYJQBPFBXRJ-UHFFFAOYSA-N 1 1 346.362 2.377 20 5 EEBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1CCc2ccccc2C1 ZINC000342808086 161092184 /nfs/dbraw/zinc/09/21/84/161092184.db2.gz KKYMYEQSMSWWEY-ZDUSSCGKSA-N 1 1 342.399 2.110 20 5 EEBDMO C[C@H]([NH2+]C1CCN(CCC(=O)N(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000343979593 161186205 /nfs/dbraw/zinc/18/62/05/161186205.db2.gz NVCMWMCIYOGBAQ-AWEZNQCLSA-N 1 1 348.447 2.188 20 5 EEBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H](C)CN1CCN(C)CC1 ZINC000344844876 161250466 /nfs/dbraw/zinc/25/04/66/161250466.db2.gz CSIWDLJHUICMMQ-QZFKAFNDSA-N 1 1 332.448 2.224 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000345371991 161296301 /nfs/dbraw/zinc/29/63/01/161296301.db2.gz CRDKLHSRISXKJK-HIFRSBDPSA-N 1 1 334.420 2.261 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000345542281 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20 5 EEBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000359018068 164038135 /nfs/dbraw/zinc/03/81/35/164038135.db2.gz KNIXUFUKWRAEJJ-CYBMUJFWSA-N 1 1 335.408 2.188 20 5 EEBDMO C[C@H]1C[C@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000360654124 164358847 /nfs/dbraw/zinc/35/88/47/164358847.db2.gz SNEKLJCIPLVMMW-GXSJLCMTSA-N 1 1 347.824 2.009 20 5 EEBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000365044691 165360190 /nfs/dbraw/zinc/36/01/90/165360190.db2.gz HWBPIYWRLNQQNN-QGZVFWFLSA-N 1 1 325.368 2.440 20 5 EEBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000365044691 165360192 /nfs/dbraw/zinc/36/01/92/165360192.db2.gz HWBPIYWRLNQQNN-QGZVFWFLSA-N 1 1 325.368 2.440 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@H]3CCO[C@@H]3C3CC3)n2)cc1 ZINC000368897299 166148771 /nfs/dbraw/zinc/14/87/71/166148771.db2.gz QTFDZSKSOKMKCN-DZGCQCFKSA-N 1 1 330.344 2.302 20 5 EEBDMO COC(=O)[C@H]1CCCCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000369112187 166191747 /nfs/dbraw/zinc/19/17/47/166191747.db2.gz KKQDRXOCINBDMT-OAHLLOKOSA-N 1 1 349.387 2.341 20 5 EEBDMO COC(=O)[C@H]1CCCCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000369112187 166191750 /nfs/dbraw/zinc/19/17/50/166191750.db2.gz KKQDRXOCINBDMT-OAHLLOKOSA-N 1 1 349.387 2.341 20 5 EEBDMO Cn1cc(C[C@H]2CC[N@@H+](CCOc3ccccc3[N+](=O)[O-])C2)cn1 ZINC000370002617 166374243 /nfs/dbraw/zinc/37/42/43/166374243.db2.gz QWGHGGNXSABLTM-CQSZACIVSA-N 1 1 330.388 2.272 20 5 EEBDMO CC[C@@](C)(O)C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000275407058 269113460 /nfs/dbraw/zinc/11/34/60/269113460.db2.gz CWYDMQTXWXRUTG-QGZVFWFLSA-N 1 1 347.419 2.144 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](C)Cn1cc[nH+]c1C ZINC000277693895 269173072 /nfs/dbraw/zinc/17/30/72/269173072.db2.gz ZWTSYYFTMYJRKC-LLVKDONJSA-N 1 1 332.360 2.174 20 5 EEBDMO CC[NH+]1CCN(C[C@@H](C)CNc2c3c(ccc2[N+](=O)[O-])NCC3)CC1 ZINC000278435137 269231294 /nfs/dbraw/zinc/23/12/94/269231294.db2.gz PYKJEPFKUZSLOY-AWEZNQCLSA-N 1 1 347.463 2.248 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@H]1C[C@H](C)O ZINC000279639615 269297048 /nfs/dbraw/zinc/29/70/48/269297048.db2.gz ASLYYCRAQCBMKR-KBPBESRZSA-N 1 1 335.404 2.467 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@H]1C[C@H](C)O ZINC000279639615 269297050 /nfs/dbraw/zinc/29/70/50/269297050.db2.gz ASLYYCRAQCBMKR-KBPBESRZSA-N 1 1 335.404 2.467 20 5 EEBDMO C[N@@H+](CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C1CCCC1 ZINC000272794228 274182717 /nfs/dbraw/zinc/18/27/17/274182717.db2.gz CQFGEVBWSPPNPJ-UHFFFAOYSA-N 1 1 347.462 2.346 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1C ZINC000493768389 274270075 /nfs/dbraw/zinc/27/00/75/274270075.db2.gz OVWVHFQTGACFRO-VXGBXAGGSA-N 1 1 327.812 2.135 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c1 ZINC000277558684 274309099 /nfs/dbraw/zinc/30/90/99/274309099.db2.gz PDOSUJWMNZZHPJ-ZDUSSCGKSA-N 1 1 333.388 2.350 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000277565749 274310797 /nfs/dbraw/zinc/31/07/97/274310797.db2.gz KPVZSGPSIOYHMC-ZDUSSCGKSA-N 1 1 333.344 2.229 20 5 EEBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000278418424 274352987 /nfs/dbraw/zinc/35/29/87/274352987.db2.gz XCTGLMZJZSRMRR-ZDUSSCGKSA-N 1 1 348.403 2.312 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)C2)C1 ZINC000292121901 275379781 /nfs/dbraw/zinc/37/97/81/275379781.db2.gz GPXKVIRRPWMUPN-GOSISDBHSA-N 1 1 344.415 2.337 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)CC[C@H]21 ZINC000248173173 277084013 /nfs/dbraw/zinc/08/40/13/277084013.db2.gz VDSIWVPGORJGLG-SUMWQHHRSA-N 1 1 347.415 2.377 20 5 EEBDMO C[C@H](NC(=O)N1CC[C@H]2CC[N@@H+](C)C[C@H]21)c1ccc([N+](=O)[O-])cc1 ZINC000297795142 294342929 /nfs/dbraw/zinc/34/29/29/294342929.db2.gz XSUNEOAYNLGPEV-JGGQBBKZSA-N 1 1 332.404 2.391 20 5 EEBDMO O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)c1ccc([N+](=O)[O-])[nH]1 ZINC000298841230 294599283 /nfs/dbraw/zinc/59/92/83/294599283.db2.gz HIVAOPUEVSPEFO-CYBMUJFWSA-N 1 1 332.360 2.473 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000448878515 315396377 /nfs/dbraw/zinc/39/63/77/315396377.db2.gz RFSROERMNAUJRE-LBPRGKRZSA-N 1 1 345.403 2.445 20 5 EEBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000524720414 317024210 /nfs/dbraw/zinc/02/42/10/317024210.db2.gz PEHVRDTVMVIJCI-CQSZACIVSA-N 1 1 346.431 2.267 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCc2c[nH+]c(C)n2C1 ZINC000563286397 318992842 /nfs/dbraw/zinc/99/28/42/318992842.db2.gz UBJPGVIBLANYBP-NSHDSACASA-N 1 1 329.360 2.343 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(NCC[NH+]3CCSCC3)n2)cc1 ZINC000486966209 447826760 /nfs/dbraw/zinc/82/67/60/447826760.db2.gz FFIVQEADVYBEHU-UHFFFAOYSA-N 1 1 335.389 2.106 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000339241031 465160084 /nfs/dbraw/zinc/16/00/84/465160084.db2.gz VMQQXYFWUJNISI-AWEZNQCLSA-N 1 1 334.420 2.387 20 5 EEBDMO C[C@H](c1cnn(C)c1)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337329541 465309031 /nfs/dbraw/zinc/30/90/31/465309031.db2.gz ZSJSFAKQRMDRKP-GFCCVEGCSA-N 1 1 331.376 2.350 20 5 EEBDMO Cc1cc(C(=O)N2CCC([N@@H+]3CCOC[C@H]3C)CC2)cc([N+](=O)[O-])c1 ZINC000590554802 468271433 /nfs/dbraw/zinc/27/14/33/468271433.db2.gz FJOVZMMKLQBDHN-CQSZACIVSA-N 1 1 347.415 2.229 20 5 EEBDMO CC[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000046063613 462644021 /nfs/dbraw/zinc/64/40/21/462644021.db2.gz LCGFQPBRCCIYQV-OAHLLOKOSA-N 1 1 342.399 2.490 20 5 EEBDMO CN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C)C1 ZINC000153606696 462668833 /nfs/dbraw/zinc/66/88/33/462668833.db2.gz FFZHAXHNSSCZBU-OAHLLOKOSA-N 1 1 346.431 2.361 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)n1 ZINC000089644407 462703355 /nfs/dbraw/zinc/70/33/55/462703355.db2.gz SGXQYHYBISESNY-CVEARBPZSA-N 1 1 342.399 2.346 20 5 EEBDMO CC[N@H+](CCC(=O)OC)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000064570084 462710866 /nfs/dbraw/zinc/71/08/66/462710866.db2.gz DHHXQGIWHVSXGE-UHFFFAOYSA-N 1 1 334.332 2.030 20 5 EEBDMO CC[N@@H+](CCC(=O)OC)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000064570084 462710871 /nfs/dbraw/zinc/71/08/71/462710871.db2.gz DHHXQGIWHVSXGE-UHFFFAOYSA-N 1 1 334.332 2.030 20 5 EEBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000115519213 462718860 /nfs/dbraw/zinc/71/88/60/462718860.db2.gz YSBTVJGQAFCVRQ-GFCCVEGCSA-N 1 1 332.404 2.258 20 5 EEBDMO CCOc1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000090512162 462795015 /nfs/dbraw/zinc/79/50/15/462795015.db2.gz NZBIQTSMEJAPBS-UHFFFAOYSA-N 1 1 331.372 2.287 20 5 EEBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000076651106 462890770 /nfs/dbraw/zinc/89/07/70/462890770.db2.gz CSBZVEXXVBDBTL-CYBMUJFWSA-N 1 1 328.372 2.269 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000076651106 462890772 /nfs/dbraw/zinc/89/07/72/462890772.db2.gz CSBZVEXXVBDBTL-CYBMUJFWSA-N 1 1 328.372 2.269 20 5 EEBDMO C[N@H+]1CC[C@@H](CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000120713576 463030052 /nfs/dbraw/zinc/03/00/52/463030052.db2.gz QOOBWNXEYXAVEB-VIFPVBQESA-N 1 1 342.193 2.039 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H](C)CC[NH+]1CCOCC1 ZINC000094133945 463061524 /nfs/dbraw/zinc/06/15/24/463061524.db2.gz BOIKQGIUKNVPMQ-AWEZNQCLSA-N 1 1 349.431 2.361 20 5 EEBDMO C[C@@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000068202988 463105111 /nfs/dbraw/zinc/10/51/11/463105111.db2.gz VSXJHMFLUFDSSC-KGLIPLIRSA-N 1 1 334.420 2.243 20 5 EEBDMO C[C@@H]1C[N@H+](CCCNc2nc3sccn3c2[N+](=O)[O-])C[C@H](C)O1 ZINC000025151774 463112026 /nfs/dbraw/zinc/11/20/26/463112026.db2.gz LTMNXQVLJIGEST-PHIMTYICSA-N 1 1 339.421 2.215 20 5 EEBDMO CC(C)C[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000026062454 463149451 /nfs/dbraw/zinc/14/94/51/463149451.db2.gz PEWLJKKMBGIFDM-MRXNPFEDSA-N 1 1 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CC1(C)CCC[N@H+]1CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000450951807 467214066 /nfs/dbraw/zinc/21/40/66/467214066.db2.gz RAJWVUMOSOTCNR-UHFFFAOYSA-N 1 1 341.433 2.285 20 5 EEBDMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000451869757 467277431 /nfs/dbraw/zinc/27/74/31/467277431.db2.gz SLTTYKSJYVCPFH-CYBMUJFWSA-N 1 1 345.403 2.239 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)c(CN2CC[NH+]([C@@H]3CCOC3)CC2)c1 ZINC000378401030 467291900 /nfs/dbraw/zinc/29/19/00/467291900.db2.gz WXLPYLJJKVJMDX-CQSZACIVSA-N 1 1 325.796 2.155 20 5 EEBDMO C[C@@H]1[C@H]([N@@H+](C)CCO)CCN1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000429158973 467307228 /nfs/dbraw/zinc/30/72/28/467307228.db2.gz PVXVUUDWHTVJAE-BXUZGUMPSA-N 1 1 327.812 2.135 20 5 EEBDMO Cc1sc(S(=O)(=O)N[C@@H]2CCC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000435436219 467469384 /nfs/dbraw/zinc/46/93/84/467469384.db2.gz FCJLLAURTHJJLG-LLVKDONJSA-N 1 1 347.462 2.116 20 5 EEBDMO Cc1sc(S(=O)(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000435436219 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CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000352574658 162194607 /nfs/dbraw/zinc/19/46/07/162194607.db2.gz IORNMOVYOKYPPF-CYBMUJFWSA-N 1 1 343.449 2.302 20 5 EEBDMO COc1cc(CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])cc1OC ZINC000360256015 164269390 /nfs/dbraw/zinc/26/93/90/164269390.db2.gz XERHTMUGOLZSEZ-UONOGXRCSA-N 1 1 335.404 2.328 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@@H](OCc3ccncc3)C2)c1 ZINC000376511094 167340848 /nfs/dbraw/zinc/34/08/48/167340848.db2.gz JOLWPTGZMKXQTJ-MSOLQXFVSA-N 1 1 343.383 2.314 20 5 EEBDMO C[NH+](C)CCN(c1ccccc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000171953093 227383712 /nfs/dbraw/zinc/38/37/12/227383712.db2.gz IQWLZWRLFXFYEK-UHFFFAOYSA-N 1 1 349.412 2.352 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2CO)nc1 ZINC000269101304 274109870 /nfs/dbraw/zinc/10/98/70/274109870.db2.gz RVOMCYGHAIEDEW-NVXWUHKLSA-N 1 1 342.399 2.285 20 5 EEBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1CCOc1cccc([N+](=O)[O-])c1 ZINC000278672429 274386352 /nfs/dbraw/zinc/38/63/52/274386352.db2.gz ODBNRWGAZMMRTM-OAHLLOKOSA-N 1 1 349.431 2.159 20 5 EEBDMO Cc1cnn([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)c1 ZINC000289785899 275148616 /nfs/dbraw/zinc/14/86/16/275148616.db2.gz HLKAPRLEFMVADC-AWEZNQCLSA-N 1 1 331.332 2.455 20 5 EEBDMO Cc1cnn([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)c1 ZINC000289785899 275148617 /nfs/dbraw/zinc/14/86/17/275148617.db2.gz HLKAPRLEFMVADC-AWEZNQCLSA-N 1 1 331.332 2.455 20 5 EEBDMO Cn1cc(C[N@@H+]2CCC[C@@](F)(CO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000289833165 275153023 /nfs/dbraw/zinc/15/30/23/275153023.db2.gz OWQXFYFJLIAJME-KRWDZBQOSA-N 1 1 348.378 2.292 20 5 EEBDMO Cn1cc(C[N@H+]2CCC[C@@](F)(CO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000289833165 275153024 /nfs/dbraw/zinc/15/30/24/275153024.db2.gz OWQXFYFJLIAJME-KRWDZBQOSA-N 1 1 348.378 2.292 20 5 EEBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)C2 ZINC000290026226 275172249 /nfs/dbraw/zinc/17/22/49/275172249.db2.gz RMONOXSLUZCJKX-CQSZACIVSA-N 1 1 328.372 2.021 20 5 EEBDMO COCCOCC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000290153310 275184687 /nfs/dbraw/zinc/18/46/87/275184687.db2.gz LGNUYSZHWMMKAY-UHFFFAOYSA-N 1 1 334.319 2.291 20 5 EEBDMO COCCOCC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000290153310 275184688 /nfs/dbraw/zinc/18/46/88/275184688.db2.gz LGNUYSZHWMMKAY-UHFFFAOYSA-N 1 1 334.319 2.291 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CC[C@@H](n4cccn4)C3)o2)cc1 ZINC000291597538 275321345 /nfs/dbraw/zinc/32/13/45/275321345.db2.gz BUEDDVRKTLPNSN-CQSZACIVSA-N 1 1 340.343 2.288 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@H](n4cccn4)C3)o2)cc1 ZINC000291597538 275321347 /nfs/dbraw/zinc/32/13/47/275321347.db2.gz BUEDDVRKTLPNSN-CQSZACIVSA-N 1 1 340.343 2.288 20 5 EEBDMO C[C@@H]1CN(c2cccc(F)c2)CC[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000292060175 275369809 /nfs/dbraw/zinc/36/98/09/275369809.db2.gz BOLQCBKVAIISMJ-CYBMUJFWSA-N 1 1 333.367 2.141 20 5 EEBDMO C[C@@H]1CN(c2cccc(F)c2)CC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000292060175 275369811 /nfs/dbraw/zinc/36/98/11/275369811.db2.gz BOLQCBKVAIISMJ-CYBMUJFWSA-N 1 1 333.367 2.141 20 5 EEBDMO CC(C)(C)NC(=O)NC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000292067718 275370999 /nfs/dbraw/zinc/37/09/99/275370999.db2.gz DFQSFQGMLIUCSJ-UHFFFAOYSA-N 1 1 336.392 2.044 20 5 EEBDMO C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1nccc2c1cccc2[N+](=O)[O-] ZINC000450529173 279999827 /nfs/dbraw/zinc/99/98/27/279999827.db2.gz MHNKEHOYMXNHTC-KBPBESRZSA-N 1 1 342.399 2.442 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)c1 ZINC000345313534 281015245 /nfs/dbraw/zinc/01/52/45/281015245.db2.gz JKIPCELLCJSCTK-INIZCTEOSA-N 1 1 349.431 2.471 20 5 EEBDMO Cc1ccccc1[C@@H]([C@@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-])[NH+](C)C ZINC000357857828 281361240 /nfs/dbraw/zinc/36/12/40/281361240.db2.gz GNEJKVOUQIHGHE-IAQYHMDHSA-N 1 1 331.376 2.048 20 5 EEBDMO C[C@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+](C2CCC2)C1 ZINC000293694580 293272859 /nfs/dbraw/zinc/27/28/59/293272859.db2.gz MSZYQQUJVXRAAZ-GFCCVEGCSA-N 1 1 333.388 2.247 20 5 EEBDMO C[C@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000293694580 293272861 /nfs/dbraw/zinc/27/28/61/293272861.db2.gz MSZYQQUJVXRAAZ-GFCCVEGCSA-N 1 1 333.388 2.247 20 5 EEBDMO C[C@H](C(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])[NH+]1CCSCC1 ZINC000293871629 293315223 /nfs/dbraw/zinc/31/52/23/293315223.db2.gz DZCUXIGFVCLKHM-GFCCVEGCSA-N 1 1 337.445 2.383 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000299040246 294644189 /nfs/dbraw/zinc/64/41/89/294644189.db2.gz UGQUXKOKRKZKQC-UHFFFAOYSA-N 1 1 347.331 2.136 20 5 EEBDMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000332640230 312039055 /nfs/dbraw/zinc/03/90/55/312039055.db2.gz QUGIQVJZUNDCAJ-STQMWFEESA-N 1 1 333.388 2.302 20 5 EEBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000421709461 314147910 /nfs/dbraw/zinc/14/79/10/314147910.db2.gz FJFWKBIMHNWEEP-LBPRGKRZSA-N 1 1 328.372 2.309 20 5 EEBDMO O=[N+]([O-])c1cccc(CS(=O)(=O)N2CC[NH2+]Cc3ccccc32)c1 ZINC000443457847 315248159 /nfs/dbraw/zinc/24/81/59/315248159.db2.gz XNRGLJXFCWODET-UHFFFAOYSA-N 1 1 347.396 2.034 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCC[NH+]1CCOCC1 ZINC000443941818 315265640 /nfs/dbraw/zinc/26/56/40/315265640.db2.gz ANWUYEDONHIKSC-UHFFFAOYSA-N 1 1 336.392 2.055 20 5 EEBDMO CC(C)OCC[NH+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000444648489 315313880 /nfs/dbraw/zinc/31/38/80/315313880.db2.gz NUCQLJVZACNILD-UHFFFAOYSA-N 1 1 347.419 2.014 20 5 EEBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000525727068 317070924 /nfs/dbraw/zinc/07/09/24/317070924.db2.gz VWLXCJKFVABVMT-LBPRGKRZSA-N 1 1 349.387 2.127 20 5 EEBDMO O=C(Cn1c[nH+]c2c1CCCC2)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000541780568 318109436 /nfs/dbraw/zinc/10/94/36/318109436.db2.gz BYNAHWIXEYDLOR-UHFFFAOYSA-N 1 1 340.383 2.255 20 5 EEBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@@H]1c1ccccc1Cl ZINC000567671898 319403227 /nfs/dbraw/zinc/40/32/27/319403227.db2.gz RVISUSMLOVQLGN-OAHLLOKOSA-N 1 1 348.790 2.373 20 5 EEBDMO CC(C)Oc1cc(C(=O)NCC[N@H+]2CC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000574380918 320019923 /nfs/dbraw/zinc/01/99/23/320019923.db2.gz KOTAGHDEGXZFKW-ZDUSSCGKSA-N 1 1 335.404 2.454 20 5 EEBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000578010801 320288850 /nfs/dbraw/zinc/28/88/50/320288850.db2.gz RQHOJXNCGLAYOE-LBPRGKRZSA-N 1 1 347.371 2.070 20 5 EEBDMO COC(=O)c1cc(NC(=O)C[N@@H+]2CCC(C)(C)C2)cc([N+](=O)[O-])c1 ZINC000581319825 324230502 /nfs/dbraw/zinc/23/05/02/324230502.db2.gz MIBPKBOGEXBETP-UHFFFAOYSA-N 1 1 335.360 2.052 20 5 EEBDMO COC(=O)c1cc(NC(=O)C[N@H+]2CCC(C)(C)C2)cc([N+](=O)[O-])c1 ZINC000581319825 324230503 /nfs/dbraw/zinc/23/05/03/324230503.db2.gz MIBPKBOGEXBETP-UHFFFAOYSA-N 1 1 335.360 2.052 20 5 EEBDMO CNc1c(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000326429596 465038141 /nfs/dbraw/zinc/03/81/41/465038141.db2.gz OKGYAZZKDHPFDV-GXTWGEPZSA-N 1 1 332.404 2.193 20 5 EEBDMO CC(C)[N@H+]1CCCC[C@H]1CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O ZINC000339115866 465092440 /nfs/dbraw/zinc/09/24/40/465092440.db2.gz GFZSFFTUPLAMOZ-ZDUSSCGKSA-N 1 1 331.372 2.454 20 5 EEBDMO COc1c(C(=O)NC[C@@H](C)Cn2cc[nH+]c2C)cccc1[N+](=O)[O-] ZINC000354808426 465164707 /nfs/dbraw/zinc/16/47/07/465164707.db2.gz QDUKYFRUPXOJFN-LLVKDONJSA-N 1 1 332.360 2.174 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](CCO)[C@H]1CC[C@H](C)C1 ZINC000351616903 465253951 /nfs/dbraw/zinc/25/39/51/465253951.db2.gz BGBADGUBRQNHAF-JSGCOSHPSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1 ZINC000341801333 465261345 /nfs/dbraw/zinc/26/13/45/465261345.db2.gz VLRAQTLTJMTWPU-DGCLKSJQSA-N 1 1 328.376 2.214 20 5 EEBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000113197729 462576165 /nfs/dbraw/zinc/57/61/65/462576165.db2.gz SGUGWTKUVWAKNP-AWEZNQCLSA-N 1 1 334.420 2.387 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000087008053 462582581 /nfs/dbraw/zinc/58/25/81/462582581.db2.gz CPHRVECNZKHWTM-KRWDZBQOSA-N 1 1 349.431 2.000 20 5 EEBDMO CCC[C@H]1CN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)CC[N@@H+]1CCOC ZINC000127958002 462596952 /nfs/dbraw/zinc/59/69/52/462596952.db2.gz GEUAPYHWOBVBSO-INIZCTEOSA-N 1 1 349.431 2.476 20 5 EEBDMO CCC[C@H]1CN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000127958002 462596956 /nfs/dbraw/zinc/59/69/56/462596956.db2.gz GEUAPYHWOBVBSO-INIZCTEOSA-N 1 1 349.431 2.476 20 5 EEBDMO CN(c1c([N+](=O)[O-])ncn1C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000074775107 462633893 /nfs/dbraw/zinc/63/38/93/462633893.db2.gz KVMKLQPUHQPNNF-HNNXBMFYSA-N 1 1 329.404 2.429 20 5 EEBDMO CC(C)[C@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)N1CCN(C)CC1 ZINC000064620259 462712307 /nfs/dbraw/zinc/71/23/07/462712307.db2.gz DZPIYQIEVDPKRU-AWEZNQCLSA-N 1 1 326.466 2.018 20 5 EEBDMO CCc1ccc(C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C2CC2)cc1 ZINC000075624499 462741112 /nfs/dbraw/zinc/74/11/12/462741112.db2.gz VNSDAGKZNXGEKZ-GOSISDBHSA-N 1 1 344.415 2.379 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000007850967 462754469 /nfs/dbraw/zinc/75/44/69/462754469.db2.gz VUKCFODIXGJVIG-CQSZACIVSA-N 1 1 332.404 2.383 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)C[NH+]2CCC(O)(C(F)(F)F)CC2)c1 ZINC000089968295 462757160 /nfs/dbraw/zinc/75/71/60/462757160.db2.gz FBPOCASGVGXORM-LBPRGKRZSA-N 1 1 334.294 2.017 20 5 EEBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCc2ccccc2C1 ZINC000090549303 462796333 /nfs/dbraw/zinc/79/63/33/462796333.db2.gz AWQWVYKXRJJLSW-MRXNPFEDSA-N 1 1 327.384 2.246 20 5 EEBDMO C[C@@H]([NH2+]C(C)(C)CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccccc1 ZINC000133788143 462969729 /nfs/dbraw/zinc/96/97/29/462969729.db2.gz YIZOEEYECVFWFD-LLVKDONJSA-N 1 1 331.376 2.177 20 5 EEBDMO C[C@H]([NH2+]C(C)(C)CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccccc1 ZINC000133787930 462969899 /nfs/dbraw/zinc/96/98/99/462969899.db2.gz YIZOEEYECVFWFD-NSHDSACASA-N 1 1 331.376 2.177 20 5 EEBDMO CN(C)c1ncc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000093534512 463039549 /nfs/dbraw/zinc/03/95/49/463039549.db2.gz GJNLBDLPXPYVDM-NSHDSACASA-N 1 1 348.432 2.199 20 5 EEBDMO COc1ccc(CC(=O)NC[C@@H](C)Cn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000067913630 463066154 /nfs/dbraw/zinc/06/61/54/463066154.db2.gz MIVZCJJDSOKEHN-GFCCVEGCSA-N 1 1 346.387 2.103 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000026156695 463152415 /nfs/dbraw/zinc/15/24/15/463152415.db2.gz VQFKPAOHPKXJDJ-TXEJJXNPSA-N 1 1 337.376 2.041 20 5 EEBDMO CC(C)n1cc[nH+]c1Cn1cc(Br)cc([N+](=O)[O-])c1=O ZINC000097032334 463305984 /nfs/dbraw/zinc/30/59/84/463305984.db2.gz SJPBFQKSWJASKT-UHFFFAOYSA-N 1 1 341.165 2.345 20 5 EEBDMO CCOc1ccc(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000142363063 463361482 /nfs/dbraw/zinc/36/14/82/463361482.db2.gz RNPNPTMESZQZGF-CQSZACIVSA-N 1 1 333.388 2.304 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(NC)c([N+](=O)[O-])c2)C1 ZINC000081363472 463425120 /nfs/dbraw/zinc/42/51/20/463425120.db2.gz DUGJIFBHXBUXFW-CYBMUJFWSA-N 1 1 334.420 2.440 20 5 EEBDMO C[N@H+]1CCCN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000124831468 463469511 /nfs/dbraw/zinc/46/95/11/463469511.db2.gz ZKQMYCWDQDQQFW-UHFFFAOYSA-N 1 1 328.210 2.495 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+](Cc2ccncc2)C2CC2)c1 ZINC000124865118 463474041 /nfs/dbraw/zinc/47/40/41/463474041.db2.gz UHLMPLHIBFDHET-KRWDZBQOSA-N 1 1 343.383 2.394 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000125114353 463504164 /nfs/dbraw/zinc/50/41/64/463504164.db2.gz RFQWJXGKCBLZJO-GFCCVEGCSA-N 1 1 336.392 2.080 20 5 EEBDMO C[C@@H](NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1 ZINC000126565201 463648315 /nfs/dbraw/zinc/64/83/15/463648315.db2.gz HYKYJZNCCNEEEI-MLGOLLRUSA-N 1 1 349.431 2.341 20 5 EEBDMO C[C@@H](NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1 ZINC000126565201 463648318 /nfs/dbraw/zinc/64/83/18/463648318.db2.gz HYKYJZNCCNEEEI-MLGOLLRUSA-N 1 1 349.431 2.341 20 5 EEBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000043884541 463661060 /nfs/dbraw/zinc/66/10/60/463661060.db2.gz ILCQMJROOCZVSW-CQSZACIVSA-N 1 1 349.435 2.038 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000170902717 463737959 /nfs/dbraw/zinc/73/79/59/463737959.db2.gz QJXBMJOTCBKJOK-KRWDZBQOSA-N 1 1 346.431 2.118 20 5 EEBDMO Cc1[nH]nc(C(=O)N2CC[NH2+]C[C@@H]2c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000261606435 463799792 /nfs/dbraw/zinc/79/97/92/463799792.db2.gz APXYIQUJJPHLRX-GFCCVEGCSA-N 1 1 349.778 2.066 20 5 EEBDMO CNC(=O)OC[C@@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000287126541 463808133 /nfs/dbraw/zinc/80/81/33/463808133.db2.gz ZMVWAMZBNFOEKI-ZDUSSCGKSA-N 1 1 337.376 2.184 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CCC(CC[NH+](C)C)CC2)c1[N+](=O)[O-] ZINC000269325383 463953341 /nfs/dbraw/zinc/95/33/41/463953341.db2.gz CVVJMCHAWFKDHO-UHFFFAOYSA-N 1 1 337.424 2.245 20 5 EEBDMO O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172419490 464077569 /nfs/dbraw/zinc/07/75/69/464077569.db2.gz RRCIHCHYZJCXNV-UHFFFAOYSA-N 1 1 347.415 2.451 20 5 EEBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000269785287 464093877 /nfs/dbraw/zinc/09/38/77/464093877.db2.gz HQYIJHIGSYTLRZ-YPMHNXCESA-N 1 1 332.360 2.380 20 5 EEBDMO C[C@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C(C)(C)C[NH+](C)C ZINC000173044688 464183172 /nfs/dbraw/zinc/18/31/72/464183172.db2.gz MDQKOBQXFBODID-JTQLQIEISA-N 1 1 333.392 2.177 20 5 EEBDMO C[C@@H](O)C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CCCCC1 ZINC000263786243 464190863 /nfs/dbraw/zinc/19/08/63/464190863.db2.gz PKGNTVKMWLWQLD-GFCCVEGCSA-N 1 1 335.404 2.209 20 5 EEBDMO Cc1cc(N2CCC([N@@H+](C)CCCO)CC2)c(F)cc1[N+](=O)[O-] ZINC000292713121 464315943 /nfs/dbraw/zinc/31/59/43/464315943.db2.gz SUVCCUUUUUMAMV-UHFFFAOYSA-N 1 1 325.384 2.325 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(c3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)C2)C1 ZINC000292865775 464370360 /nfs/dbraw/zinc/37/03/60/464370360.db2.gz SLVWIQHRXOEYEX-SFHVURJKSA-N 1 1 344.415 2.402 20 5 EEBDMO COc1ccc(C[N@@H+]2CCC[C@@H]2[C@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000264583226 464382905 /nfs/dbraw/zinc/38/29/05/464382905.db2.gz DEXIEAZYSSQFGA-MFKMUULPSA-N 1 1 334.294 2.491 20 5 EEBDMO COc1ccc(C[N@H+]2CCC[C@@H]2[C@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000264583226 464382911 /nfs/dbraw/zinc/38/29/11/464382911.db2.gz DEXIEAZYSSQFGA-MFKMUULPSA-N 1 1 334.294 2.491 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000294280672 464453823 /nfs/dbraw/zinc/45/38/23/464453823.db2.gz FIZSKABLIGHGBF-OAHLLOKOSA-N 1 1 333.388 2.158 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000175396398 464541071 /nfs/dbraw/zinc/54/10/71/464541071.db2.gz HLHHFCQIRFWVJC-CQSZACIVSA-N 1 1 341.433 2.008 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272349191 464573746 /nfs/dbraw/zinc/57/37/46/464573746.db2.gz OGLCVGQCPCFXTA-QMTHXVAHSA-N 1 1 339.342 2.286 20 5 EEBDMO O=[N+]([O-])c1cc(F)c(N2CCC[C@H](C[NH+]3CCOCC3)C2)c(F)c1 ZINC000282151207 464716760 /nfs/dbraw/zinc/71/67/60/464716760.db2.gz BVYMIGGVNKNUJU-GFCCVEGCSA-N 1 1 341.358 2.422 20 5 EEBDMO CC1(C)CN(CCn2ccc([N+](=O)[O-])n2)CC[N@H+]1Cc1ccccc1 ZINC000176231721 464727341 /nfs/dbraw/zinc/72/73/41/464727341.db2.gz XKVOCLZGCNSBPL-UHFFFAOYSA-N 1 1 343.431 2.388 20 5 EEBDMO C[C@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000176288470 464739468 /nfs/dbraw/zinc/73/94/68/464739468.db2.gz OSYNDPBXHQRDBT-SFDCACGMSA-N 1 1 336.417 2.222 20 5 EEBDMO Cn1ncc(C2CC2)c1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000597014777 468417907 /nfs/dbraw/zinc/41/79/07/468417907.db2.gz RWNRFYWHOONOCA-CYBMUJFWSA-N 1 1 342.403 2.287 20 5 EEBDMO COc1cc(C(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000295258072 464765217 /nfs/dbraw/zinc/76/52/17/464765217.db2.gz GQZYFTKHZGDZHO-LLVKDONJSA-N 1 1 339.367 2.345 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCCC[N@H+]2CCCC[C@@H]2C)n1 ZINC000286024992 464779172 /nfs/dbraw/zinc/77/91/72/464779172.db2.gz GBCGZYVSUQGETG-LBPRGKRZSA-N 1 1 336.392 2.453 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000266697935 464791446 /nfs/dbraw/zinc/79/14/46/464791446.db2.gz GHPMZPIRZBQXSD-OAHLLOKOSA-N 1 1 334.420 2.311 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)n1 ZINC000286133568 464815564 /nfs/dbraw/zinc/81/55/64/464815564.db2.gz VGYAMLKRTDFUIR-IXDOHACOSA-N 1 1 342.399 2.296 20 5 EEBDMO Cc1ccc([C@H](C)NC(=O)N2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000176720762 464832849 /nfs/dbraw/zinc/83/28/49/464832849.db2.gz PPAVKGSIQKPIIM-DZGCQCFKSA-N 1 1 332.404 2.454 20 5 EEBDMO O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000183646962 464890973 /nfs/dbraw/zinc/89/09/73/464890973.db2.gz YOOXVSLCEOPWGX-ZDUSSCGKSA-N 1 1 333.392 2.376 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000268240477 464987897 /nfs/dbraw/zinc/98/78/97/464987897.db2.gz USSXWZUKSJLVMX-MEBBXXQBSA-N 1 1 337.807 2.390 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)c1 ZINC000356344269 465325672 /nfs/dbraw/zinc/32/56/72/465325672.db2.gz LKUYQDBXTHJYDP-IRZMVBRHSA-N 1 1 342.399 2.330 20 5 EEBDMO CO[C@]1(C)CCC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000348239937 465506602 /nfs/dbraw/zinc/50/66/02/465506602.db2.gz QBDAZZCVJRODPJ-QGZVFWFLSA-N 1 1 349.387 2.394 20 5 EEBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000356970565 465668633 /nfs/dbraw/zinc/66/86/33/465668633.db2.gz FRLYRBFDIGKXDC-NWDGAFQWSA-N 1 1 331.376 2.169 20 5 EEBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000356970567 465668927 /nfs/dbraw/zinc/66/89/27/465668927.db2.gz FRLYRBFDIGKXDC-RYUDHWBXSA-N 1 1 331.376 2.169 20 5 EEBDMO CCCc1n[nH]c(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-] ZINC000344611269 465722098 /nfs/dbraw/zinc/72/20/98/465722098.db2.gz MPZTYVPWCOBFIB-GFCCVEGCSA-N 1 1 337.424 2.121 20 5 EEBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@@H]3COC[C@H]3O)o2)c([N+](=O)[O-])c1 ZINC000348640625 465724985 /nfs/dbraw/zinc/72/49/85/465724985.db2.gz HTHJOAVSZMWAKR-HZPDHXFCSA-N 1 1 348.355 2.055 20 5 EEBDMO COc1ccc(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000344640610 465742231 /nfs/dbraw/zinc/74/22/31/465742231.db2.gz ISLJUODNYPLQIQ-OAHLLOKOSA-N 1 1 335.404 2.454 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000330871749 465839164 /nfs/dbraw/zinc/83/91/64/465839164.db2.gz RFTNUXQUXAFJAV-WMLDXEAASA-N 1 1 348.447 2.362 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]CCCn1cccn1)c1cccc([N+](=O)[O-])c1 ZINC000353442676 465886042 /nfs/dbraw/zinc/88/60/42/465886042.db2.gz PYHOOEZQIAODNJ-INIZCTEOSA-N 1 1 340.387 2.294 20 5 EEBDMO O=[N+]([O-])c1ccc(OC2CCN(CC[N@H+]3CCCOCC3)CC2)cc1 ZINC000361309358 465899718 /nfs/dbraw/zinc/89/97/18/465899718.db2.gz OPHQIFKEWBWEGH-UHFFFAOYSA-N 1 1 349.431 2.160 20 5 EEBDMO C[N@H+]1CC[C@]2(CCN(C(=O)CCCNc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000346289683 466064000 /nfs/dbraw/zinc/06/40/00/466064000.db2.gz GDPHIGVVPNGMPF-SFHVURJKSA-N 1 1 346.431 2.341 20 5 EEBDMO CC(C)[C@@H]1CN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC[N@H+]1C ZINC000331921085 466306047 /nfs/dbraw/zinc/30/60/47/466306047.db2.gz CFFLOKNUZTYIRI-INIZCTEOSA-N 1 1 330.388 2.488 20 5 EEBDMO C[C@@H]1C[N@H+]2CCCC[C@@H]2CN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000332054210 466363794 /nfs/dbraw/zinc/36/37/94/466363794.db2.gz VDWQUEVSBLSTPE-RHSMWYFYSA-N 1 1 346.431 2.482 20 5 EEBDMO C[C@@H]1CSCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000332070924 466371976 /nfs/dbraw/zinc/37/19/76/466371976.db2.gz WKINXLWQDGBZMO-LLVKDONJSA-N 1 1 337.401 2.330 20 5 EEBDMO CCc1ccc([C@@H]([NH2+]C[C@H](O)COC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000338791034 466379849 /nfs/dbraw/zinc/37/98/49/466379849.db2.gz 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ZINC000351812322 161935672 /nfs/dbraw/zinc/93/56/72/161935672.db2.gz DRVYLUPIHVRNKP-ZDUSSCGKSA-N 1 1 337.395 2.419 20 5 EEBDMO COc1c(C(=O)Nc2c[nH+]ccc2-n2cccn2)cccc1[N+](=O)[O-] ZINC000355652556 163260611 /nfs/dbraw/zinc/26/06/11/163260611.db2.gz CQOWBTJBIULTLQ-UHFFFAOYSA-N 1 1 339.311 2.436 20 5 EEBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000360087231 164230005 /nfs/dbraw/zinc/23/00/05/164230005.db2.gz WFQBAAPXKYQECR-ZDUSSCGKSA-N 1 1 337.445 2.487 20 5 EEBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cn4ccccc4n3)CC2)n1 ZINC000373298368 166863657 /nfs/dbraw/zinc/86/36/57/166863657.db2.gz HXMFDXRJWFEBCD-UHFFFAOYSA-N 1 1 326.360 2.276 20 5 EEBDMO CCOc1ccc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-] ZINC000374871963 167056794 /nfs/dbraw/zinc/05/67/94/167056794.db2.gz CSBPIKMMBQEDHD-SWLSCSKDSA-N 1 1 333.388 2.160 20 5 EEBDMO C[C@]1(O)CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000375906540 167223653 /nfs/dbraw/zinc/22/36/53/167223653.db2.gz SYKQIADQIMBFRS-INIZCTEOSA-N 1 1 332.360 2.382 20 5 EEBDMO C[C@]1(O)CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000375906540 167223656 /nfs/dbraw/zinc/22/36/56/167223656.db2.gz SYKQIADQIMBFRS-INIZCTEOSA-N 1 1 332.360 2.382 20 5 EEBDMO Cn1c(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000408449649 167794769 /nfs/dbraw/zinc/79/47/69/167794769.db2.gz ATNMYDMLSABSQI-OCCSQVGLSA-N 1 1 332.404 2.022 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000163762819 226014138 /nfs/dbraw/zinc/01/41/38/226014138.db2.gz BXOKKNZYZPVORC-ZDUSSCGKSA-N 1 1 343.387 2.055 20 5 EEBDMO C[C@@H]1CN(c2c(F)cc([N+](=O)[O-])cc2F)CC[N@@H+]1CC(C)(C)O ZINC000275675150 269134654 /nfs/dbraw/zinc/13/46/54/269134654.db2.gz ZUNKLATXRRSESG-SNVBAGLBSA-N 1 1 329.347 2.154 20 5 EEBDMO C[C@@H]1CN(c2c(F)cc([N+](=O)[O-])cc2F)CC[N@H+]1CC(C)(C)O ZINC000275675150 269134655 /nfs/dbraw/zinc/13/46/55/269134655.db2.gz ZUNKLATXRRSESG-SNVBAGLBSA-N 1 1 329.347 2.154 20 5 EEBDMO 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/nfs/dbraw/zinc/08/14/41/466081441.db2.gz JSFLUJRCIAKVBY-HUUCEWRRSA-N 1 1 347.415 2.227 20 5 EEBDMO CCOc1cc(N2CC[C@@H]([NH+]3CCOCC3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000357605233 466171786 /nfs/dbraw/zinc/17/17/86/466171786.db2.gz WDJVJCYPOOMEQO-DZGCQCFKSA-N 1 1 335.404 2.293 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000363018361 466179718 /nfs/dbraw/zinc/17/97/18/466179718.db2.gz STFCMXDQNDUVFO-VXGBXAGGSA-N 1 1 334.376 2.352 20 5 EEBDMO COC(=O)c1cnc(N[C@@H]2CC[N@@H+](CC3CCCC3)C2)c([N+](=O)[O-])c1 ZINC000302780958 466184077 /nfs/dbraw/zinc/18/40/77/466184077.db2.gz RSQHXRIVCWMWNW-CQSZACIVSA-N 1 1 348.403 2.453 20 5 EEBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000372297483 466286597 /nfs/dbraw/zinc/28/65/97/466286597.db2.gz INMKJIYDKNKUML-OAHLLOKOSA-N 1 1 326.356 2.292 20 5 EEBDMO CC(C)[N@@H+](C)CCCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000340742090 466303630 /nfs/dbraw/zinc/30/36/30/466303630.db2.gz RYBRYJTUWZTUSH-UHFFFAOYSA-N 1 1 345.403 2.241 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])s1)N1CC[NH+](C[C@@H]2CCSC2)CC1 ZINC000332083972 466377664 /nfs/dbraw/zinc/37/76/64/466377664.db2.gz CLEUECBTYZLTIF-NSHDSACASA-N 1 1 341.458 2.167 20 5 EEBDMO CCc1ccc([C@H]([NH2+]C[C@@H](O)COC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000338791029 466380418 /nfs/dbraw/zinc/38/04/18/466380418.db2.gz XXEAZKQNORXDDJ-RHSMWYFYSA-N 1 1 334.372 2.437 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H]([C@H](C)O)C1 ZINC000305652142 466416039 /nfs/dbraw/zinc/41/60/39/466416039.db2.gz NYDHJRBZCLEPKN-UONOGXRCSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H]([C@H](C)O)C1 ZINC000305674681 466422022 /nfs/dbraw/zinc/42/20/22/466422022.db2.gz ZDITZVNBGYSTKY-UONOGXRCSA-N 1 1 335.404 2.325 20 5 EEBDMO COc1cc(C[N@@H+]2C[C@@H](O)C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000340909825 466427296 /nfs/dbraw/zinc/42/72/96/466427296.db2.gz NSJJVIBLAQLAGU-WPRPVWTQSA-N 1 1 332.303 2.160 20 5 EEBDMO COc1cc(C[N@H+]2C[C@@H](O)C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000340909825 466427301 /nfs/dbraw/zinc/42/73/01/466427301.db2.gz NSJJVIBLAQLAGU-WPRPVWTQSA-N 1 1 332.303 2.160 20 5 EEBDMO CS(=O)(=O)c1ccc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000322638529 466634126 /nfs/dbraw/zinc/63/41/26/466634126.db2.gz XGQMTOOVGOHBGA-NEPJUHHUSA-N 1 1 339.417 2.037 20 5 EEBDMO CCc1ccc(C(=O)N2CC[NH2+]C[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000423951440 466926019 /nfs/dbraw/zinc/92/60/19/466926019.db2.gz MCVKSRNXQJCNII-KRWDZBQOSA-N 1 1 340.383 2.339 20 5 EEBDMO Cc1ccc(C(=O)N2CC[NH2+]C[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000423970082 466932460 /nfs/dbraw/zinc/93/24/60/466932460.db2.gz MDMGUZGBDRXIJG-MRXNPFEDSA-N 1 1 326.356 2.085 20 5 EEBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)(C)CN1CCOCC1 ZINC000412101670 467011070 /nfs/dbraw/zinc/01/10/70/467011070.db2.gz VRPLPIMIIGUONO-UHFFFAOYSA-N 1 1 347.419 2.014 20 5 EEBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)(C)CN1CCOCC1 ZINC000412101670 467011072 /nfs/dbraw/zinc/01/10/72/467011072.db2.gz VRPLPIMIIGUONO-UHFFFAOYSA-N 1 1 347.419 2.014 20 5 EEBDMO CN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)(C)C[NH+]1CCOCC1 ZINC000412101670 467011075 /nfs/dbraw/zinc/01/10/75/467011075.db2.gz VRPLPIMIIGUONO-UHFFFAOYSA-N 1 1 347.419 2.014 20 5 EEBDMO Cc1c(CNC(=O)N2CCC[C@H]3C[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-] ZINC000425736991 467127804 /nfs/dbraw/zinc/12/78/04/467127804.db2.gz HWMFFNATDNCPKS-GOEBONIOSA-N 1 1 332.404 2.139 20 5 EEBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CC[N@H+]1CC(C)(C)O ZINC000413248559 467196800 /nfs/dbraw/zinc/19/68/00/467196800.db2.gz OFFMZTCLQSHVOW-ZDUSSCGKSA-N 1 1 344.415 2.424 20 5 EEBDMO C[C@@H](CO)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413259579 467199210 /nfs/dbraw/zinc/19/92/10/467199210.db2.gz QGZVKCNBLHODPS-ZDUSSCGKSA-N 1 1 330.388 2.036 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C2CC2)C[C@@H](C)C1 ZINC000451080222 467242037 /nfs/dbraw/zinc/24/20/37/467242037.db2.gz BBNVEGUESJMCEW-ZDUSSCGKSA-N 1 1 346.431 2.258 20 5 EEBDMO C[C@@H]1CC[C@H]([N@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000429583905 467350405 /nfs/dbraw/zinc/35/04/05/467350405.db2.gz LOURDJBTMNPTKX-OCCSQVGLSA-N 1 1 326.418 2.489 20 5 EEBDMO C[C@@H]1CC[C@H]([N@@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000429583905 467350408 /nfs/dbraw/zinc/35/04/08/467350408.db2.gz LOURDJBTMNPTKX-OCCSQVGLSA-N 1 1 326.418 2.489 20 5 EEBDMO C[C@@H]1CC[C@@H]([N@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000429583907 467350981 /nfs/dbraw/zinc/35/09/81/467350981.db2.gz LOURDJBTMNPTKX-TZMCWYRMSA-N 1 1 326.418 2.489 20 5 EEBDMO C[C@@H]1CC[C@@H]([N@@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000429583907 467350984 /nfs/dbraw/zinc/35/09/84/467350984.db2.gz LOURDJBTMNPTKX-TZMCWYRMSA-N 1 1 326.418 2.489 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CN1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420380051 467386498 /nfs/dbraw/zinc/38/64/98/467386498.db2.gz BPRLSMKXPKAZQF-QAPCUYQASA-N 1 1 349.431 2.322 20 5 EEBDMO Cn1cc(Cl)c(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)n1 ZINC000453311607 467479220 /nfs/dbraw/zinc/47/92/20/467479220.db2.gz GPGWUFZRSAKTDB-AAEUAGOBSA-N 1 1 338.799 2.452 20 5 EEBDMO Cc1cc(OCC(=O)NCC[N@@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000431571477 467525909 /nfs/dbraw/zinc/52/59/09/467525909.db2.gz PYHUPGCAOFMDAZ-CYBMUJFWSA-N 1 1 335.404 2.130 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N2CCC3(CCC[N@H+]3C)CC2)c1[N+](=O)[O-] ZINC000408221846 467530490 /nfs/dbraw/zinc/53/04/90/467530490.db2.gz LWRFCNGEQBWBFN-UHFFFAOYSA-N 1 1 335.408 2.142 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CCC3(CCC[N@@H+]3C)CC2)c1[N+](=O)[O-] ZINC000408221846 467530493 /nfs/dbraw/zinc/53/04/93/467530493.db2.gz LWRFCNGEQBWBFN-UHFFFAOYSA-N 1 1 335.408 2.142 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CCC3(CCC[N@H+]3C)CC2)c1[N+](=O)[O-] ZINC000408221846 467530496 /nfs/dbraw/zinc/53/04/96/467530496.db2.gz LWRFCNGEQBWBFN-UHFFFAOYSA-N 1 1 335.408 2.142 20 5 EEBDMO C[N@@H+](CCO)C1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000493076121 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HCQSPRFNZRQLCO-OLZOCXBDSA-N 1 1 334.420 2.487 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(c3ncnc4ccc([N+](=O)[O-])cc43)C2)C1 ZINC000590141940 468218289 /nfs/dbraw/zinc/21/82/89/468218289.db2.gz UFHBXWFJBITHOB-KRWDZBQOSA-N 1 1 327.388 2.460 20 5 EEBDMO C[C@@H]1C[N@H+](CCCNC(=O)/C=C\c2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000490736201 468243990 /nfs/dbraw/zinc/24/39/90/468243990.db2.gz VBYMEJJJKWASBA-VMZPBXKQSA-N 1 1 347.415 2.224 20 5 EEBDMO CNc1ccc(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594420556 468580993 /nfs/dbraw/zinc/58/09/93/468580993.db2.gz WRMWTDJPGJLLRJ-GJZGRUSLSA-N 1 1 332.404 2.383 20 5 EEBDMO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1nnn(C(C)(C)C)n1 ZINC000594510956 468612572 /nfs/dbraw/zinc/61/25/72/468612572.db2.gz PZFBMCMRPVNSCJ-GFCCVEGCSA-N 1 1 332.408 2.447 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000597853964 468693572 /nfs/dbraw/zinc/69/35/72/468693572.db2.gz FOSVWVVLHCVPPM-LLVKDONJSA-N 1 1 349.387 2.174 20 5 EEBDMO O=C(NCc1cccc([N+](=O)[O-])c1)c1cc(C[NH+]2CCCC2)on1 ZINC000570869674 468706672 /nfs/dbraw/zinc/70/66/72/468706672.db2.gz YJNORSZGLJUCPV-UHFFFAOYSA-N 1 1 330.344 2.109 20 5 EEBDMO CCS(=O)(=O)C[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595018631 468744065 /nfs/dbraw/zinc/74/40/65/468744065.db2.gz CDFCJCQRHVZJJO-MNOVXSKESA-N 1 1 330.406 2.077 20 5 EEBDMO CC(=O)N1CCC[C@@H](CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1 ZINC000601158258 468764384 /nfs/dbraw/zinc/76/43/84/468764384.db2.gz QFGXFLGIYPDVKH-ZDUSSCGKSA-N 1 1 328.372 2.235 20 5 EEBDMO CC(C)(C)OC(=O)C[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000593089989 468866555 /nfs/dbraw/zinc/86/65/55/468866555.db2.gz COQQWYKMOBHZFH-CYBMUJFWSA-N 1 1 338.408 2.378 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](C)[C@H](CO)C1 ZINC000598650917 468946462 /nfs/dbraw/zinc/94/64/62/468946462.db2.gz QCLXDWLNKIMUHM-OCCSQVGLSA-N 1 1 335.404 2.182 20 5 EEBDMO Cn1ccnc1[C@@H](C1CC1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000602638019 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340.811 2.192 20 5 EEBDMO O=[N+]([O-])c1cccc(C[N@H+](CC[C@H]2CCS(=O)(=O)C2)C2CC2)c1 ZINC000611171668 469181107 /nfs/dbraw/zinc/18/11/07/469181107.db2.gz OJHDQMMMGUWIKG-ZDUSSCGKSA-N 1 1 338.429 2.384 20 5 EEBDMO O=[N+]([O-])c1cccc(C[N@@H+](CC[C@H]2CCS(=O)(=O)C2)C2CC2)c1 ZINC000611171668 469181111 /nfs/dbraw/zinc/18/11/11/469181111.db2.gz OJHDQMMMGUWIKG-ZDUSSCGKSA-N 1 1 338.429 2.384 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@@H](c3cc[nH]n3)C1)OCCO2 ZINC000611261555 469213209 /nfs/dbraw/zinc/21/32/09/469213209.db2.gz YYRAIZYPTZZMDW-GFCCVEGCSA-N 1 1 344.371 2.469 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@@H](c3ncc[nH]3)C1)OCCO2 ZINC000611261827 469213303 /nfs/dbraw/zinc/21/33/03/469213303.db2.gz HLIMKYHXVNOFHJ-GFCCVEGCSA-N 1 1 344.371 2.469 20 5 EEBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCc3c2cnn3CCO)c(F)c1 ZINC000611497644 469264183 /nfs/dbraw/zinc/26/41/83/469264183.db2.gz DYROWSQYBTZAON-OAHLLOKOSA-N 1 1 334.351 2.090 20 5 EEBDMO Nc1c(F)cccc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000602473243 469331518 /nfs/dbraw/zinc/33/15/18/469331518.db2.gz LADRWSIISFHIEH-GFCCVEGCSA-N 1 1 331.351 2.398 20 5 EEBDMO CCCC(=O)NC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000603682317 469422673 /nfs/dbraw/zinc/42/26/73/469422673.db2.gz FHXLJABDBZXXKD-UHFFFAOYSA-N 1 1 335.404 2.484 20 5 EEBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](n3ccnc3)C2)c2c(c1)COCO2 ZINC000609257976 469908070 /nfs/dbraw/zinc/90/80/70/469908070.db2.gz HOGMWVRYGSNOTG-OAHLLOKOSA-N 1 1 344.371 2.495 20 5 EEBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](n3ccnc3)C2)c2c(c1)COCO2 ZINC000609257976 469908073 /nfs/dbraw/zinc/90/80/73/469908073.db2.gz HOGMWVRYGSNOTG-OAHLLOKOSA-N 1 1 344.371 2.495 20 5 EEBDMO Cc1ccc(NCCCNC(=O)[C@@H]2CCCC[N@@H+]2C)c([N+](=O)[O-])c1 ZINC000610069270 469978111 /nfs/dbraw/zinc/97/81/11/469978111.db2.gz ICZOZXUYVIJSLN-HNNXBMFYSA-N 1 1 334.420 2.306 20 5 EEBDMO CC(C)C[C@H]1COCC[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181883253 528599607 /nfs/dbraw/zinc/59/96/07/528599607.db2.gz CQTFOGYXUBHBMR-GJZGRUSLSA-N 1 1 338.404 2.081 20 5 EEBDMO CC(C)C[C@H]1COCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181883253 528599616 /nfs/dbraw/zinc/59/96/16/528599616.db2.gz CQTFOGYXUBHBMR-GJZGRUSLSA-N 1 1 338.404 2.081 20 5 EEBDMO CON1CCC([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000459577708 536845826 /nfs/dbraw/zinc/84/58/26/536845826.db2.gz HHRRLFHTJIRVPB-UHFFFAOYSA-N 1 1 347.375 2.102 20 5 EEBDMO COc1ccc(CC(=O)NCCn2cc[nH+]c2C(C)C)cc1[N+](=O)[O-] ZINC000727853359 576454011 /nfs/dbraw/zinc/45/40/11/576454011.db2.gz QPGGAYBKEDDKSL-UHFFFAOYSA-N 1 1 346.387 2.282 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768773174 577562179 /nfs/dbraw/zinc/56/21/79/577562179.db2.gz SZXIHOYRWNRAEX-GHMZBOCLSA-N 1 1 340.811 2.211 20 5 EEBDMO CCOCC[N@H+](CC)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000752791505 577776168 /nfs/dbraw/zinc/77/61/68/577776168.db2.gz HOUSHJMEWZFATK-UHFFFAOYSA-N 1 1 336.392 2.153 20 5 EEBDMO CCOCC[N@@H+](CC)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000752791505 577776169 /nfs/dbraw/zinc/77/61/69/577776169.db2.gz HOUSHJMEWZFATK-UHFFFAOYSA-N 1 1 336.392 2.153 20 5 EEBDMO CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)OCc1cccc([N+](=O)[O-])c1 ZINC000748469216 577962447 /nfs/dbraw/zinc/96/24/47/577962447.db2.gz KFDLXTQCYNRTAV-MRXNPFEDSA-N 1 1 336.388 2.431 20 5 EEBDMO C[N@H+]1CCCN(CCC[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000740003940 578076941 /nfs/dbraw/zinc/07/69/41/578076941.db2.gz DQAAPYFQPKGVKI-UHFFFAOYSA-N 1 1 340.855 2.365 20 5 EEBDMO CCC1(O)CC[NH+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000742170842 578128501 /nfs/dbraw/zinc/12/85/01/578128501.db2.gz DHPSQYGKHBUXPS-UHFFFAOYSA-N 1 1 331.376 2.048 20 5 EEBDMO O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001022064119 676628609 /nfs/dbraw/zinc/62/86/09/676628609.db2.gz WZWWMSOWJOUPTP-XMTFNYHQSA-N 1 1 339.395 2.242 20 5 EEBDMO Cc1nn(C[N@@H+]2CCS[C@H]3COCC[C@@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000121267620 677878573 /nfs/dbraw/zinc/87/85/73/677878573.db2.gz MRPVAFIEYAIXRO-HOCLYGCPSA-N 1 1 348.428 2.417 20 5 EEBDMO Cc1nn(C[N@H+]2CCS[C@H]3COCC[C@@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000121267620 677878574 /nfs/dbraw/zinc/87/85/74/677878574.db2.gz MRPVAFIEYAIXRO-HOCLYGCPSA-N 1 1 348.428 2.417 20 5 EEBDMO Cc1[nH+]ccn1CCCN(C)C(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC000866856997 677909911 /nfs/dbraw/zinc/90/99/11/677909911.db2.gz SUIICCJVCBJELJ-UHFFFAOYSA-N 1 1 334.351 2.330 20 5 EEBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000255832732 679946435 /nfs/dbraw/zinc/94/64/35/679946435.db2.gz DXFIKYOQEFDODU-VUEDLFODSA-N 1 1 347.415 2.176 20 5 EEBDMO O=[N+]([O-])c1cnc2ccc(Cl)cc2c1N1CC([N@@H+]2CC[C@@H](O)C2)C1 ZINC000894396963 682811113 /nfs/dbraw/zinc/81/11/13/682811113.db2.gz CBQQSZGOWKULGW-GFCCVEGCSA-N 1 1 348.790 2.052 20 5 EEBDMO O=[N+]([O-])c1cnc2ccc(Cl)cc2c1N1CC([N@H+]2CC[C@@H](O)C2)C1 ZINC000894396963 682811118 /nfs/dbraw/zinc/81/11/18/682811118.db2.gz CBQQSZGOWKULGW-GFCCVEGCSA-N 1 1 348.790 2.052 20 5 EEBDMO CC1(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4cccc([N+](=O)[O-])c4)C[C@H]32)CC=CC1 ZINC001026010577 683744184 /nfs/dbraw/zinc/74/41/84/683744184.db2.gz TZLMEAJANUAJNY-FVQHAEBGSA-N 1 1 341.411 2.498 20 5 EEBDMO C[C@H](Nc1ncc([N+](=O)[O-])c2ccccc21)[C@H]1C[N@@H+](C)CCN1C ZINC000895247918 684383963 /nfs/dbraw/zinc/38/39/63/684383963.db2.gz KERLVWXXPVJWGR-BLLLJJGKSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1ncc([N+](=O)[O-])c2ccccc21)[C@H]1CN(C)CC[N@@H+]1C ZINC000895247918 684383967 /nfs/dbraw/zinc/38/39/67/684383967.db2.gz KERLVWXXPVJWGR-BLLLJJGKSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1ncc([N+](=O)[O-])c2ccccc21)[C@H]1CN(C)CC[N@H+]1C ZINC000895247918 684383971 /nfs/dbraw/zinc/38/39/71/684383971.db2.gz KERLVWXXPVJWGR-BLLLJJGKSA-N 1 1 329.404 2.189 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC([N@@H+](C)CCCO)CC2)c1C ZINC000897235508 686299495 /nfs/dbraw/zinc/29/94/95/686299495.db2.gz TZETYYMFIYXPOO-UHFFFAOYSA-N 1 1 349.431 2.130 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CC[C@H](C4OCCO4)C3)c2)cc1 ZINC000905697016 1189892376 /nfs/dbraw/zinc/89/23/76/1189892376.db2.gz TTZLOOOTJYHPKV-AWEZNQCLSA-N 1 1 344.371 2.111 20 5 EEBDMO CCS(=O)(=O)CC[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872032624 1198032319 /nfs/dbraw/zinc/03/23/19/1198032319.db2.gz WVIMNVVJHAUOQQ-JTQLQIEISA-N 1 1 332.447 2.402 20 5 EEBDMO COc1cc(C(=O)O[C@H](C)Cn2cc[nH+]c2C)c([N+](=O)[O-])cc1OC ZINC000810623863 1199620568 /nfs/dbraw/zinc/62/05/68/1199620568.db2.gz HUAUYPVUHWGXAD-SNVBAGLBSA-N 1 1 349.343 2.362 20 5 EEBDMO CC(C)CC(=O)N1CCC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000879760470 1201244924 /nfs/dbraw/zinc/24/49/24/1201244924.db2.gz CQROXHAILBOLNO-QGZVFWFLSA-N 1 1 349.431 2.209 20 5 EEBDMO CC(C)CC(=O)N1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000879760470 1201244926 /nfs/dbraw/zinc/24/49/26/1201244926.db2.gz CQROXHAILBOLNO-QGZVFWFLSA-N 1 1 349.431 2.209 20 5 EEBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000869210503 1201965395 /nfs/dbraw/zinc/96/53/95/1201965395.db2.gz SGDBEWNHUSJSHW-LSDHHAIUSA-N 1 1 335.379 2.410 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](N(C)C)[C@H]1C ZINC000931047441 1206602740 /nfs/dbraw/zinc/60/27/40/1206602740.db2.gz YRDDZTWBJWLWEP-CZUORRHYSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](N(C)C)[C@@H]1C ZINC000931047442 1206602729 /nfs/dbraw/zinc/60/27/29/1206602729.db2.gz YRDDZTWBJWLWEP-XJKSGUPXSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](N(C)C)[C@@H]1C ZINC000931047442 1206602730 /nfs/dbraw/zinc/60/27/30/1206602730.db2.gz YRDDZTWBJWLWEP-XJKSGUPXSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](N(C)C)[C@H]1C ZINC000931047441 1206602741 /nfs/dbraw/zinc/60/27/41/1206602741.db2.gz YRDDZTWBJWLWEP-CZUORRHYSA-N 1 1 334.420 2.256 20 5 EEBDMO CCOC(=O)[C@@H]1[C@H](C)C[C@@H](C)[N@@H+](CCn2cc([N+](=O)[O-])cn2)[C@H]1C ZINC000934164555 1207915068 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BOGNJCLKKDXUCB-SHTZXODSSA-N 1 1 346.431 2.447 20 5 EEBDMO C[N@@H+](CC1=CCCOC1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000853561960 1292416425 /nfs/dbraw/zinc/41/64/25/1292416425.db2.gz APYDGQUVKKHSFS-UHFFFAOYSA-N 1 1 329.360 2.089 20 5 EEBDMO C[N@H+](CC1=CCCOC1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000853561960 1292416427 /nfs/dbraw/zinc/41/64/27/1292416427.db2.gz APYDGQUVKKHSFS-UHFFFAOYSA-N 1 1 329.360 2.089 20 5 EEBDMO C[N@H+]1CCN[C@@H](c2nc(-c3ccc4ccc5cccnc5c4n3)no2)C1 ZINC001211457291 1295906558 /nfs/dbraw/zinc/90/65/58/1295906558.db2.gz KJZAKCDDBRWUQH-OAHLLOKOSA-N 1 1 346.394 2.409 20 5 EEBDMO CCOc1ccc2c(c1)c(=N)c1ccc(N)cc1n2C(=O)C1([NH3+])CC1 ZINC001219005371 1297903533 /nfs/dbraw/zinc/90/35/33/1297903533.db2.gz MPEWRGHGTJXBFE-UHFFFAOYSA-N 1 1 336.395 2.386 20 5 EEBDMO O=C(NC1CC[NH+](CC/C=C/c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001227257622 1301751652 /nfs/dbraw/zinc/75/16/52/1301751652.db2.gz CLNNZQVFIMHUCI-PLDKWVJVSA-N 1 1 343.427 2.336 20 5 EEBDMO C[N@H+]1CCC[C@H](Oc2ccc3c(c2)oc2cc(=O)ccc-2[n+]3[O-])CC1 ZINC001227448499 1301832865 /nfs/dbraw/zinc/83/28/65/1301832865.db2.gz FOXNSHZYROGBOT-AWEZNQCLSA-N 1 1 340.379 2.394 20 5 EEBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1Oc1nc[nH]c(=O)c1[N+](=O)[O-] ZINC001228143160 1302123488 /nfs/dbraw/zinc/12/34/88/1302123488.db2.gz JXHNYRVZFQHYOG-GXTWGEPZSA-N 1 1 344.371 2.380 20 5 EEBDMO COc1c(C)cc([N+](=O)[O-])c(O[C@H]2CCc3[nH+]ccn3C2)c1[N+](=O)[O-] ZINC001229868685 1302971373 /nfs/dbraw/zinc/97/13/73/1302971373.db2.gz MQJIKNJRTUQLEY-JTQLQIEISA-N 1 1 348.315 2.410 20 5 EEBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3ccc(C)cc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001230146886 1303085638 /nfs/dbraw/zinc/08/56/38/1303085638.db2.gz ZBGWZMVKVKOHII-ZJOBFFGXSA-N 1 1 334.372 2.449 20 5 EEBDMO CC[N@H+]1CCN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)[C@@H](C)C1 ZINC001230368339 1303180487 /nfs/dbraw/zinc/18/04/87/1303180487.db2.gz LLISQDQFQIUJIJ-NSHDSACASA-N 1 1 340.811 2.484 20 5 EEBDMO C[C@@H]1CCC[N@H+]1CCN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000780768304 1303700086 /nfs/dbraw/zinc/70/00/86/1303700086.db2.gz ROWHRPPOULCOLH-PBHICJAKSA-N 1 1 343.431 2.492 20 5 EEBDMO C[C@@H]1CCC[N@H+]1CCN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000780769021 1303700336 /nfs/dbraw/zinc/70/03/36/1303700336.db2.gz VURLEUZPHJISFV-RHSMWYFYSA-N 1 1 343.431 2.492 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NCC1(Nc2ncccc2[N+](=O)[O-])CCC1 ZINC001111827138 1303954457 /nfs/dbraw/zinc/95/44/57/1303954457.db2.gz SUKBQRJCOOESLF-UHFFFAOYSA-N 1 1 349.435 2.173 20 5 EEBDMO O=C(NCC1([NH2+]CCC(F)(F)F)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530519 1305285702 /nfs/dbraw/zinc/28/57/02/1305285702.db2.gz BHGDKDFGQQUPNH-GHMZBOCLSA-N 1 1 337.342 2.013 20 5 EEBDMO C[N@H+]1CCCC[C@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001120808471 1309764461 /nfs/dbraw/zinc/76/44/61/1309764461.db2.gz GOUJMYHULURIPQ-AWEZNQCLSA-N 1 1 330.388 2.219 20 5 EEBDMO COC[C@@]1(C)CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000830528949 1314539792 /nfs/dbraw/zinc/53/97/92/1314539792.db2.gz CMKNJEWTGGWDBD-INIZCTEOSA-N 1 1 339.367 2.421 20 5 EEBDMO CC1(C)CCC[N@H+]1CCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000837175877 1315059657 /nfs/dbraw/zinc/05/96/57/1315059657.db2.gz YWBKBIJUNLRUGI-UHFFFAOYSA-N 1 1 349.416 2.204 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000839706629 1315235389 /nfs/dbraw/zinc/23/53/89/1315235389.db2.gz YMRPZYWEAZFERT-BSDSXHPESA-N 1 1 343.427 2.165 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000839706629 1315235393 /nfs/dbraw/zinc/23/53/93/1315235393.db2.gz YMRPZYWEAZFERT-BSDSXHPESA-N 1 1 343.427 2.165 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000839706629 1315235398 /nfs/dbraw/zinc/23/53/98/1315235398.db2.gz YMRPZYWEAZFERT-BSDSXHPESA-N 1 1 343.427 2.165 20 5 EEBDMO COCCCC[N@H+](C)Cn1cc(C)n(-c2ccccc2[N+](=O)[O-])c1=O ZINC000841693341 1315598948 /nfs/dbraw/zinc/59/89/48/1315598948.db2.gz ZFTQHVKIRMJBKV-UHFFFAOYSA-N 1 1 348.403 2.172 20 5 EEBDMO COCCCC[N@@H+](C)Cn1cc(C)n(-c2ccccc2[N+](=O)[O-])c1=O ZINC000841693341 1315598950 /nfs/dbraw/zinc/59/89/50/1315598950.db2.gz ZFTQHVKIRMJBKV-UHFFFAOYSA-N 1 1 348.403 2.172 20 5 EEBDMO Cc1nn(C[N@H+]2CCC[C@@H]2[C@H]2CCCOC2)c2ncc([N+](=O)[O-])cc12 ZINC000842617701 1315734142 /nfs/dbraw/zinc/73/41/42/1315734142.db2.gz RAFPTCJWNZXYQW-XJKSGUPXSA-N 1 1 345.403 2.496 20 5 EEBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCC(N2CCN(C)CC2)CC1 ZINC001254562355 1318122063 /nfs/dbraw/zinc/12/20/63/1318122063.db2.gz KVFJLTJQHVHYBA-MRXNPFEDSA-N 1 1 346.475 2.238 20 5 EEBDMO COc1cc(N2CCC([N@@H+]3CCO[C@@H]4C[C@@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256101677 1318647116 /nfs/dbraw/zinc/64/71/16/1318647116.db2.gz QTDVBSMMITVWJS-DOTOQJQBSA-N 1 1 333.388 2.045 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CCO[C@@H]4C[C@@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256101677 1318647127 /nfs/dbraw/zinc/64/71/27/1318647127.db2.gz QTDVBSMMITVWJS-DOTOQJQBSA-N 1 1 333.388 2.045 20 5 EEBDMO O=C(NCCC1=CC[N@@H+](CC2CCCCC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160107774 1320071325 /nfs/dbraw/zinc/07/13/25/1320071325.db2.gz SQLAZSKYRFJWDX-IAGOWNOFSA-N 1 1 335.448 2.370 20 5 EEBDMO O=C(NCCC1=CC[N@H+](CC2CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160107774 1320071330 /nfs/dbraw/zinc/07/13/30/1320071330.db2.gz SQLAZSKYRFJWDX-IAGOWNOFSA-N 1 1 335.448 2.370 20 5 EEBDMO O=C(NCCC1=CC[N@@H+](CC2CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160107774 1320071337 /nfs/dbraw/zinc/07/13/37/1320071337.db2.gz SQLAZSKYRFJWDX-IAGOWNOFSA-N 1 1 335.448 2.370 20 5 EEBDMO [NH3+]CCc1cn(-c2cnc3cc([N+](=O)[O-])ccc3n2)c2ccncc12 ZINC001160946268 1320326177 /nfs/dbraw/zinc/32/61/77/1320326177.db2.gz YTGRYWGADAKBNT-UHFFFAOYSA-N 1 1 334.339 2.378 20 5 EEBDMO COc1nc(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)ncc1[N+](=O)[O-] ZINC001161885653 1320662341 /nfs/dbraw/zinc/66/23/41/1320662341.db2.gz WVVXRWPXYCWKAJ-AWEZNQCLSA-N 1 1 343.387 2.470 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)nc(N2CC[NH+](CCc3ccncc3)CC2)c1 ZINC001165059088 1321448271 /nfs/dbraw/zinc/44/82/71/1321448271.db2.gz QVJMDWBEYONZED-UHFFFAOYSA-N 1 1 347.806 2.403 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1CN1CCC[N@H+]3CCC[C@H]3C1)OCCO2 ZINC001320493644 1332896966 /nfs/dbraw/zinc/89/69/66/1332896966.db2.gz CXZXOCCXOVEUEW-AWEZNQCLSA-N 1 1 333.388 2.036 20 5 EEBDMO CCCc1[nH]nc(-c2nc([C@H]([NH3+])c3ccccc3)no2)c1[N+](=O)[O-] ZINC001326207246 1334043845 /nfs/dbraw/zinc/04/38/45/1334043845.db2.gz FOOIFHQSHDRIMD-LLVKDONJSA-N 1 1 328.332 2.369 20 5 EEBDMO CCOC(=O)C[C@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001327312067 1334264248 /nfs/dbraw/zinc/26/42/48/1334264248.db2.gz HBNHZDSRUNXREI-OAHLLOKOSA-N 1 1 349.387 2.341 20 5 EEBDMO CC1(C)CCC[N@H+]1CCNC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC001328168725 1334409166 /nfs/dbraw/zinc/40/91/66/1334409166.db2.gz YWSQRIXMMIYQBH-UHFFFAOYSA-N 1 1 339.367 2.103 20 5 EEBDMO COC1CCC([N@@H+](C)Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])CC1 ZINC001609313648 1351929880 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NJLLYKKYIIIUEJ-QAPCUYQASA-N 1 1 333.432 2.340 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC001337887387 1336748684 /nfs/dbraw/zinc/74/86/84/1336748684.db2.gz FJSPOEZKEFSXLO-BDJLRTHQSA-N 1 1 344.415 2.382 20 5 EEBDMO CNC(=O)c1ccc(N2CCC(c3c[nH+]cn3C)CC2)c([N+](=O)[O-])c1 ZINC001340027322 1337113204 /nfs/dbraw/zinc/11/32/04/1337113204.db2.gz BBPUCGZHGKGTOC-UHFFFAOYSA-N 1 1 343.387 2.072 20 5 EEBDMO O=[N+]([O-])c1cnc(N2CC[NH+]([C@H]3CCOC3)CC2)c2ccccc21 ZINC001353261636 1338227570 /nfs/dbraw/zinc/22/75/70/1338227570.db2.gz IVMULCFGLHTSJQ-ZDUSSCGKSA-N 1 1 328.372 2.054 20 5 EEBDMO CNc1nccc(C(=O)OC[C@H]2CCCC[N@H+]2C(C)C)c1[N+](=O)[O-] ZINC000848790088 1338764779 /nfs/dbraw/zinc/76/47/79/1338764779.db2.gz JRVQGHKXTUJTLM-GFCCVEGCSA-N 1 1 336.392 2.451 20 5 EEBDMO CCOC1(C)CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1 ZINC001578078355 1344231275 /nfs/dbraw/zinc/23/12/75/1344231275.db2.gz SEGCJRJGEMEXLZ-KRWDZBQOSA-N 1 1 335.404 2.186 20 5 EEBDMO C[C@@H](CNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC001590261874 1349237084 /nfs/dbraw/zinc/23/70/84/1349237084.db2.gz ZBFTYKOGMPJCHZ-NEPJUHHUSA-N 1 1 345.407 2.307 20 5 EEBDMO O=[N+]([O-])c1sc(-c2nn[nH]n2)cc1N[C@@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC001607088491 1351413198 /nfs/dbraw/zinc/41/31/98/1351413198.db2.gz PUTBZGYEJNJOOR-KOLCDFICSA-N 1 1 349.420 2.265 20 5 EEBDMO O=[N+]([O-])c1sc(-c2nn[nH]n2)cc1N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC001607088491 1351413203 /nfs/dbraw/zinc/41/32/03/1351413203.db2.gz PUTBZGYEJNJOOR-KOLCDFICSA-N 1 1 349.420 2.265 20 5 EEBDMO CCC[N@@H+](CCNC(=O)c1cnco1)Cc1ccc([N+](=O)[O-])cc1 ZINC001753146185 1406698254 /nfs/dbraw/zinc/69/82/54/1406698254.db2.gz LHOGSMFJSQWWGN-UHFFFAOYSA-N 1 1 332.360 2.225 20 5 EEBDMO CSc1nc(Cl)nc(N2C[C@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-] ZINC001164637722 719207950 /nfs/dbraw/zinc/20/79/50/719207950.db2.gz MNWRSFPGUJOEDV-YUMQZZPRSA-N 1 1 331.829 2.289 20 5 EEBDMO CSc1nc(Cl)nc(N2C[C@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-] ZINC001164637722 719207954 /nfs/dbraw/zinc/20/79/54/719207954.db2.gz MNWRSFPGUJOEDV-YUMQZZPRSA-N 1 1 331.829 2.289 20 5 EEBDMO C[N@H+]1CCO[C@@H]2CN(c3ccc4c(ccc(Cl)c4[N+](=O)[O-])n3)C[C@H]21 ZINC001164666618 719401259 /nfs/dbraw/zinc/40/12/59/719401259.db2.gz LKRCLAGLPQIFPM-ZIAGYGMSSA-N 1 1 348.790 2.316 20 5 EEBDMO O=[N+]([O-])c1ccc2ncc(N3CC4(C3)CC[N@@H+](CC3CC3)C4)nc2c1 ZINC001164767057 721282029 /nfs/dbraw/zinc/28/20/29/721282029.db2.gz FBWPBHDQESKKFN-UHFFFAOYSA-N 1 1 339.399 2.460 20 5 EEBDMO C[C@H]1CCC[N@H+]1CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000780866704 760670403 /nfs/dbraw/zinc/67/04/03/760670403.db2.gz KVYLOQJMBWCWDT-JTQLQIEISA-N 1 1 347.824 2.011 20 5 EEBDMO Cc1cccc(C(=O)NCC2C[NH+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC001031552861 769568967 /nfs/dbraw/zinc/56/89/67/769568967.db2.gz KYHAOTPSWHDBNF-UHFFFAOYSA-N 1 1 340.383 2.160 20 5 EEBDMO Cc1nc(C)c(C(=O)NCC2C[NH+](Cc3cccc([N+](=O)[O-])c3)C2)o1 ZINC001031595339 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349.387 2.199 20 5 EEBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412108085 467013405 /nfs/dbraw/zinc/01/34/05/467013405.db2.gz HFMFDQYLGHLMAI-XOKHGSTOSA-N 1 1 331.416 2.499 20 5 EEBDMO CCOc1cc(C[N@H+]2[C@@H]3CC[C@H]2CN(C)C(=O)C3)ccc1[N+](=O)[O-] ZINC000451862339 467276142 /nfs/dbraw/zinc/27/61/42/467276142.db2.gz GSGPBFBLGCSFJA-KGLIPLIRSA-N 1 1 333.388 2.189 20 5 EEBDMO CCOc1cc(C[N@@H+]2[C@@H]3CC[C@H]2CN(C)C(=O)C3)ccc1[N+](=O)[O-] ZINC000451862339 467276147 /nfs/dbraw/zinc/27/61/47/467276147.db2.gz GSGPBFBLGCSFJA-KGLIPLIRSA-N 1 1 333.388 2.189 20 5 EEBDMO C[N@H+](Cc1ccc(F)c(Cl)c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000433231071 467310286 /nfs/dbraw/zinc/31/02/86/467310286.db2.gz HWLNARGCSWVEJO-LBPRGKRZSA-N 1 1 342.758 2.077 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](O)C12CCCC2 ZINC000433300165 467315771 /nfs/dbraw/zinc/31/57/71/467315771.db2.gz SGRBFNCFGLWRAI-CQSZACIVSA-N 1 1 333.388 2.221 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](O)C12CCCC2 ZINC000433300165 467315774 /nfs/dbraw/zinc/31/57/74/467315774.db2.gz SGRBFNCFGLWRAI-CQSZACIVSA-N 1 1 333.388 2.221 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCC[N@H+]1CCCC1(C)C ZINC000452089666 467319060 /nfs/dbraw/zinc/31/90/60/467319060.db2.gz PZPODAYEBWGLMU-UHFFFAOYSA-N 1 1 341.433 2.056 20 5 EEBDMO Cc1ccc(S(=O)(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000452098587 467322574 /nfs/dbraw/zinc/32/25/74/467322574.db2.gz UQOXKCLQADHRQF-ZDUSSCGKSA-N 1 1 341.433 2.006 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420346189 467371371 /nfs/dbraw/zinc/37/13/71/467371371.db2.gz XPFRRIFGIGDRJB-QLFBSQMISA-N 1 1 346.431 2.243 20 5 EEBDMO C[NH2+]C[C@H]1CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000430962152 467483108 /nfs/dbraw/zinc/48/31/08/467483108.db2.gz PWKGLPQQTQERMF-CYBMUJFWSA-N 1 1 330.388 2.334 20 5 EEBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCN([C@@H]2CCC[C@H]2O)CC1 ZINC000449191567 467622499 /nfs/dbraw/zinc/62/24/99/467622499.db2.gz PKKIMMZNFARVTM-NIKGAXFTSA-N 1 1 347.459 2.493 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(Cc3cc([N+](=O)[O-])ccc3OC(F)F)C[C@@H]21 ZINC000449517381 467654984 /nfs/dbraw/zinc/65/49/84/467654984.db2.gz JWJVMDLLGPOVPK-MFKMUULPSA-N 1 1 327.331 2.332 20 5 EEBDMO C[C@H](CN1CC[NH+](C)CC1)Nc1nccc2c1cccc2[N+](=O)[O-] ZINC000450319763 467826371 /nfs/dbraw/zinc/82/63/71/467826371.db2.gz RYFRAXRKBZEXRF-CYBMUJFWSA-N 1 1 329.404 2.191 20 5 EEBDMO C[C@H]1CC[N@@H+](CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000517795917 468097816 /nfs/dbraw/zinc/09/78/16/468097816.db2.gz TZSLMLVLHJPDMX-NSHDSACASA-N 1 1 325.796 2.249 20 5 EEBDMO CC(C)[C@@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000489383058 468130570 /nfs/dbraw/zinc/13/05/70/468130570.db2.gz DQRMSXYIVDQHMZ-INIZCTEOSA-N 1 1 334.420 2.195 20 5 EEBDMO Cc1ncc2c(n1)CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000532918313 468152581 /nfs/dbraw/zinc/15/25/81/468152581.db2.gz VHDUKYHPBBNUSN-UHFFFAOYSA-N 1 1 341.371 2.080 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC([N@@H+]2CCOC[C@@H]2C)CC1 ZINC000590386602 468244077 /nfs/dbraw/zinc/24/40/77/468244077.db2.gz CEXRPMPWLVRIFE-AWEZNQCLSA-N 1 1 347.415 2.229 20 5 EEBDMO O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594420424 468579799 /nfs/dbraw/zinc/57/97/99/468579799.db2.gz TUYFNDSAPFPLDG-CABCVRRESA-N 1 1 332.404 2.140 20 5 EEBDMO O=C(Cn1cc[nH+]c1C1CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000600615624 468603969 /nfs/dbraw/zinc/60/39/69/468603969.db2.gz ZWIYERPJAFPOGX-UHFFFAOYSA-N 1 1 330.300 2.036 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000597603940 468613383 /nfs/dbraw/zinc/61/33/83/468613383.db2.gz GHBITEGTCGJVPZ-HNNXBMFYSA-N 1 1 344.415 2.492 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC[NH+]1CCC(OC)CC1 ZINC000595010706 468743133 /nfs/dbraw/zinc/74/31/33/468743133.db2.gz DJPLGTCHBLMWLU-CYBMUJFWSA-N 1 1 337.420 2.365 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1CCC([C@@H](C)CO)CC1 ZINC000593085857 468865793 /nfs/dbraw/zinc/86/57/93/468865793.db2.gz YAKPAOOQYONMMI-ZDUSSCGKSA-N 1 1 335.404 2.182 20 5 EEBDMO COC(=O)c1ccnc(N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000598587835 468923957 /nfs/dbraw/zinc/92/39/57/468923957.db2.gz DPBPQYXFSCKKLQ-NWDGAFQWSA-N 1 1 336.392 2.309 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](C)[C@@H](CO)C2)cccc1[N+](=O)[O-] ZINC000598650125 468945091 /nfs/dbraw/zinc/94/50/91/468945091.db2.gz MLBAKNFJCUIHBS-KWCYVHTRSA-N 1 1 335.404 2.181 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C)[C@@H](CO)C2)cccc1[N+](=O)[O-] ZINC000598650125 468945094 /nfs/dbraw/zinc/94/50/94/468945094.db2.gz MLBAKNFJCUIHBS-KWCYVHTRSA-N 1 1 335.404 2.181 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](C)[C@H](CO)C1 ZINC000598650914 468946476 /nfs/dbraw/zinc/94/64/76/468946476.db2.gz QCLXDWLNKIMUHM-JSGCOSHPSA-N 1 1 335.404 2.182 20 5 EEBDMO C[C@@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1CO ZINC000598675991 468955416 /nfs/dbraw/zinc/95/54/16/468955416.db2.gz CBIMVFPHHSHXFC-CZUORRHYSA-N 1 1 344.415 2.446 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000595784846 469009349 /nfs/dbraw/zinc/00/93/49/469009349.db2.gz BXXRTSBYHSTRGP-GDBMZVCRSA-N 1 1 335.404 2.038 20 5 EEBDMO COC(=O)C(C)(C)[C@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1 ZINC000602800521 469083546 /nfs/dbraw/zinc/08/35/46/469083546.db2.gz XMZVJKLLPFNSJH-ZDUSSCGKSA-N 1 1 338.408 2.011 20 5 EEBDMO O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N[C@@H]1CC[N@H+](C2CC2)C1 ZINC000596091488 469150468 /nfs/dbraw/zinc/15/04/68/469150468.db2.gz KXQIWBIWLQXNFY-OAHLLOKOSA-N 1 1 346.431 2.076 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@H+](CC[C@H]2CCS(=O)(=O)C2)C2CC2)cc1 ZINC000611211206 469193841 /nfs/dbraw/zinc/19/38/41/469193841.db2.gz CHQAQFLMICUOBJ-AWEZNQCLSA-N 1 1 338.429 2.384 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC[C@H]2CCS(=O)(=O)C2)C2CC2)cc1 ZINC000611211206 469193845 /nfs/dbraw/zinc/19/38/45/469193845.db2.gz CHQAQFLMICUOBJ-AWEZNQCLSA-N 1 1 338.429 2.384 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+](CCO)Cc1ccccc1)OCCO2 ZINC000611249537 469208510 /nfs/dbraw/zinc/20/85/10/469208510.db2.gz NMRPXFZIIDSAJH-UHFFFAOYSA-N 1 1 344.367 2.361 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+](CCO)Cc1ccccc1)OCCO2 ZINC000611249537 469208516 /nfs/dbraw/zinc/20/85/16/469208516.db2.gz NMRPXFZIIDSAJH-UHFFFAOYSA-N 1 1 344.367 2.361 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21 ZINC000602997567 469213548 /nfs/dbraw/zinc/21/35/48/469213548.db2.gz MZKAMAGUHRSTPM-XIRDDKMYSA-N 1 1 347.415 2.467 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21 ZINC000602997567 469213552 /nfs/dbraw/zinc/21/35/52/469213552.db2.gz MZKAMAGUHRSTPM-XIRDDKMYSA-N 1 1 347.415 2.467 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000611285409 469220051 /nfs/dbraw/zinc/22/00/51/469220051.db2.gz VSHDELSHCMANOQ-CABCVRRESA-N 1 1 347.415 2.425 20 5 EEBDMO CN(Cc1csc([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000611374163 469237153 /nfs/dbraw/zinc/23/71/53/469237153.db2.gz MYTSTIVMEUVRSF-HNNXBMFYSA-N 1 1 338.477 2.257 20 5 EEBDMO CN(Cc1csc([N+](=O)[O-])c1)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000611374163 469237157 /nfs/dbraw/zinc/23/71/57/469237157.db2.gz MYTSTIVMEUVRSF-HNNXBMFYSA-N 1 1 338.477 2.257 20 5 EEBDMO O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCCN(c2cc[nH+]cc2)CC1 ZINC000603083846 469255113 /nfs/dbraw/zinc/25/51/13/469255113.db2.gz MYFAJEFCKDFCJV-UHFFFAOYSA-N 1 1 342.355 2.048 20 5 EEBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000611554188 469277486 /nfs/dbraw/zinc/27/74/86/469277486.db2.gz HRDONQMJVLTIAA-GHMZBOCLSA-N 1 1 333.310 2.419 20 5 EEBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2c2ncnc3ccc([N+](=O)[O-])cc32)C1 ZINC000611712261 469307449 /nfs/dbraw/zinc/30/74/49/469307449.db2.gz ZCLGUMVPSQEJMH-WBMJQRKESA-N 1 1 327.388 2.459 20 5 EEBDMO COCC[N@@H+]1CC[C@H](NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602546745 469356384 /nfs/dbraw/zinc/35/63/84/469356384.db2.gz KRPHAHQQIRIPCX-ZDUSSCGKSA-N 1 1 347.337 2.424 20 5 EEBDMO COCC[N@H+]1CC[C@H](NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602546745 469356389 /nfs/dbraw/zinc/35/63/89/469356389.db2.gz KRPHAHQQIRIPCX-ZDUSSCGKSA-N 1 1 347.337 2.424 20 5 EEBDMO COc1ccc(OC[C@@H](O)C[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000616178575 469391773 /nfs/dbraw/zinc/39/17/73/469391773.db2.gz XFVPCZZAHOKRBO-HNNXBMFYSA-N 1 1 346.383 2.475 20 5 EEBDMO O=[N+]([O-])c1ccccc1OCCN1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000603848403 469436202 /nfs/dbraw/zinc/43/62/02/469436202.db2.gz SADVLJOQYZKQOD-MRXNPFEDSA-N 1 1 349.431 2.160 20 5 EEBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H]1CNc2ccnn2C1)C1CC1 ZINC000619264445 469562637 /nfs/dbraw/zinc/56/26/37/469562637.db2.gz FKDZEVCWNOVBCC-CYBMUJFWSA-N 1 1 327.388 2.498 20 5 EEBDMO C[NH+](C)[C@@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000609461256 469929911 /nfs/dbraw/zinc/92/99/11/469929911.db2.gz UNWGUMWDMMCPIP-QGZVFWFLSA-N 1 1 343.383 2.393 20 5 EEBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)[N@@H+](C)Cc1ccccc1 ZINC000609506196 469934781 /nfs/dbraw/zinc/93/47/81/469934781.db2.gz LRYIVMPJIKGOCL-ZDUSSCGKSA-N 1 1 330.388 2.184 20 5 EEBDMO Cc1c(C(=O)NC(C)(C)CCN2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000184175291 533774004 /nfs/dbraw/zinc/77/40/04/533774004.db2.gz FJPFJBIGICRWHT-UHFFFAOYSA-N 1 1 348.447 2.049 20 5 EEBDMO Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000180885596 534740777 /nfs/dbraw/zinc/74/07/77/534740777.db2.gz AAAUASIEQVGIOQ-CQSZACIVSA-N 1 1 344.371 2.337 20 5 EEBDMO C[N@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000356634703 536180264 /nfs/dbraw/zinc/18/02/64/536180264.db2.gz NIPWVERZTGFAMY-ZDUSSCGKSA-N 1 1 333.388 2.104 20 5 EEBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000356634703 536180269 /nfs/dbraw/zinc/18/02/69/536180269.db2.gz NIPWVERZTGFAMY-ZDUSSCGKSA-N 1 1 333.388 2.104 20 5 EEBDMO C[C@H]1C[C@H](NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000742309576 577870784 /nfs/dbraw/zinc/87/07/84/577870784.db2.gz POIUPWOWXYRQFU-GXSJLCMTSA-N 1 1 347.824 2.009 20 5 EEBDMO COC(=O)C[C@@H]1CCCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000745438599 577913884 /nfs/dbraw/zinc/91/38/84/577913884.db2.gz XSSORQBLPXCOCJ-ZDUSSCGKSA-N 1 1 332.360 2.320 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1 ZINC000749958489 577984758 /nfs/dbraw/zinc/98/47/58/577984758.db2.gz DPQYSCDLCXPETO-CQSZACIVSA-N 1 1 346.435 2.269 20 5 EEBDMO CC(C)[C@H](C(=O)OCC(=O)c1cccc([N+](=O)[O-])c1)[NH+]1CCCC1 ZINC000741015016 578111120 /nfs/dbraw/zinc/11/11/20/578111120.db2.gz VKSBLKSQLLWOIS-MRXNPFEDSA-N 1 1 334.372 2.441 20 5 EEBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cc(-c2nn[nH]n2)ccc1F ZINC000823648604 599459058 /nfs/dbraw/zinc/45/90/58/599459058.db2.gz YLOWQJJLKRESDZ-UHFFFAOYSA-N 1 1 328.307 2.204 20 5 EEBDMO COC(=O)CC(C)(C)[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000177921001 681589957 /nfs/dbraw/zinc/58/99/57/681589957.db2.gz DOANOVNLONMZFM-UHFFFAOYSA-N 1 1 334.332 2.076 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](N(C)c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C1 ZINC000894131176 681624005 /nfs/dbraw/zinc/62/40/05/681624005.db2.gz OWNVZWDRXUEZIG-CYBMUJFWSA-N 1 1 344.415 2.366 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)ccc1CN[C@H]1CCC[N@@H+](CCCO)C1 ZINC000894674053 683023569 /nfs/dbraw/zinc/02/35/69/683023569.db2.gz SHUPOOJPEZINSC-AWEZNQCLSA-N 1 1 327.812 2.185 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)ccc1CN[C@H]1CCC[N@H+](CCCO)C1 ZINC000894674053 683023573 /nfs/dbraw/zinc/02/35/73/683023573.db2.gz SHUPOOJPEZINSC-AWEZNQCLSA-N 1 1 327.812 2.185 20 5 EEBDMO CC(C)c1ccccc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC000983656282 683080569 /nfs/dbraw/zinc/08/05/69/683080569.db2.gz AHXLRWLREOELPC-MOIQIXESSA-N 1 1 345.443 2.460 20 5 EEBDMO Cc1[nH]ccc1C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21 ZINC001025729124 683251516 /nfs/dbraw/zinc/25/15/16/683251516.db2.gz GMCNQQTXVLVBGM-FVQHAEBGSA-N 1 1 340.383 2.092 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21)[C@H]1C[C@H]2C[C@H]2C1 ZINC001025962981 683691267 /nfs/dbraw/zinc/69/12/67/683691267.db2.gz WPERNTVFWXGYOR-HIIFRAMHSA-N 1 1 341.411 2.187 20 5 EEBDMO C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@@H](O)Cc1ccccc1 ZINC000814649069 1199643163 /nfs/dbraw/zinc/64/31/63/1199643163.db2.gz IUSGUHYCRGLOSS-ROUUACIJSA-N 1 1 330.384 2.164 20 5 EEBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000810843452 1199775657 /nfs/dbraw/zinc/77/56/57/1199775657.db2.gz FWGRLBDONSDWES-AAEUAGOBSA-N 1 1 348.355 2.150 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1C[C@@H](O)c1ccco1 ZINC000878188752 1200311325 /nfs/dbraw/zinc/31/13/25/1200311325.db2.gz NYQCORBYNVTOHB-UONOGXRCSA-N 1 1 334.376 2.281 20 5 EEBDMO COc1ccc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])s3)CC[NH2+]2)cc1 ZINC000870138151 1200498963 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C[C@@H](CNC(=O)COc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1C ZINC000032730718 463390358 /nfs/dbraw/zinc/39/03/58/463390358.db2.gz ZTYLLFOTBHDYCF-KGLIPLIRSA-N 1 1 335.404 2.353 20 5 EEBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000124302805 463407332 /nfs/dbraw/zinc/40/73/32/463407332.db2.gz CFYRHRSMRLANQL-CYBMUJFWSA-N 1 1 334.420 2.275 20 5 EEBDMO CCC(C)(C)NC(=O)[C@H](C)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000071912064 463469959 /nfs/dbraw/zinc/46/99/59/463469959.db2.gz IWWWUDUKSBJWLB-STQMWFEESA-N 1 1 349.435 2.169 20 5 EEBDMO CCC(C)(C)NC(=O)[C@H](C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000071912064 463469964 /nfs/dbraw/zinc/46/99/64/463469964.db2.gz IWWWUDUKSBJWLB-STQMWFEESA-N 1 1 349.435 2.169 20 5 EEBDMO C[C@@H](CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000071954271 463478751 /nfs/dbraw/zinc/47/87/51/463478751.db2.gz GOJIEPNTZQJVCW-NEPJUHHUSA-N 1 1 345.403 2.364 20 5 EEBDMO COCC[N@@H+](C)CCCNC(=O)c1cc(SC)ccc1[N+](=O)[O-] 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C[N@H+]1CC[C@@H]2CN(c3ncc([N+](=O)[O-])cc3Br)C[C@@H]2C1 ZINC000601183644 468774450 /nfs/dbraw/zinc/77/44/50/468774450.db2.gz AGHFJYJTOWGIKP-ZJUUUORDSA-N 1 1 341.209 2.140 20 5 EEBDMO Cc1[nH+]c2c(n1CCO)CC[C@@H](Nc1ccc([N+](=O)[O-])c(C)c1)C2 ZINC000601184295 468774577 /nfs/dbraw/zinc/77/45/77/468774577.db2.gz IXQBYIXZBYDCGS-CQSZACIVSA-N 1 1 330.388 2.370 20 5 EEBDMO Cc1noc(C[N@@H+]2CC[C@](CO)(Cc3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000595492051 468875028 /nfs/dbraw/zinc/87/50/28/468875028.db2.gz ZSHRWFRYZJPPLU-KRWDZBQOSA-N 1 1 349.362 2.457 20 5 EEBDMO Cc1noc(C[N@H+]2CC[C@](CO)(Cc3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000595492051 468875030 /nfs/dbraw/zinc/87/50/30/468875030.db2.gz ZSHRWFRYZJPPLU-KRWDZBQOSA-N 1 1 349.362 2.457 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC000595504431 468879971 /nfs/dbraw/zinc/87/99/71/468879971.db2.gz JAVNYKACVFGJLJ-GOSISDBHSA-N 1 1 346.431 2.259 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000595505170 468880958 /nfs/dbraw/zinc/88/09/58/468880958.db2.gz QFTRQKTWPCVLJY-KSSFIOAISA-N 1 1 346.431 2.340 20 5 EEBDMO CNc1ccc(C(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000598560442 468913827 /nfs/dbraw/zinc/91/38/27/468913827.db2.gz LXZTZKLYWJEZHY-CQSZACIVSA-N 1 1 346.431 2.488 20 5 EEBDMO CC(C)(C)C[N@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)OC(C)(C)C ZINC000595827930 469030483 /nfs/dbraw/zinc/03/04/83/469030483.db2.gz TXFLFYKXXPPMAD-UHFFFAOYSA-N 1 1 340.424 2.481 20 5 EEBDMO CC(C)(C)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)OC(C)(C)C ZINC000595827930 469030484 /nfs/dbraw/zinc/03/04/84/469030484.db2.gz TXFLFYKXXPPMAD-UHFFFAOYSA-N 1 1 340.424 2.481 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cc4cnccc4o3)CC2)cn1 ZINC000593565084 469038739 /nfs/dbraw/zinc/03/87/39/469038739.db2.gz ALZAGEPMDTVOCO-UHFFFAOYSA-N 1 1 339.355 2.453 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)CC(=O)Nc1c(C)cccc1C ZINC000610695070 469042612 /nfs/dbraw/zinc/04/26/12/469042612.db2.gz PTFCTSOUEGEHSY-UHFFFAOYSA-N 1 1 345.403 2.287 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)CC(=O)Nc1c(C)cccc1C ZINC000610695070 469042619 /nfs/dbraw/zinc/04/26/19/469042619.db2.gz PTFCTSOUEGEHSY-UHFFFAOYSA-N 1 1 345.403 2.287 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000610714609 469047572 /nfs/dbraw/zinc/04/75/72/469047572.db2.gz VMHKVZIXJSLRAW-QLJPJBMISA-N 1 1 328.372 2.289 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)[C@](C)(CO)C1 ZINC000595870094 469053950 /nfs/dbraw/zinc/05/39/50/469053950.db2.gz GAYUMLKJLIDAFW-DYVFJYSZSA-N 1 1 335.404 2.182 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)[C@](C)(CO)C2)cccc1[N+](=O)[O-] ZINC000595870535 469054826 /nfs/dbraw/zinc/05/48/26/469054826.db2.gz HGRVSTAIJXFOIZ-SJCJKPOMSA-N 1 1 335.404 2.182 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H](C3CCCCC3)C2)c1 ZINC000595881741 469062437 /nfs/dbraw/zinc/06/24/37/469062437.db2.gz VNICZRBQBGGQEG-RDJZCZTQSA-N 1 1 336.436 2.445 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000602773296 469064779 /nfs/dbraw/zinc/06/47/79/469064779.db2.gz ZWEVOOSXQJFGEQ-INIZCTEOSA-N 1 1 330.388 2.346 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H](CC(=O)OC(C)C)C1 ZINC000602812783 469091927 /nfs/dbraw/zinc/09/19/27/469091927.db2.gz ZPJBOXCHLUDPEC-AWEZNQCLSA-N 1 1 338.408 2.153 20 5 EEBDMO Cc1c(CNC(=O)NC[C@@H]2CCCC[N@H+](C)C2)cccc1[N+](=O)[O-] ZINC000599040603 469096053 /nfs/dbraw/zinc/09/60/53/469096053.db2.gz LMIUSVPTHFANIW-AWEZNQCLSA-N 1 1 334.420 2.434 20 5 EEBDMO CCO[C@H]1C[C@](CO)([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C1(C)C ZINC000614926374 469096117 /nfs/dbraw/zinc/09/61/17/469096117.db2.gz UEUSFGOKKZGUSE-WMLDXEAASA-N 1 1 349.387 2.392 20 5 EEBDMO Cc1ccc(NCCCNc2cc(CO)cc(C)[nH+]2)c([N+](=O)[O-])c1 ZINC000596136980 469171728 /nfs/dbraw/zinc/17/17/28/469171728.db2.gz ZEVZSBNRLSXIJV-UHFFFAOYSA-N 1 1 330.388 3.013 20 5 EEBDMO CCCc1[nH]nc(C(=O)N(C)[C@H](C)C2CC[NH+](C)CC2)c1[N+](=O)[O-] ZINC000563195806 469193798 /nfs/dbraw/zinc/19/37/98/469193798.db2.gz UFZLYRUNQBJLBZ-LLVKDONJSA-N 1 1 337.424 2.073 20 5 EEBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1 ZINC000611244104 469207801 /nfs/dbraw/zinc/20/78/01/469207801.db2.gz AXGLRTQEFNGFKB-CXAGYDPISA-N 1 1 346.431 2.070 20 5 EEBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(N2CCC[C@@H]2C(N)=O)CC1 ZINC000611244104 469207806 /nfs/dbraw/zinc/20/78/06/469207806.db2.gz AXGLRTQEFNGFKB-CXAGYDPISA-N 1 1 346.431 2.070 20 5 EEBDMO C[C@@H]1C[C@H](N2CCOCC2)C[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000589187843 469210256 /nfs/dbraw/zinc/21/02/56/469210256.db2.gz ZGXYIIRRDLMVGH-AAQZWPSQSA-N 1 1 331.416 2.403 20 5 EEBDMO CC(C)[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)C(=O)N1CCCC1 ZINC000611395861 469240910 /nfs/dbraw/zinc/24/09/10/469240910.db2.gz UZTXVXSPAIKSSQ-INIZCTEOSA-N 1 1 346.387 2.473 20 5 EEBDMO O=[N+]([O-])c1ccc2ncnc(NC[C@H]3CCC[N@@H+](CC4CC4)C3)c2c1 ZINC000596571535 469304098 /nfs/dbraw/zinc/30/40/98/469304098.db2.gz VBJQNLAFQVPULO-CQSZACIVSA-N 1 1 341.415 3.072 20 5 EEBDMO CCOc1cc(Cn2cc(C[NH+]3CCCC3)nn2)ccc1[N+](=O)[O-] ZINC000603233655 469318059 /nfs/dbraw/zinc/31/80/59/469318059.db2.gz BCSHQIGNXXNQIX-UHFFFAOYSA-N 1 1 331.376 2.229 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCc2c(O)cccc2C1 ZINC000599648154 469322756 /nfs/dbraw/zinc/32/27/56/469322756.db2.gz URVBIOTXLWHKAU-AWEZNQCLSA-N 1 1 344.367 2.098 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCc2c(O)cccc2C1 ZINC000599648154 469322760 /nfs/dbraw/zinc/32/27/60/469322760.db2.gz URVBIOTXLWHKAU-AWEZNQCLSA-N 1 1 344.367 2.098 20 5 EEBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000610297288 470000971 /nfs/dbraw/zinc/00/09/71/470000971.db2.gz YVRWWNJDAVABLW-HNNXBMFYSA-N 1 1 342.399 2.280 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@]23CCOC3=O)cccc1[N+](=O)[O-] ZINC000186746117 533899244 /nfs/dbraw/zinc/89/92/44/533899244.db2.gz AEXMVVKNCMSCKU-KRWDZBQOSA-N 1 1 347.371 2.013 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@]23CCOC3=O)cccc1[N+](=O)[O-] ZINC000186746117 533899250 /nfs/dbraw/zinc/89/92/50/533899250.db2.gz AEXMVVKNCMSCKU-KRWDZBQOSA-N 1 1 347.371 2.013 20 5 EEBDMO O=C(CC[N@@H+](C[C@@H]1CCOC1)C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411167310 534392784 /nfs/dbraw/zinc/39/27/84/534392784.db2.gz NXCZKKUEZFHCQZ-ZDUSSCGKSA-N 1 1 333.388 2.424 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H]2c2cccc3c2OCCO3)c1 ZINC000174843960 534889163 /nfs/dbraw/zinc/88/91/63/534889163.db2.gz MLWDTZHBFDQPKJ-HNNXBMFYSA-N 1 1 344.371 2.400 20 5 EEBDMO CC(C)C[C@@]1(CO)CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000191660630 528436819 /nfs/dbraw/zinc/43/68/19/528436819.db2.gz JBYWTKXFSMUPQJ-GOSISDBHSA-N 1 1 349.431 2.431 20 5 EEBDMO CN1C(=O)NCC12CC[NH+](Cc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000425369156 536323451 /nfs/dbraw/zinc/32/34/51/536323451.db2.gz GKAAMNTUFWINCD-UHFFFAOYSA-N 1 1 338.795 2.238 20 5 EEBDMO COc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1O ZINC000446849008 536894802 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C[C@H]1CC2(C[N@H+]1Cn1c(=O)oc3cccc([N+](=O)[O-])c31)CCOCC2 ZINC000842637745 1315741191 /nfs/dbraw/zinc/74/11/91/1315741191.db2.gz DRPAWRFWRKJPPN-LBPRGKRZSA-N 1 1 347.371 2.351 20 5 EEBDMO CC(C)Oc1ccnc(C[NH2+][C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)n1 ZINC001254598503 1318139142 /nfs/dbraw/zinc/13/91/42/1318139142.db2.gz KGQJFXHLGWTBRP-CQSZACIVSA-N 1 1 328.372 2.429 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCN(Cc3ccco3)CC1)C2 ZINC001254598531 1318139218 /nfs/dbraw/zinc/13/92/18/1318139218.db2.gz HLEQGVSRRZVZPX-KRWDZBQOSA-N 1 1 327.384 2.473 20 5 EEBDMO CCOC(=O)C(F)(F)CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001157062053 1318376501 /nfs/dbraw/zinc/37/65/01/1318376501.db2.gz SZDUZAQQMQAUHM-AATRIKPKSA-N 1 1 344.318 2.132 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](Nc2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])[C@H](C)C1 ZINC001163367002 1321106127 /nfs/dbraw/zinc/10/61/27/1321106127.db2.gz XNDSRKQNEWPLDY-GHMZBOCLSA-N 1 1 328.800 2.412 20 5 EEBDMO 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339.417 2.232 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)NC/C=C/CNc1ccc(C)cc1[N+](=O)[O-] ZINC001107425151 787200880 /nfs/dbraw/zinc/20/08/80/787200880.db2.gz OWUZPTNZMDFTSS-ONEGZZNKSA-N 1 1 343.387 2.193 20 5 EEBDMO Cc1cc(NC/C=C/CNC(=O)C[N@H+](C)C2CCC2)ccc1[N+](=O)[O-] ZINC001107564773 787664306 /nfs/dbraw/zinc/66/43/06/787664306.db2.gz GGMKBVFGONJPSB-ONEGZZNKSA-N 1 1 346.431 2.472 20 5 EEBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825111825 788442186 /nfs/dbraw/zinc/44/21/86/788442186.db2.gz PZRODKXCNHNCEU-RHSMWYFYSA-N 1 1 349.431 2.257 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)N1CCN(c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC001093166601 794799304 /nfs/dbraw/zinc/79/93/04/794799304.db2.gz OASWGEULYCQISG-UHFFFAOYSA-N 1 1 348.447 2.284 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)NCCCNc1ccc([N+](=O)[O-])c(C)c1 ZINC001094434829 796229213 /nfs/dbraw/zinc/22/92/13/796229213.db2.gz UEKHMWUKRHOENK-UHFFFAOYSA-N 1 1 331.376 2.027 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)C[NH+]1[C@H](C)CC[C@H]1C 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ZINC000174875609 231331230 /nfs/dbraw/zinc/33/12/30/231331230.db2.gz CVDQWFQYHFRCJJ-CYBMUJFWSA-N 1 1 339.823 2.402 20 5 EEBDMO O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000040513534 213330900 /nfs/dbraw/zinc/33/09/00/213330900.db2.gz YGBZNTOZQOFFJG-MRXNPFEDSA-N 1 1 348.403 2.313 20 5 EEBDMO CC[N@H+](C)C[C@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000072858166 216319193 /nfs/dbraw/zinc/31/91/93/216319193.db2.gz YZODSOFTEWRVTB-CQSZACIVSA-N 1 1 334.420 2.197 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000072858166 216319196 /nfs/dbraw/zinc/31/91/96/216319196.db2.gz YZODSOFTEWRVTB-CQSZACIVSA-N 1 1 334.420 2.197 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451416859 243106483 /nfs/dbraw/zinc/10/64/83/243106483.db2.gz KVIJTQIVFOPCHK-UAGQMJEPSA-N 1 1 347.415 2.467 20 5 EEBDMO C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@H]1CCCC[C@H]1O ZINC000245554277 243125345 /nfs/dbraw/zinc/12/53/45/243125345.db2.gz 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COCC[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C[C@H]1C ZINC000153759870 532952651 /nfs/dbraw/zinc/95/26/51/532952651.db2.gz LMDXWSXEFXCBJI-CYBMUJFWSA-N 1 1 336.392 2.088 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000270321334 256123366 /nfs/dbraw/zinc/12/33/66/256123366.db2.gz XYOPHNPCXOYNHZ-UHFFFAOYSA-N 1 1 341.371 2.330 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000270373432 256128304 /nfs/dbraw/zinc/12/83/04/256128304.db2.gz NHSUZTZFJGENMG-DIFFPNOSSA-N 1 1 342.399 2.218 20 5 EEBDMO CC[C@@H]1C[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O ZINC000270857320 256179953 /nfs/dbraw/zinc/17/99/53/256179953.db2.gz HSPVKFURXAHWBS-MISXGVKJSA-N 1 1 332.360 2.409 20 5 EEBDMO C[N@@H+]1CC=C(CNc2ccc([N+](=O)[O-])cc2N2CCOC2=O)CC1 ZINC000273914899 256338096 /nfs/dbraw/zinc/33/80/96/256338096.db2.gz IZWDDNOLPSEWBS-UHFFFAOYSA-N 1 1 332.360 2.225 20 5 EEBDMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-] ZINC000113229997 292229561 /nfs/dbraw/zinc/22/95/61/292229561.db2.gz GLFXIYLWWJSOOH-QKOWSDGPSA-N 1 1 333.363 2.442 20 5 EEBDMO CCC[N@H+]1CC[C@H](CNC(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000054510010 158962949 /nfs/dbraw/zinc/96/29/49/158962949.db2.gz NTCFNIWFKKABPY-CQSZACIVSA-N 1 1 349.435 2.038 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000081364072 159151351 /nfs/dbraw/zinc/15/13/51/159151351.db2.gz STOWFBDVORWCTC-GFCCVEGCSA-N 1 1 345.403 2.275 20 5 EEBDMO CCC[N@H+](C)C[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000081364072 159151354 /nfs/dbraw/zinc/15/13/54/159151354.db2.gz STOWFBDVORWCTC-GFCCVEGCSA-N 1 1 345.403 2.275 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000081364072 159151356 /nfs/dbraw/zinc/15/13/56/159151356.db2.gz STOWFBDVORWCTC-GFCCVEGCSA-N 1 1 345.403 2.275 20 5 EEBDMO CC(C)c1ccc(C[N@@H+]2CCc3nn(C)c(=O)cc3C2)cc1[N+](=O)[O-] ZINC000093756425 159238900 /nfs/dbraw/zinc/23/89/00/159238900.db2.gz WDRBGZNUBBTABN-UHFFFAOYSA-N 1 1 342.399 2.370 20 5 EEBDMO CC(C)c1ccc(C[N@H+]2CCc3nn(C)c(=O)cc3C2)cc1[N+](=O)[O-] ZINC000093756425 159238903 /nfs/dbraw/zinc/23/89/03/159238903.db2.gz WDRBGZNUBBTABN-UHFFFAOYSA-N 1 1 342.399 2.370 20 5 EEBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000188484260 160124558 /nfs/dbraw/zinc/12/45/58/160124558.db2.gz USZSCKOYPXAMTN-PXAZEXFGSA-N 1 1 344.415 2.266 20 5 EEBDMO COc1ccc(OCCN2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c([N+](=O)[O-])c1 ZINC000248159240 160338964 /nfs/dbraw/zinc/33/89/64/160338964.db2.gz RVYMZDVJYUGQEX-GOEBONIOSA-N 1 1 349.431 2.398 20 5 EEBDMO CC[C@]1(C)CC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000343537262 161144420 /nfs/dbraw/zinc/14/44/20/161144420.db2.gz LOWMRTZXHNDUHP-OAHLLOKOSA-N 1 1 326.418 2.491 20 5 EEBDMO CC[C@]1(C)CC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000343537262 161144421 /nfs/dbraw/zinc/14/44/21/161144421.db2.gz LOWMRTZXHNDUHP-OAHLLOKOSA-N 1 1 326.418 2.491 20 5 EEBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000345894640 161340167 /nfs/dbraw/zinc/34/01/67/161340167.db2.gz WMGFFALWPJWYLQ-GJZGRUSLSA-N 1 1 342.399 2.293 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C[C@@H]1C ZINC000345974133 161346855 /nfs/dbraw/zinc/34/68/55/161346855.db2.gz XRJIAGGZALTGIK-WDEREUQCSA-N 1 1 331.376 2.026 20 5 EEBDMO COC(=O)C(C)(C)[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000346023360 161350754 /nfs/dbraw/zinc/35/07/54/161350754.db2.gz GNPLLKUYKXWROV-UHFFFAOYSA-N 1 1 337.376 2.115 20 5 EEBDMO COC(=O)C(C)(C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000346023360 161350755 /nfs/dbraw/zinc/35/07/55/161350755.db2.gz GNPLLKUYKXWROV-UHFFFAOYSA-N 1 1 337.376 2.115 20 5 EEBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000352587178 162201069 /nfs/dbraw/zinc/20/10/69/162201069.db2.gz ZXNUYRXYOPYRCT-CYBMUJFWSA-N 1 1 343.449 2.302 20 5 EEBDMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000352855901 162314883 /nfs/dbraw/zinc/31/48/83/162314883.db2.gz DDDDDRUOZDYPNN-UHFFFAOYSA-N 1 1 339.395 2.480 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](COC(F)F)C1 ZINC000353008669 162387948 /nfs/dbraw/zinc/38/79/48/162387948.db2.gz NXNBNWVGINDSBW-WDEREUQCSA-N 1 1 343.330 2.483 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](COC(F)F)C1 ZINC000353008669 162387951 /nfs/dbraw/zinc/38/79/51/162387951.db2.gz NXNBNWVGINDSBW-WDEREUQCSA-N 1 1 343.330 2.483 20 5 EEBDMO COC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)C2 ZINC000367814670 166006533 /nfs/dbraw/zinc/00/65/33/166006533.db2.gz CGEQUZPZKIFHEX-GUYCJALGSA-N 1 1 334.372 2.379 20 5 EEBDMO COc1c(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)cccc1[N+](=O)[O-] ZINC000356248717 163379656 /nfs/dbraw/zinc/37/96/56/163379656.db2.gz DXFVLNHYUGLHQG-QGZVFWFLSA-N 1 1 333.388 2.161 20 5 EEBDMO CN(C(=O)C[NH2+][C@@H](CO)c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000359625638 164140673 /nfs/dbraw/zinc/14/06/73/164140673.db2.gz OAVZXQKJMAUKOA-INIZCTEOSA-N 1 1 347.346 2.020 20 5 EEBDMO NC(=O)c1ccc(C[N@@H+]2CCC[C@H](OCC3CC3)C2)c([N+](=O)[O-])c1 ZINC000368793561 166128913 /nfs/dbraw/zinc/12/89/13/166128913.db2.gz XRRXMOTXRZUTFH-HNNXBMFYSA-N 1 1 333.388 2.085 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H](OCC3CC3)C2)c([N+](=O)[O-])c1 ZINC000368793561 166128916 /nfs/dbraw/zinc/12/89/16/166128916.db2.gz XRRXMOTXRZUTFH-HNNXBMFYSA-N 1 1 333.388 2.085 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1ccccc1[N+](=O)[O-] ZINC000371253927 166565205 /nfs/dbraw/zinc/56/52/05/166565205.db2.gz POXBFJHMMSGQEA-VQFNDLOPSA-N 1 1 337.379 2.455 20 5 EEBDMO CCOC(=O)c1cc(N2CC[C@H](c3[nH+]ccn3C)C2)ccc1[N+](=O)[O-] ZINC000374350566 167023517 /nfs/dbraw/zinc/02/35/17/167023517.db2.gz KMADURZVBIXCQR-LBPRGKRZSA-N 1 1 344.371 2.499 20 5 EEBDMO COc1ccc(NC(=O)C[N@H+](C)CCc2ccccn2)c([N+](=O)[O-])c1 ZINC000123399898 222271814 /nfs/dbraw/zinc/27/18/14/222271814.db2.gz QSBYEMHFKKWXAO-UHFFFAOYSA-N 1 1 344.371 2.111 20 5 EEBDMO COc1ccc(NC(=O)C[N@@H+](C)CCc2ccccn2)c([N+](=O)[O-])c1 ZINC000123399898 222271815 /nfs/dbraw/zinc/27/18/15/222271815.db2.gz QSBYEMHFKKWXAO-UHFFFAOYSA-N 1 1 344.371 2.111 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(C(=O)CCCNc3ccc([N+](=O)[O-])cc3)[C@@H]2C1 ZINC000272670518 269006415 /nfs/dbraw/zinc/00/64/15/269006415.db2.gz SZJYTISOTHQRMD-WMLDXEAASA-N 1 1 346.431 2.340 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)[C@H]2C1 ZINC000272674314 269006720 /nfs/dbraw/zinc/00/67/20/269006720.db2.gz UKDWBHQHQZZZDM-ABAIWWIYSA-N 1 1 337.807 2.343 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(CCCO)CC1 ZINC000272768618 269017625 /nfs/dbraw/zinc/01/76/25/269017625.db2.gz BRDQBIUSHPZMBD-CYBMUJFWSA-N 1 1 335.404 2.406 20 5 EEBDMO CC(C)(C)[C@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1 ZINC000279067715 269260363 /nfs/dbraw/zinc/26/03/63/269260363.db2.gz ADLLMEYYJQOKQO-GOEBONIOSA-N 1 1 338.404 2.081 20 5 EEBDMO CC(C)(C)[C@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1 ZINC000279067715 269260364 /nfs/dbraw/zinc/26/03/64/269260364.db2.gz ADLLMEYYJQOKQO-GOEBONIOSA-N 1 1 338.404 2.081 20 5 EEBDMO CN(C(=O)C[N@H+]1CCC[C@]1(C)CCCO)c1ccc([N+](=O)[O-])cc1 ZINC000271184988 274122511 /nfs/dbraw/zinc/12/25/11/274122511.db2.gz IXMNOOSGCPSUMA-QGZVFWFLSA-N 1 1 335.404 2.185 20 5 EEBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](C[C@@H](O)c2ccccc2)CC1 ZINC000068047315 275040287 /nfs/dbraw/zinc/04/02/87/275040287.db2.gz OGAPHQDUJAEBJN-GOSISDBHSA-N 1 1 327.384 2.450 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000289262789 275106576 /nfs/dbraw/zinc/10/65/76/275106576.db2.gz DGDBGFQOXITEJR-OAHLLOKOSA-N 1 1 340.383 2.468 20 5 EEBDMO CN(C)CC[N@@H+](C)CCCN(C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000289479175 275119771 /nfs/dbraw/zinc/11/97/71/275119771.db2.gz RNSGCTVPQFCBDY-UHFFFAOYSA-N 1 1 344.406 2.188 20 5 EEBDMO CN(CCCN(C)Cc1c(F)cc([N+](=O)[O-])cc1F)CC[NH+](C)C ZINC000289479175 275119772 /nfs/dbraw/zinc/11/97/72/275119772.db2.gz RNSGCTVPQFCBDY-UHFFFAOYSA-N 1 1 344.406 2.188 20 5 EEBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)Nc1n[nH]c3ccc([N+](=O)[O-])cc31)C2 ZINC000291439385 275305449 /nfs/dbraw/zinc/30/54/49/275305449.db2.gz MEDXBYVRNITITO-SNVBAGLBSA-N 1 1 340.343 2.177 20 5 EEBDMO CC[N@@H+](CCNC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)C(C)C ZINC000338833142 276127298 /nfs/dbraw/zinc/12/72/98/276127298.db2.gz ZBAVRQISOFCUQG-UHFFFAOYSA-N 1 1 338.408 2.133 20 5 EEBDMO CC[N@@H+](CCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000077389527 276131228 /nfs/dbraw/zinc/13/12/28/276131228.db2.gz FUFDVZLJQKGCME-UHFFFAOYSA-N 1 1 347.824 2.011 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C1CC1 ZINC000078496212 276348562 /nfs/dbraw/zinc/34/85/62/276348562.db2.gz SZPPBMJJCDPUME-UHFFFAOYSA-N 1 1 346.431 2.409 20 5 EEBDMO Cc1ccccc1[C@H]([C@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-])[NH+](C)C ZINC000357857830 281389225 /nfs/dbraw/zinc/38/92/25/281389225.db2.gz GNEJKVOUQIHGHE-NHYWBVRUSA-N 1 1 331.376 2.048 20 5 EEBDMO CC[C@H](C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC1 ZINC000296809825 294073199 /nfs/dbraw/zinc/07/31/99/294073199.db2.gz FIHNAALYRLXBIW-NSHDSACASA-N 1 1 336.348 2.059 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCCCN1CC[NH+](C)CC1 ZINC000163195395 311382586 /nfs/dbraw/zinc/38/25/86/311382586.db2.gz UVKBTZCSHXATLP-UHFFFAOYSA-N 1 1 349.435 2.052 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@]2(O)CCCC[C@H]2C1 ZINC000332485388 312014755 /nfs/dbraw/zinc/01/47/55/312014755.db2.gz NKTBHVODBWJLHN-KBXCAEBGSA-N 1 1 347.415 2.469 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@]2(O)CCCC[C@H]2C1 ZINC000332485388 312014757 /nfs/dbraw/zinc/01/47/57/312014757.db2.gz NKTBHVODBWJLHN-KBXCAEBGSA-N 1 1 347.415 2.469 20 5 EEBDMO O=C1[C@H]([N@H+]2CCC[C@H](CCO)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000421009552 314023369 /nfs/dbraw/zinc/02/33/69/314023369.db2.gz FLXAUVLHCQWUFT-WMLDXEAASA-N 1 1 347.415 2.185 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC([N@@H+](C)CCCO)CC1 ZINC000421793778 314165385 /nfs/dbraw/zinc/16/53/85/314165385.db2.gz YDURAQBDYPEGJL-UHFFFAOYSA-N 1 1 349.431 2.130 20 5 EEBDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000443600533 315251581 /nfs/dbraw/zinc/25/15/81/315251581.db2.gz DNYYYUCUINYXPI-ZDUSSCGKSA-N 1 1 335.408 2.044 20 5 EEBDMO COc1ccc(NC(=O)NC[C@@H]2CC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000542964556 318148651 /nfs/dbraw/zinc/14/86/51/318148651.db2.gz RMGBDRCYZPVQPO-LBPRGKRZSA-N 1 1 336.392 2.455 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@H]2OCC[C@@H]2C1 ZINC000576155778 320146142 /nfs/dbraw/zinc/14/61/42/320146142.db2.gz GBFOULBJHWFNOT-DOMZBBRYSA-N 1 1 347.371 2.004 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCn2c(C)[nH+]cc2C1 ZINC000576350388 320164169 /nfs/dbraw/zinc/16/41/69/320164169.db2.gz ZJHWDZQFGUXQBJ-NSHDSACASA-N 1 1 329.360 2.343 20 5 EEBDMO CCN(C)C(=O)[C@@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])C(C)C ZINC000296120919 465087000 /nfs/dbraw/zinc/08/70/00/465087000.db2.gz FMVCCHUKUYCFOZ-HNNXBMFYSA-N 1 1 341.383 2.335 20 5 EEBDMO CC[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc2c(c1)OCCO2 ZINC000341582350 465243379 /nfs/dbraw/zinc/24/33/79/465243379.db2.gz BLMQORGYXQOYFV-LBPRGKRZSA-N 1 1 332.360 2.340 20 5 EEBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](CC[C@H](O)c2ccccc2)CC1 ZINC000298095353 465299662 /nfs/dbraw/zinc/29/96/62/465299662.db2.gz MYOPRLFARWDYQF-KRWDZBQOSA-N 1 1 342.399 2.236 20 5 EEBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)[N@@H+]1CCc2sccc2C1 ZINC000046063331 462643685 /nfs/dbraw/zinc/64/36/85/462643685.db2.gz XUHYZIPWFSOUOY-SNVBAGLBSA-N 1 1 334.401 2.161 20 5 EEBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)[N@H+]1CCc2sccc2C1 ZINC000046063331 462643692 /nfs/dbraw/zinc/64/36/92/462643692.db2.gz XUHYZIPWFSOUOY-SNVBAGLBSA-N 1 1 334.401 2.161 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000063692811 462662362 /nfs/dbraw/zinc/66/23/62/462662362.db2.gz CXDFUTCIIGAPIP-NSHDSACASA-N 1 1 338.383 2.166 20 5 EEBDMO C[N@H+](CC(=O)NCCNc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000064384790 462699970 /nfs/dbraw/zinc/69/99/70/462699970.db2.gz DCZXZSGBCMEORK-UHFFFAOYSA-N 1 1 342.399 2.255 20 5 EEBDMO C[N@@H+](CC(=O)NCCNc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000064384790 462699976 /nfs/dbraw/zinc/69/99/76/462699976.db2.gz DCZXZSGBCMEORK-UHFFFAOYSA-N 1 1 342.399 2.255 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC(C)(C)[NH+]1CCN(C)CC1 ZINC000075955160 462778173 /nfs/dbraw/zinc/77/81/73/462778173.db2.gz RHPLJNRIPHFJEI-UHFFFAOYSA-N 1 1 349.435 2.051 20 5 EEBDMO COc1ccc(NC(=O)C[N@@H+](C[C@H]2CCOC2)C2CC2)c([N+](=O)[O-])c1 ZINC000047405773 462778656 /nfs/dbraw/zinc/77/86/56/462778656.db2.gz AZKDOMSCGSIHHF-GFCCVEGCSA-N 1 1 349.387 2.043 20 5 EEBDMO CC(C)NC(=O)c1ccc(NC[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1 ZINC000091482623 462883744 /nfs/dbraw/zinc/88/37/44/462883744.db2.gz AQHVFPMSSMXTLC-ZDUSSCGKSA-N 1 1 334.420 2.487 20 5 EEBDMO NC(=O)c1ccc(N2CC[NH+](Cc3ccsc3)CC2)c([N+](=O)[O-])c1 ZINC000015143472 462943021 /nfs/dbraw/zinc/94/30/21/462943021.db2.gz QHWDWDKJQLIVGJ-UHFFFAOYSA-N 1 1 346.412 2.077 20 5 EEBDMO COCC[N@H+]1CCC[C@@H](NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)C1 ZINC000094123181 463059858 /nfs/dbraw/zinc/05/98/58/463059858.db2.gz MSGOBQFQNQKKEZ-OAHLLOKOSA-N 1 1 349.431 2.361 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000068421172 463133000 /nfs/dbraw/zinc/13/30/00/463133000.db2.gz WLIWOMISEBAADF-OAHLLOKOSA-N 1 1 330.388 2.150 20 5 EEBDMO COc1ccccc1[C@H]([NH3+])C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000157470566 463135402 /nfs/dbraw/zinc/13/54/02/463135402.db2.gz GQTWKUXXLRFDBQ-KRWDZBQOSA-N 1 1 341.367 2.188 20 5 EEBDMO Cc1ccc(C(=O)NC[C@H](CC(C)C)[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000026061199 463148492 /nfs/dbraw/zinc/14/84/92/463148492.db2.gz BQYBJFQVDAHVGB-INIZCTEOSA-N 1 1 349.431 2.380 20 5 EEBDMO CSC[C@H]1CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000135424390 463154289 /nfs/dbraw/zinc/15/42/89/463154289.db2.gz JDXLXFYUBZQJBZ-CQSZACIVSA-N 1 1 335.429 2.311 20 5 EEBDMO O=[N+]([O-])c1cnn(CCN2CCC[N@@H+](CC3CCCCC3)CC2)c1 ZINC000157750845 463166214 /nfs/dbraw/zinc/16/62/14/463166214.db2.gz CILPBEUPXROZOO-UHFFFAOYSA-N 1 1 335.452 2.379 20 5 EEBDMO C[N@H+](CCOc1ccccc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027347884 463188596 /nfs/dbraw/zinc/18/85/96/463188596.db2.gz XSWAQJHZOCWTHU-UHFFFAOYSA-N 1 1 329.356 2.205 20 5 EEBDMO C[N@@H+](CCOc1ccccc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027347884 463188603 /nfs/dbraw/zinc/18/86/03/463188603.db2.gz XSWAQJHZOCWTHU-UHFFFAOYSA-N 1 1 329.356 2.205 20 5 EEBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000054646779 463251216 /nfs/dbraw/zinc/25/12/16/463251216.db2.gz SMSJFOKAOBUTTC-JKSUJKDBSA-N 1 1 332.404 2.063 20 5 EEBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000069514638 463265130 /nfs/dbraw/zinc/26/51/30/463265130.db2.gz DWEPEBQBGSTRRR-LSDHHAIUSA-N 1 1 332.404 2.140 20 5 EEBDMO Cc1ccc(N2CCC[N@H+](CC(=O)N3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000080552278 463331166 /nfs/dbraw/zinc/33/11/66/463331166.db2.gz CIKUAEUVOBLXGV-UHFFFAOYSA-N 1 1 346.431 2.038 20 5 EEBDMO Cc1ccc(N2CCC[N@@H+](CC(=O)N3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000080552278 463331173 /nfs/dbraw/zinc/33/11/73/463331173.db2.gz CIKUAEUVOBLXGV-UHFFFAOYSA-N 1 1 346.431 2.038 20 5 EEBDMO COC(=O)C[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000072579404 463522789 /nfs/dbraw/zinc/52/27/89/463522789.db2.gz FARXBHYGHKRDCJ-ZDUSSCGKSA-N 1 1 349.387 2.259 20 5 EEBDMO COC(=O)C[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000072579404 463522793 /nfs/dbraw/zinc/52/27/93/463522793.db2.gz FARXBHYGHKRDCJ-ZDUSSCGKSA-N 1 1 349.387 2.259 20 5 EEBDMO CC[NH+]1CCN(CCCCNC(=O)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000042593964 463579148 /nfs/dbraw/zinc/57/91/48/463579148.db2.gz QZWVLWDLZZLYNQ-UHFFFAOYSA-N 1 1 348.447 2.051 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000108890518 463627211 /nfs/dbraw/zinc/62/72/11/463627211.db2.gz ADOXPSWUEWVSHE-LLVKDONJSA-N 1 1 348.359 2.026 20 5 EEBDMO CC[C@@H](C)[N@@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000287221594 463838948 /nfs/dbraw/zinc/83/89/48/463838948.db2.gz FLQIOPGKZKQDEE-SNVBAGLBSA-N 1 1 329.784 2.280 20 5 EEBDMO CCOc1ccc(NC(=O)C[N@@H+](CCO)[C@H](C)CC)c([N+](=O)[O-])c1 ZINC000287236281 463842551 /nfs/dbraw/zinc/84/25/51/463842551.db2.gz GEXJEVFNUPBFKC-GFCCVEGCSA-N 1 1 339.392 2.025 20 5 EEBDMO CN(C(=O)NCCc1ccccc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000287817905 464011101 /nfs/dbraw/zinc/01/11/01/464011101.db2.gz CEEQRPXPGDWNLO-XYPWUTKMSA-N 1 1 346.431 2.404 20 5 EEBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000284291419 464139320 /nfs/dbraw/zinc/13/93/20/464139320.db2.gz GCZUMRSFMXBDGF-LLVKDONJSA-N 1 1 338.383 2.024 20 5 EEBDMO CC(C)[N@H+]1CCCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000292426203 464229519 /nfs/dbraw/zinc/22/95/19/464229519.db2.gz LQHIAZCKALSJOB-CQSZACIVSA-N 1 1 334.420 2.338 20 5 EEBDMO CNC(=O)[C@@]1(C)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000280754456 464245575 /nfs/dbraw/zinc/24/55/75/464245575.db2.gz BZYYTOKCOQTDTR-HNNXBMFYSA-N 1 1 343.330 2.154 20 5 EEBDMO NC(=O)N[C@@H]1CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000270577836 464260658 /nfs/dbraw/zinc/26/06/58/464260658.db2.gz CFFJLSZIAZMOSS-CQSZACIVSA-N 1 1 337.379 2.189 20 5 EEBDMO C[C@H](O)[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000264445157 464328382 /nfs/dbraw/zinc/32/83/82/464328382.db2.gz RIVZOJYZXWNGPF-SMDDNHRTSA-N 1 1 332.360 2.380 20 5 EEBDMO COc1ccc(NC(=O)C[N@H+](C)CCCSC)c([N+](=O)[O-])c1 ZINC000281538449 464495366 /nfs/dbraw/zinc/49/53/66/464495366.db2.gz WQRRHLJVYFATLT-UHFFFAOYSA-N 1 1 327.406 2.227 20 5 EEBDMO COc1ccc(NC(=O)C[N@@H+](C)CCCSC)c([N+](=O)[O-])c1 ZINC000281538449 464495368 /nfs/dbraw/zinc/49/53/68/464495368.db2.gz WQRRHLJVYFATLT-UHFFFAOYSA-N 1 1 327.406 2.227 20 5 EEBDMO C[N@@H+]1CC[C@H]2CCN(c3ncc([N+](=O)[O-])cc3Br)[C@H]2C1 ZINC000272166831 464503443 /nfs/dbraw/zinc/50/34/43/464503443.db2.gz GZYXINPETAKSQP-CABZTGNLSA-N 1 1 341.209 2.283 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(c3ncc([N+](=O)[O-])cc3Br)[C@H]2C1 ZINC000272166831 464503447 /nfs/dbraw/zinc/50/34/47/464503447.db2.gz GZYXINPETAKSQP-CABZTGNLSA-N 1 1 341.209 2.283 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CN(C)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000175392218 464538852 /nfs/dbraw/zinc/53/88/52/464538852.db2.gz AYTXQAKXIRSBPL-CYBMUJFWSA-N 1 1 341.433 2.008 20 5 EEBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)CCC(C)(C)[N+](=O)[O-] ZINC000294702775 464579578 /nfs/dbraw/zinc/57/95/78/464579578.db2.gz ZCILGIJXISXOCW-UHFFFAOYSA-N 1 1 331.376 2.027 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000182136880 464580199 /nfs/dbraw/zinc/58/01/99/464580199.db2.gz ULEGJTPTJAQKFO-NWDGAFQWSA-N 1 1 327.812 2.135 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+](Cc1ccccn1)C1CC1 ZINC000182178906 464592097 /nfs/dbraw/zinc/59/20/97/464592097.db2.gz VVVDFSOAARMCFJ-MRXNPFEDSA-N 1 1 343.383 2.394 20 5 EEBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H](O)C(F)(F)F ZINC000282067273 464687837 /nfs/dbraw/zinc/68/78/37/464687837.db2.gz NANHTSIAISMMGD-GFCCVEGCSA-N 1 1 349.309 2.169 20 5 EEBDMO COC[C@]1(C(=O)OC)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000295137981 464718680 /nfs/dbraw/zinc/71/86/80/464718680.db2.gz ZAULZPDOUMPTHY-HNNXBMFYSA-N 1 1 342.779 2.260 20 5 EEBDMO COC[C@]1(C(=O)OC)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000295137981 464718684 /nfs/dbraw/zinc/71/86/84/464718684.db2.gz ZAULZPDOUMPTHY-HNNXBMFYSA-N 1 1 342.779 2.260 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@H]2c2ccccc2)c1 ZINC000273870667 464726530 /nfs/dbraw/zinc/72/65/30/464726530.db2.gz QAQJLXZRBXXHCQ-SJORKVTESA-N 1 1 330.388 2.379 20 5 EEBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1(CO)CCOCC1 ZINC000191018064 464763046 /nfs/dbraw/zinc/76/30/46/464763046.db2.gz LDEOXQTVBHSTJK-UHFFFAOYSA-N 1 1 347.371 2.223 20 5 EEBDMO Cc1cc(NC(=O)CC[N@H+](C)CCc2cccc([N+](=O)[O-])c2)no1 ZINC000282346134 464783777 /nfs/dbraw/zinc/78/37/77/464783777.db2.gz CGIUVPQKNDCISM-UHFFFAOYSA-N 1 1 332.360 2.394 20 5 EEBDMO CCCCOCCNC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282443833 464821543 /nfs/dbraw/zinc/82/15/43/464821543.db2.gz LCSGYMYBVWGOSH-UHFFFAOYSA-N 1 1 337.420 2.002 20 5 EEBDMO CCCCOCCNC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282443833 464821551 /nfs/dbraw/zinc/82/15/51/464821551.db2.gz LCSGYMYBVWGOSH-UHFFFAOYSA-N 1 1 337.420 2.002 20 5 EEBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H](C(F)(F)F)[C@H](CO)C2)cc1 ZINC000286354584 464889716 /nfs/dbraw/zinc/88/97/16/464889716.db2.gz FSQPYPARZFNQAK-FZMZJTMJSA-N 1 1 348.321 2.466 20 5 EEBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H](C(F)(F)F)[C@H](CO)C2)cc1 ZINC000286354608 464890331 /nfs/dbraw/zinc/89/03/31/464890331.db2.gz FSQPYPARZFNQAK-SMDDNHRTSA-N 1 1 348.321 2.466 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)[C@@H]1CCC[C@H]1O 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466230116 /nfs/dbraw/zinc/23/01/16/466230116.db2.gz CHOZLOCMIVYKPA-UHFFFAOYSA-N 1 1 335.389 2.020 20 5 EEBDMO Cc1cc(C)c(S(=O)(=O)N[C@H](C)C[N@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000349785898 466239891 /nfs/dbraw/zinc/23/98/91/466239891.db2.gz WASHIVOCGCHIKP-CYBMUJFWSA-N 1 1 343.449 2.219 20 5 EEBDMO C[C@H]1CC[C@@H]([N@@H+](CCO)Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000331940760 466316135 /nfs/dbraw/zinc/31/61/35/466316135.db2.gz LWYOFLABSHINRH-SWLSCSKDSA-N 1 1 336.388 2.444 20 5 EEBDMO COc1cccc(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-] ZINC000331975098 466330415 /nfs/dbraw/zinc/33/04/15/466330415.db2.gz SWYXFHLXMJSVBI-GFCCVEGCSA-N 1 1 333.388 2.350 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C ZINC000332019774 466349354 /nfs/dbraw/zinc/34/93/54/466349354.db2.gz FYLMSSCLXVOJCC-DGCLKSJQSA-N 1 1 330.388 2.218 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H]1C[C@@H](C)O ZINC000305202072 466377836 /nfs/dbraw/zinc/37/78/36/466377836.db2.gz 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348.491 2.387 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]CCC(C)(C)CO)c1cccc([N+](=O)[O-])c1 ZINC000449408022 467640840 /nfs/dbraw/zinc/64/08/40/467640840.db2.gz KWPADYSJXGACFA-OAHLLOKOSA-N 1 1 332.404 2.416 20 5 EEBDMO Cc1nc(N2CC[C@@H](n3c[nH+]c4c3CCCC4)C2)ncc1[N+](=O)[O-] ZINC000450456023 467853083 /nfs/dbraw/zinc/85/30/83/467853083.db2.gz WIGOEWUQLFWXDF-GFCCVEGCSA-N 1 1 328.376 2.220 20 5 EEBDMO CCC(=O)c1ccc(NC[C@H]2CCC[N@H+]2CCCO)c([N+](=O)[O-])c1 ZINC000450602045 467877800 /nfs/dbraw/zinc/87/78/00/467877800.db2.gz ZORIMMCWPVOFGM-CQSZACIVSA-N 1 1 335.404 2.446 20 5 EEBDMO C[C@H]1C[N@@H+](CCCNC(=O)/C=C\c2cccc([N+](=O)[O-])c2)CCCO1 ZINC000493352097 467892804 /nfs/dbraw/zinc/89/28/04/467892804.db2.gz MIHMKKAZVVSWMZ-LZNQSLFOSA-N 1 1 347.415 2.225 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCc3ccccc3F)CC2)cn1 ZINC000582700126 468578705 /nfs/dbraw/zinc/57/87/05/468578705.db2.gz YXUXDTUMWPUUHA-UHFFFAOYSA-N 1 1 330.363 2.494 20 5 EEBDMO CNC(=O)c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 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Cc1c[nH+]cn1CC(=O)NCC1(Nc2ccccc2[N+](=O)[O-])CCC1 ZINC001111871198 1304031006 /nfs/dbraw/zinc/03/10/06/1304031006.db2.gz FDJHBHTTWNHQBR-UHFFFAOYSA-N 1 1 343.387 2.251 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799190971 1305180221 /nfs/dbraw/zinc/18/02/21/1305180221.db2.gz VXOZUBXADAJTFH-HUUCEWRRSA-N 1 1 343.383 2.219 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCn3cnc(CO)c3C1)CC2 ZINC001246703631 1310386795 /nfs/dbraw/zinc/38/67/95/1310386795.db2.gz KLCPKCMYGLJOGQ-HNNXBMFYSA-N 1 1 342.399 2.047 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCn3cnc(CO)c3C1)CC2 ZINC001246703631 1310386807 /nfs/dbraw/zinc/38/68/07/1310386807.db2.gz KLCPKCMYGLJOGQ-HNNXBMFYSA-N 1 1 342.399 2.047 20 5 EEBDMO COc1ccnc(-c2noc([C@@H]([NH3+])Cc3ccccc3[N+](=O)[O-])n2)c1 ZINC001247665200 1310671688 /nfs/dbraw/zinc/67/16/88/1310671688.db2.gz AGNOPJMSGOIAHL-LBPRGKRZSA-N 1 1 341.327 2.291 20 5 EEBDMO COc1cc(-c2noc([C@@H]([NH3+])Cc3ccccc3[N+](=O)[O-])n2)ccn1 ZINC001247665698 1310673257 /nfs/dbraw/zinc/67/32/57/1310673257.db2.gz IOVISZHORWCGBL-LBPRGKRZSA-N 1 1 341.327 2.291 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N[C@@H]2C[N@@H+](C3CC3)C[C@H]2C)c1F ZINC000830015640 1314523327 /nfs/dbraw/zinc/52/33/27/1314523327.db2.gz ABPIBHUXTZGJIY-MWLCHTKSSA-N 1 1 339.342 2.394 20 5 EEBDMO COC(=O)C[C@H]1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254483438 1318084478 /nfs/dbraw/zinc/08/44/78/1318084478.db2.gz UNJAGPUGHBDJTI-CQSZACIVSA-N 1 1 347.415 2.449 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]CCC2CCCCC2)CC1 ZINC001205224067 1322319902 /nfs/dbraw/zinc/31/99/02/1322319902.db2.gz LGYGFBAXDMPUKB-IAGOWNOFSA-N 1 1 337.464 2.450 20 5 EEBDMO Cc1c(Br)c(NCCc2[nH+]ccn2C)ncc1[N+](=O)[O-] ZINC000165734522 1324301100 /nfs/dbraw/zinc/30/11/00/1324301100.db2.gz WKGUYHGDOWOWMD-UHFFFAOYSA-N 1 1 340.181 2.449 20 5 EEBDMO O=[N+]([O-])c1cnccc1Nc1ccc(N2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC001307197863 1331515912 /nfs/dbraw/zinc/51/59/12/1331515912.db2.gz GKJSJFGALIBHHX-INIZCTEOSA-N 1 1 339.399 2.440 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001318829989 1332606020 /nfs/dbraw/zinc/60/60/20/1332606020.db2.gz ZDFXBOCCMVMICT-HOTGVXAUSA-N 1 1 330.388 2.247 20 5 EEBDMO CC(C)(C)[N@H+]1CCCN(c2cccc(-c3nn[nH]n3)c2[N+](=O)[O-])CC1 ZINC001589136563 1348964239 /nfs/dbraw/zinc/96/42/39/1348964239.db2.gz SIONYHSUNBKNDE-UHFFFAOYSA-N 1 1 345.407 2.086 20 5 EEBDMO O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NC[C@H]1CCCC[N@H+]1C1CC1 ZINC001593471297 1349807150 /nfs/dbraw/zinc/80/71/50/1349807150.db2.gz QPDRLTYXBIZIOZ-CYBMUJFWSA-N 1 1 343.391 2.204 20 5 EEBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1nc[nH]n1 ZINC001188695460 1368313413 /nfs/dbraw/zinc/31/34/13/1368313413.db2.gz KZERSWHJYQOANA-UHFFFAOYSA-N 1 1 348.366 2.061 20 5 EEBDMO CC(C)OCCC(=O)N1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001194926299 1368496219 /nfs/dbraw/zinc/49/62/19/1368496219.db2.gz MKULKSDOPNPGBB-UHFFFAOYSA-N 1 1 349.431 2.444 20 5 EEBDMO CC(C)OCCC(=O)N1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001194926299 1368496224 /nfs/dbraw/zinc/49/62/24/1368496224.db2.gz MKULKSDOPNPGBB-UHFFFAOYSA-N 1 1 349.431 2.444 20 5 EEBDMO CC[N@H+](C[C@@H]1CCCO1)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1 ZINC000853492137 1369340555 /nfs/dbraw/zinc/34/05/55/1369340555.db2.gz YNMUDTIVRMRXEH-ZDUSSCGKSA-N 1 1 331.376 2.312 20 5 EEBDMO CC[N@@H+](C[C@@H]1CCCO1)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1 ZINC000853492137 1369340562 /nfs/dbraw/zinc/34/05/62/1369340562.db2.gz YNMUDTIVRMRXEH-ZDUSSCGKSA-N 1 1 331.376 2.312 20 5 EEBDMO O=C(/C=C\[C@H]1CCOC1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000835458018 1372626228 /nfs/dbraw/zinc/62/62/28/1372626228.db2.gz NDYZWMHLGIGZFE-YXVLKGNQSA-N 1 1 346.383 2.305 20 5 EEBDMO O=C(/C=C\[C@H]1CCOC1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000835458018 1372626232 /nfs/dbraw/zinc/62/62/32/1372626232.db2.gz NDYZWMHLGIGZFE-YXVLKGNQSA-N 1 1 346.383 2.305 20 5 EEBDMO C[C@@H]1Cn2nc(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)cc2C[NH2+]1 ZINC001576871161 1403613646 /nfs/dbraw/zinc/61/36/46/1403613646.db2.gz MCPCNLKVQXKOLU-MRVPVSSYSA-N 1 1 335.751 2.189 20 5 EEBDMO O=C(c1cccc([N+](=O)[O-])c1Cl)N1CC[NH2+]C[C@H]1c1ccncc1 ZINC001580820972 1403871344 /nfs/dbraw/zinc/87/13/44/1403871344.db2.gz LJQDZNAKCUKYLG-AWEZNQCLSA-N 1 1 346.774 2.430 20 5 EEBDMO C[N@H+]1CCO[C@H]2CN(c3cc(Cl)nc4ccc([N+](=O)[O-])cc43)C[C@@H]21 ZINC001164672377 719446992 /nfs/dbraw/zinc/44/69/92/719446992.db2.gz RCRRVLLXWPFLMA-GJZGRUSLSA-N 1 1 348.790 2.316 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CC[NH2+]C[C@@H]1c1ccncc1 ZINC000818006269 785161376 /nfs/dbraw/zinc/16/13/76/785161376.db2.gz YYIKYWGSGIIRLV-OAHLLOKOSA-N 1 1 346.774 2.430 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC/C=C/CNc1cc(C)ccc1[N+](=O)[O-] ZINC001107321626 786858729 /nfs/dbraw/zinc/85/87/29/786858729.db2.gz HQJXWSSECFSBOF-AATRIKPKSA-N 1 1 334.420 2.329 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NC/C=C/CNc1nccc(C)c1[N+](=O)[O-] ZINC001107391507 787104514 /nfs/dbraw/zinc/10/45/14/787104514.db2.gz JPPDQONNUCPYKF-BQYQJAHWSA-N 1 1 349.435 2.113 20 5 EEBDMO Cc1cc(NCCCN(C)C(=O)C[N@@H+](C)C2CCC2)ncc1[N+](=O)[O-] ZINC001109652823 805829912 /nfs/dbraw/zinc/82/99/12/805829912.db2.gz DGOVKHZVZWULRU-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)CSc3ccc([N+](=O)[O-])cc3)C[C@@]2(C)C1 ZINC000913294246 788771885 /nfs/dbraw/zinc/77/18/85/788771885.db2.gz JNYKOAJTTLAGKW-CALCHBBNSA-N 1 1 349.456 2.487 20 5 EEBDMO C[C@@H]1C[N@H+](C)[C@H](C)[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000844640171 789285738 /nfs/dbraw/zinc/28/57/38/789285738.db2.gz GYCMXWOIRHULER-GMTAPVOTSA-N 1 1 336.348 2.056 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000844640171 789285747 /nfs/dbraw/zinc/28/57/47/789285747.db2.gz GYCMXWOIRHULER-GMTAPVOTSA-N 1 1 336.348 2.056 20 5 EEBDMO Cn1nc(Br)cc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000691553954 790208818 /nfs/dbraw/zinc/20/88/18/790208818.db2.gz OKBUUNKYXJQFHW-UHFFFAOYSA-N 1 1 325.166 2.381 20 5 EEBDMO Cc1cc(NCCCNC(=O)C[N@H+](C)C2CCC2)ccc1[N+](=O)[O-] ZINC001094853532 796782351 /nfs/dbraw/zinc/78/23/51/796782351.db2.gz QQQDUHSIQOFDKV-UHFFFAOYSA-N 1 1 334.420 2.306 20 5 EEBDMO CCN1C[C@@H](C)[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1=O ZINC001172921821 797152040 /nfs/dbraw/zinc/15/20/40/797152040.db2.gz UKAYMMYSJHMJPC-CZUORRHYSA-N 1 1 331.416 2.395 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H](O)[C@@H](F)CC2)c1F ZINC001173181325 797279567 /nfs/dbraw/zinc/27/95/67/797279567.db2.gz OMZKOWPRZPNVPA-VHRBIJSZSA-N 1 1 344.358 2.468 20 5 EEBDMO C[N@H+]1CC[C@@H]1CNC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000925430280 797753352 /nfs/dbraw/zinc/75/33/52/797753352.db2.gz LITJFMGQWQTGJG-GDBMZVCRSA-N 1 1 332.404 2.188 20 5 EEBDMO O=c1ccc2c(n1CC1CC1)CC[N@@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)CC2 ZINC001169018258 803587291 /nfs/dbraw/zinc/58/72/91/803587291.db2.gz AGNMVOBMDBTHOM-RDJZCZTQSA-N 1 1 345.443 2.104 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CC[C@]3(C[C@@H](Oc4cccnc4)CO3)C2)C1 ZINC001169022000 803588585 /nfs/dbraw/zinc/58/85/85/803588585.db2.gz MCCFRAUDVFFDSV-ONIAQPFYSA-N 1 1 347.415 2.139 20 5 EEBDMO CC(C)[N@@H+](C)CCNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790626211 808848922 /nfs/dbraw/zinc/84/89/22/808848922.db2.gz DFVJKWYAEUHSOG-UHFFFAOYSA-N 1 1 331.775 2.386 20 5 EEBDMO Cc1ccc(C[NH2+]C2CC[NH+](CCCC(=O)[O-])CC2)cc1[N+](=O)[O-] ZINC000902329740 980835796 /nfs/dbraw/zinc/83/57/96/980835796.db2.gz LXHLKLOUWLPUCT-UHFFFAOYSA-N 1 1 335.404 2.322 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1CC[C@H]2C[C@@H](C)C[N@H+]2C1 ZINC001521229979 1119225776 /nfs/dbraw/zinc/22/57/76/1119225776.db2.gz REGKAJXJXWRJMF-NFAWXSAZSA-N 1 1 347.415 2.340 20 5 EEBDMO CC[C@@]1(CO)CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000189616451 529562771 /nfs/dbraw/zinc/56/27/71/529562771.db2.gz LRCBCBNQTWZZJD-INIZCTEOSA-N 1 1 332.360 2.382 20 5 EEBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)CCCC[NH+]1CCOCC1 ZINC000171957049 530004065 /nfs/dbraw/zinc/00/40/65/530004065.db2.gz LLVPUIVEPRRADD-UHFFFAOYSA-N 1 1 335.404 2.056 20 5 EEBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000179718587 233365117 /nfs/dbraw/zinc/36/51/17/233365117.db2.gz QXLUGDXNRCLSHC-CYBMUJFWSA-N 1 1 342.399 2.427 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)N(C)CC[N@@H+](C)C2CC2)cccc1[N+](=O)[O-] ZINC000186796606 236024065 /nfs/dbraw/zinc/02/40/65/236024065.db2.gz QFCUQFIYMZKJAV-CYBMUJFWSA-N 1 1 334.420 2.256 20 5 EEBDMO CCOC(=O)[C@](C)(O)C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543144 243151591 /nfs/dbraw/zinc/15/15/91/243151591.db2.gz AZOYLCBASFWIJC-WMLDXEAASA-N 1 1 336.388 2.088 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](O)CC(C)(C)C1 ZINC000451811048 243273729 /nfs/dbraw/zinc/27/37/29/243273729.db2.gz OPROPSPWCLXDPA-ZDUSSCGKSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](O)CC(C)(C)C1 ZINC000451811048 243273733 /nfs/dbraw/zinc/27/37/33/243273733.db2.gz 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COc1ccc(C[N@H+]2CCOC3(CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000372206213 466225647 /nfs/dbraw/zinc/22/56/47/466225647.db2.gz QEQJHSQBKBRTQF-UHFFFAOYSA-N 1 1 336.388 2.375 20 5 EEBDMO O=C(C[N@@H+](CCCCO)C1CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000304267069 466272969 /nfs/dbraw/zinc/27/29/69/466272969.db2.gz VPAUMTSNXRSTSQ-UHFFFAOYSA-N 1 1 341.795 2.424 20 5 EEBDMO O=C(C[N@H+](CCCCO)C1CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000304267069 466272976 /nfs/dbraw/zinc/27/29/76/466272976.db2.gz VPAUMTSNXRSTSQ-UHFFFAOYSA-N 1 1 341.795 2.424 20 5 EEBDMO CC1CCC(O)(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)CC1 ZINC000305227038 466384126 /nfs/dbraw/zinc/38/41/26/466384126.db2.gz KUQLNPXCUNNDAG-XOYHFGRZSA-N 1 1 334.420 2.417 20 5 EEBDMO Cc1nc([N+](=O)[O-])c(-c2noc([C@@H](c3ccccc3)[NH+](C)C)n2)n1C ZINC000347129402 466416560 /nfs/dbraw/zinc/41/65/60/466416560.db2.gz BJBVXLFTDDYDHI-GFCCVEGCSA-N 1 1 342.359 2.338 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000332220055 466453853 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O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCc2c(Cl)cccc2C1 ZINC000132157211 534320212 /nfs/dbraw/zinc/32/02/12/534320212.db2.gz NEHOSMSDSFWFAO-UHFFFAOYSA-N 1 1 333.775 2.468 20 5 EEBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000413956896 534424481 /nfs/dbraw/zinc/42/44/81/534424481.db2.gz OSOBURMZJNAHEK-CYBMUJFWSA-N 1 1 328.372 2.269 20 5 EEBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000413956896 534424489 /nfs/dbraw/zinc/42/44/89/534424489.db2.gz OSOBURMZJNAHEK-CYBMUJFWSA-N 1 1 328.372 2.269 20 5 EEBDMO O=C1O[C@@H](C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)CC12CCC2 ZINC000191938377 534819551 /nfs/dbraw/zinc/81/95/51/534819551.db2.gz IFLCINXHFWMVKT-MRXNPFEDSA-N 1 1 345.399 2.203 20 5 EEBDMO CNC(=O)c1ccc(N(C)CC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC000266242422 536429659 /nfs/dbraw/zinc/42/96/59/536429659.db2.gz LOQVYMFMKCQMBL-AWEZNQCLSA-N 1 1 334.420 2.265 20 5 EEBDMO C[N@H+](Cc1ccc2ccccc2c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266479224 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2.101 20 5 EEBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@H](C)C2)cc1SC ZINC000742198272 578265218 /nfs/dbraw/zinc/26/52/18/578265218.db2.gz HODXQCRKLOWJEI-SNVBAGLBSA-N 1 1 339.417 2.101 20 5 EEBDMO C[C@@H](CNC(=O)NC[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000891980374 677838584 /nfs/dbraw/zinc/83/85/84/677838584.db2.gz FJVBPTQZTPNEEJ-UONOGXRCSA-N 1 1 346.431 2.482 20 5 EEBDMO CC[N@H+]1CCCN(c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000894178299 682175652 /nfs/dbraw/zinc/17/56/52/682175652.db2.gz LNZXIPOJJHCBLK-ZDUSSCGKSA-N 1 1 344.415 2.367 20 5 EEBDMO COCC[N@@H+]1CCC[C@H]1CNCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892867066 683149758 /nfs/dbraw/zinc/14/97/58/683149758.db2.gz VKACYRGOUOPBAR-AWEZNQCLSA-N 1 1 327.812 2.449 20 5 EEBDMO COCC[N@H+]1CCC[C@H]1CNCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892867066 683149760 /nfs/dbraw/zinc/14/97/60/683149760.db2.gz VKACYRGOUOPBAR-AWEZNQCLSA-N 1 1 327.812 2.449 20 5 EEBDMO CC(C)[NH+]1CCN(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)CC1 ZINC000895646827 684670406 /nfs/dbraw/zinc/67/04/06/684670406.db2.gz OBWFLXWPDCVSIM-UHFFFAOYSA-N 1 1 342.399 2.496 20 5 EEBDMO C[N@@H+](C[C@H](O)COc1cccc(C(F)(F)F)c1[N+](=O)[O-])C1CC1 ZINC000899906754 693919818 /nfs/dbraw/zinc/91/98/18/693919818.db2.gz NOPPMXCTDXFKPD-JTQLQIEISA-N 1 1 334.294 2.448 20 5 EEBDMO Cc1cc(C[N@H+](C)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cs1 ZINC000985425281 686650698 /nfs/dbraw/zinc/65/06/98/686650698.db2.gz DQGOVGUNQMQHRP-HUUCEWRRSA-N 1 1 337.445 2.145 20 5 EEBDMO Cc1cc(C[N@@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1 ZINC000985425281 686650702 /nfs/dbraw/zinc/65/07/02/686650702.db2.gz DQGOVGUNQMQHRP-HUUCEWRRSA-N 1 1 337.445 2.145 20 5 EEBDMO Cc1cc(C[N@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1 ZINC000985425281 686650707 /nfs/dbraw/zinc/65/07/07/686650707.db2.gz DQGOVGUNQMQHRP-HUUCEWRRSA-N 1 1 337.445 2.145 20 5 EEBDMO COc1ccc(C(=O)NCC2C[NH+](Cc3cccc([N+](=O)[O-])c3)C2)o1 ZINC001032070678 1192136419 /nfs/dbraw/zinc/13/64/19/1192136419.db2.gz PQIOFBNLVUQNBS-UHFFFAOYSA-N 1 1 345.355 2.058 20 5 EEBDMO CN(CCCN(C)c1ccc([N+](=O)[O-])cc1)C(=O)C[N@@H+](C)C1CCC1 ZINC001112195427 1186744711 /nfs/dbraw/zinc/74/47/11/1186744711.db2.gz AHSIYHJZTBKCAA-UHFFFAOYSA-N 1 1 348.447 2.364 20 5 EEBDMO C[NH+]1CCN(CC2CN(c3ccc([N+](=O)[O-])cc3C(F)F)C2)CC1 ZINC000865915823 1198422937 /nfs/dbraw/zinc/42/29/37/1198422937.db2.gz IHXOBXMKEUOPES-UHFFFAOYSA-N 1 1 340.374 2.216 20 5 EEBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CC2(C1)C[NH+](Cc1ccccc1)C2 ZINC000866000859 1198450039 /nfs/dbraw/zinc/45/00/39/1198450039.db2.gz QXIAKMNSWFYVEB-UHFFFAOYSA-N 1 1 341.415 2.442 20 5 EEBDMO COc1ccc(CC(=O)O[C@H](C)Cn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000810618778 1199618354 /nfs/dbraw/zinc/61/83/54/1199618354.db2.gz ULHNHWUPTGQQBJ-LLVKDONJSA-N 1 1 333.344 2.283 20 5 EEBDMO Cc1[nH+]ccn1C[C@@H](C)OC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000810613577 1199629742 /nfs/dbraw/zinc/62/97/42/1199629742.db2.gz UJIOIAXCIFKBDG-LLVKDONJSA-N 1 1 343.343 2.081 20 5 EEBDMO Cn1cncc1C[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000877539102 1199959814 /nfs/dbraw/zinc/95/98/14/1199959814.db2.gz IMZXKUIMVUFFOM-UHFFFAOYSA-N 1 1 331.195 2.442 20 5 EEBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878340932 1200408499 /nfs/dbraw/zinc/40/84/99/1200408499.db2.gz VLDFDDRLNNVZGW-NWDGAFQWSA-N 1 1 331.376 2.169 20 5 EEBDMO COc1ccc([C@@H]2CN(Cc3cc(O)ccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC000879524055 1201121022 /nfs/dbraw/zinc/12/10/22/1201121022.db2.gz RNBZMLCZFOSPCG-KRWDZBQOSA-N 1 1 343.383 2.456 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])C2)C1 ZINC000868573027 1201837801 /nfs/dbraw/zinc/83/78/01/1201837801.db2.gz XLKWOOLMYUVCIA-KRWDZBQOSA-N 1 1 335.379 2.221 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCCCN(C)c1cc(C)ccc1[N+](=O)[O-] ZINC001095605268 1205889180 /nfs/dbraw/zinc/88/91/80/1205889180.db2.gz BWMWQADEPAUMSO-UHFFFAOYSA-N 1 1 336.436 2.188 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1C1OCCO1 ZINC000933904607 1207866781 /nfs/dbraw/zinc/86/67/81/1207866781.db2.gz ZBTIATBOFSPKQY-HNNXBMFYSA-N 1 1 349.387 2.069 20 5 EEBDMO Cc1[nH+]ccn1CCCCOC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000778898936 1208395434 /nfs/dbraw/zinc/39/54/34/1208395434.db2.gz ISVLJISEWFYWBH-UHFFFAOYSA-N 1 1 347.327 2.466 20 5 EEBDMO O=C(N[C@H]1C[C@H]([NH2+]Cc2ccc(C(F)F)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001020138844 1229504879 /nfs/dbraw/zinc/50/48/79/1229504879.db2.gz DHKVUZOVWRQKLB-AAVRWANBSA-N 1 1 339.342 2.026 20 5 EEBDMO O=C(NCC1=CC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1)c1ccc[nH]1 ZINC001000448486 1240336651 /nfs/dbraw/zinc/33/66/51/1240336651.db2.gz RQULZBWPUYHZMS-UHFFFAOYSA-N 1 1 340.383 2.485 20 5 EEBDMO O=C(NCC1=CC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1)c1ccc[nH]1 ZINC001000448486 1240336658 /nfs/dbraw/zinc/33/66/58/1240336658.db2.gz RQULZBWPUYHZMS-UHFFFAOYSA-N 1 1 340.383 2.485 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)N[C@H]1C[C@H](Nc2cc(C)c([N+](=O)[O-])cn2)C1 ZINC001097051246 1243628281 /nfs/dbraw/zinc/62/82/81/1243628281.db2.gz SVRBLMFZQJCBGV-HDJSIYSDSA-N 1 1 349.435 2.089 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@H](Nc2cc(C)ccc2[N+](=O)[O-])C1 ZINC001097056605 1243667161 /nfs/dbraw/zinc/66/71/61/1243667161.db2.gz CFSVKOLFBVQEMY-HDJSIYSDSA-N 1 1 334.420 2.304 20 5 EEBDMO Cc1ccc(N(CCNC(=O)C[N@H+](C)C(C)C)C2CC2)c([N+](=O)[O-])c1 ZINC001101352503 1245701902 /nfs/dbraw/zinc/70/19/02/1245701902.db2.gz DSCBKHFKJHKMOE-UHFFFAOYSA-N 1 1 348.447 2.328 20 5 EEBDMO C[C@@]1(O)CCC[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CC1 ZINC000794668477 1296506603 /nfs/dbraw/zinc/50/66/03/1296506603.db2.gz UTDMKGHEKNXDQU-QGZVFWFLSA-N 1 1 348.403 2.031 20 5 EEBDMO C[C@@]1(O)CCC[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CC1 ZINC000794668477 1296506613 /nfs/dbraw/zinc/50/66/13/1296506613.db2.gz UTDMKGHEKNXDQU-QGZVFWFLSA-N 1 1 348.403 2.031 20 5 EEBDMO O=[N+]([O-])c1cc2cn[nH]c2cc1O[C@H]1CC[C@H]([NH+]2CCOCC2)CC1 ZINC001230602007 1303308522 /nfs/dbraw/zinc/30/85/22/1303308522.db2.gz TVMJAVFXUJZBOS-HDJSIYSDSA-N 1 1 346.387 2.493 20 5 EEBDMO C[C@]1(CO)CC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C[C@H]1O ZINC001232219478 1304041394 /nfs/dbraw/zinc/04/13/94/1304041394.db2.gz URJRNUQAVSOUQY-YLJYHZDGSA-N 1 1 337.423 2.348 20 5 EEBDMO C[N@@H+](CCCNC(=O)C1=COCCC1)Cc1cccc([N+](=O)[O-])c1 ZINC001235463805 1305241634 /nfs/dbraw/zinc/24/16/34/1305241634.db2.gz DUBTVWRFJXHQNL-UHFFFAOYSA-N 1 1 333.388 2.227 20 5 EEBDMO COc1ccc(Nc2c[nH+]ccc2N2CCN(C)CC2)c([N+](=O)[O-])c1 ZINC001248470530 1310907732 /nfs/dbraw/zinc/90/77/32/1310907732.db2.gz MTOSWGDZDJCUFS-UHFFFAOYSA-N 1 1 343.387 2.494 20 5 EEBDMO Cc1nn(C[N@@H+]2CC3(C[C@@H]2C)CCOCC3)c2ncc([N+](=O)[O-])cc12 ZINC000842639601 1315741647 /nfs/dbraw/zinc/74/16/47/1315741647.db2.gz REFKEERZETZDGI-LBPRGKRZSA-N 1 1 345.403 2.496 20 5 EEBDMO Cn1cnc2c1CC[N@@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2 ZINC001254480276 1318084445 /nfs/dbraw/zinc/08/44/45/1318084445.db2.gz COTCKIMBENBTNI-UHFFFAOYSA-N 1 1 341.415 2.355 20 5 EEBDMO Cn1cnc2c1CC[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2 ZINC001254480276 1318084456 /nfs/dbraw/zinc/08/44/56/1318084456.db2.gz COTCKIMBENBTNI-UHFFFAOYSA-N 1 1 341.415 2.355 20 5 EEBDMO CC(C)CC(=O)N1CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603440 1318140814 /nfs/dbraw/zinc/14/08/14/1318140814.db2.gz NFDSFMZQGRVCQX-KRWDZBQOSA-N 1 1 331.416 2.252 20 5 EEBDMO COc1cc(N2CCC([N@H+]3[C@@H](C)CC[C@H]3CO)CC2)ccc1[N+](=O)[O-] ZINC001256093738 1318645684 /nfs/dbraw/zinc/64/56/84/1318645684.db2.gz PRKWCIYCAIUFND-BBRMVZONSA-N 1 1 349.431 2.417 20 5 EEBDMO COc1cc2ncnc(N3CC[N@@H+](C(C)C)[C@@H](C)C3)c2cc1[N+](=O)[O-] ZINC001158494647 1319270702 /nfs/dbraw/zinc/27/07/02/1319270702.db2.gz OEEMUNGRWFFWSD-LBPRGKRZSA-N 1 1 345.403 2.466 20 5 EEBDMO C[N@@H+](C1CN(c2ccc3c(cccc3[N+](=O)[O-])n2)C1)[C@H]1CCOC1 ZINC001158730962 1319406926 /nfs/dbraw/zinc/40/69/26/1319406926.db2.gz DHXCUPQFGYKBHX-LBPRGKRZSA-N 1 1 328.372 2.052 20 5 EEBDMO CCc1ccccc1C[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001164491054 1321395247 /nfs/dbraw/zinc/39/52/47/1321395247.db2.gz YQSOBBVEUCNDKR-IAGOWNOFSA-N 1 1 345.443 2.290 20 5 EEBDMO COCCC[NH+]1CCN(c2nc(Cl)c(Cl)cc2[N+](=O)[O-])CC1 ZINC001165098006 1321454673 /nfs/dbraw/zinc/45/46/73/1321454673.db2.gz QWJZWKZVMCABJJ-UHFFFAOYSA-N 1 1 349.218 2.455 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)C(=O)NCC(F)(F)F ZINC001328086928 1334394268 /nfs/dbraw/zinc/39/42/68/1334394268.db2.gz WFXDEVNMIVPUTP-IUCAKERBSA-N 1 1 349.309 2.321 20 5 EEBDMO C[N@H+]1CCC[C@H](CCNC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001331436575 1335013701 /nfs/dbraw/zinc/01/37/01/1335013701.db2.gz YLIDRWIEKDZKQH-CYBMUJFWSA-N 1 1 332.404 2.352 20 5 EEBDMO Cn1c([C@H]2CCC[N@@H+]2C)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001350516598 1337720099 /nfs/dbraw/zinc/72/00/99/1337720099.db2.gz CKKFCMJVNXSDSF-OAHLLOKOSA-N 1 1 342.403 2.053 20 5 EEBDMO Cn1c([C@H]2CCC[N@H+]2C)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001350516598 1337720103 /nfs/dbraw/zinc/72/01/03/1337720103.db2.gz CKKFCMJVNXSDSF-OAHLLOKOSA-N 1 1 342.403 2.053 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001589137373 1348964493 /nfs/dbraw/zinc/96/44/93/1348964493.db2.gz ZKDBIFLQCRNIOB-SNVBAGLBSA-N 1 1 331.380 2.060 20 5 EEBDMO C[N@H+]1CCC[C@@H](CCNc2cc(F)c(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001591184471 1349444547 /nfs/dbraw/zinc/44/45/47/1349444547.db2.gz OVAPOCNXLQTWQR-JTQLQIEISA-N 1 1 349.370 2.058 20 5 EEBDMO CC[C@@H]1CCCC[N@H+]1CCNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001604102882 1350858623 /nfs/dbraw/zinc/85/86/23/1350858623.db2.gz JDADTKAMUREJJD-GFCCVEGCSA-N 1 1 345.407 2.451 20 5 EEBDMO O=C(C[N@H+]1CCC[C@H](CO)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000815278703 1367863475 /nfs/dbraw/zinc/86/34/75/1367863475.db2.gz VPUNCZHYZVWQDX-NSHDSACASA-N 1 1 341.795 2.281 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@H](CO)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000815278703 1367863478 /nfs/dbraw/zinc/86/34/78/1367863478.db2.gz VPUNCZHYZVWQDX-NSHDSACASA-N 1 1 341.795 2.281 20 5 EEBDMO CN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286343625 1369749775 /nfs/dbraw/zinc/74/97/75/1369749775.db2.gz VYTZEQCLZXDXDK-FUNVUKJBSA-N 1 1 348.359 2.200 20 5 EEBDMO CC[NH+](CC)CC[C@@H](C)NC(=O)[C@@](C)(N)c1cccc([N+](=O)[O-])c1 ZINC001577684923 1403668234 /nfs/dbraw/zinc/66/82/34/1403668234.db2.gz PKIDYQYISJWIFY-DYVFJYSZSA-N 1 1 336.436 2.005 20 5 EEBDMO CC[NH+](CC)CC[C@H](C)NC(=O)[C@@](C)(N)c1cccc([N+](=O)[O-])c1 ZINC001577684924 1403668314 /nfs/dbraw/zinc/66/83/14/1403668314.db2.gz PKIDYQYISJWIFY-GUYCJALGSA-N 1 1 336.436 2.005 20 5 EEBDMO C[N@H+]1CCO[C@H]2CN(c3ccc4c(ccc(Cl)c4[N+](=O)[O-])n3)C[C@H]21 ZINC001164666614 719400727 /nfs/dbraw/zinc/40/07/27/719400727.db2.gz LKRCLAGLPQIFPM-KGLIPLIRSA-N 1 1 348.790 2.316 20 5 EEBDMO Cc1ccoc1C(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001031549335 769540156 /nfs/dbraw/zinc/54/01/56/769540156.db2.gz JVKNVERDESCMRP-UHFFFAOYSA-N 1 1 329.356 2.358 20 5 EEBDMO Cc1cccc(C)c1C[N@H+]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000981137556 776582784 /nfs/dbraw/zinc/58/27/84/776582784.db2.gz WPSFTIWXBLAZGX-NVXWUHKLSA-N 1 1 331.416 2.003 20 5 EEBDMO Cc1cccc(C)c1C[N@@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000981137556 776582792 /nfs/dbraw/zinc/58/27/92/776582792.db2.gz WPSFTIWXBLAZGX-NVXWUHKLSA-N 1 1 331.416 2.003 20 5 EEBDMO Cc1cccc(C)c1C[N@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000981137556 776582801 /nfs/dbraw/zinc/58/28/01/776582801.db2.gz WPSFTIWXBLAZGX-NVXWUHKLSA-N 1 1 331.416 2.003 20 5 EEBDMO O=C(C(F)F)N1CC2(C1)CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C2 ZINC000981570662 777688881 /nfs/dbraw/zinc/68/88/81/777688881.db2.gz AQRCNTXRLXYCPE-UHFFFAOYSA-N 1 1 339.342 2.284 20 5 EEBDMO C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1Cl)[C@H]1C[N@H+](C)CCO1 ZINC000809914046 783464740 /nfs/dbraw/zinc/46/47/40/783464740.db2.gz FVTMGWJIIICAMR-BXKDBHETSA-N 1 1 342.783 2.089 20 5 EEBDMO C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1Cl)[C@H]1C[N@@H+](C)CCO1 ZINC000809914046 783464744 /nfs/dbraw/zinc/46/47/44/783464744.db2.gz FVTMGWJIIICAMR-BXKDBHETSA-N 1 1 342.783 2.089 20 5 EEBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC000906711819 784094361 /nfs/dbraw/zinc/09/43/61/784094361.db2.gz SGZPRSXELGCFCF-SNVBAGLBSA-N 1 1 340.811 2.244 20 5 EEBDMO C[C@@H]1C[C@@H](CO)C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000817277777 784655608 /nfs/dbraw/zinc/65/56/08/784655608.db2.gz MLVFVLNKMCUTSM-VXGBXAGGSA-N 1 1 339.367 2.013 20 5 EEBDMO O=C(C(F)F)N1CCC2(C[NH+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC001035631109 784828768 /nfs/dbraw/zinc/82/87/68/784828768.db2.gz VMMXMWQUNGPOKP-UHFFFAOYSA-N 1 1 339.342 2.284 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)[C@@H](C)C1 ZINC000910287571 786620046 /nfs/dbraw/zinc/62/00/46/786620046.db2.gz LHVARBZRPZBQAV-LBPRGKRZSA-N 1 1 339.367 2.055 20 5 EEBDMO C[C@H](C[NH+](C)C)[C@H]1CCCCN1C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000912809713 788377133 /nfs/dbraw/zinc/37/71/33/788377133.db2.gz KGCIUKUPSHRPGT-MLGOLLRUSA-N 1 1 335.404 2.493 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NCCC1(CNc2ccc([N+](=O)[O-])cn2)CC1 ZINC001089958101 795580879 /nfs/dbraw/zinc/58/08/79/795580879.db2.gz IPLHENCRRGQAJD-UHFFFAOYSA-N 1 1 349.435 2.030 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H](N3CCOCC3)C1)CC2 ZINC001172914160 797148479 /nfs/dbraw/zinc/14/84/79/797148479.db2.gz DJJCJEOBBKQCSD-IEBWSBKVSA-N 1 1 345.443 2.249 20 5 EEBDMO C[N@@H+](CCN1CCOCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909576 797168209 /nfs/dbraw/zinc/16/82/09/797168209.db2.gz SRSPTKURBNKEON-QGZVFWFLSA-N 1 1 333.432 2.106 20 5 EEBDMO C[C@H](OC(=O)C[NH+]1[C@H](C)CC[C@H]1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000785736798 806564192 /nfs/dbraw/zinc/56/41/92/806564192.db2.gz QUAMTNUFAUBQLB-UPJWGTAASA-N 1 1 349.387 2.338 20 5 EEBDMO CCOC(=O)C1=C(O)CC[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173227125 797310943 /nfs/dbraw/zinc/31/09/43/797310943.db2.gz OFRBZEVGOBRFQD-CZUORRHYSA-N 1 1 348.399 2.370 20 5 EEBDMO CC[NH+](CC)CCN1CCN([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173230016 797311763 /nfs/dbraw/zinc/31/17/63/797311763.db2.gz XGXSOGYBWVKPRC-KRWDZBQOSA-N 1 1 348.491 2.485 20 5 EEBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]2[C@H](CCC(=O)N2C)C1 ZINC001173237162 797321555 /nfs/dbraw/zinc/32/15/55/797321555.db2.gz INUSATZKKXLXTL-FRFSOERESA-N 1 1 331.416 2.469 20 5 EEBDMO CCc1[nH]nc(C(=O)N2CCCC[C@@H]2[C@H](C)C[NH+](C)C)c1[N+](=O)[O-] ZINC000823484749 798737880 /nfs/dbraw/zinc/73/78/80/798737880.db2.gz XELQPFMDBMBOND-DGCLKSJQSA-N 1 1 337.424 2.073 20 5 EEBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@@H]1C[N@@H+]2CCC[C@@H]2CO1 ZINC000786813871 806910085 /nfs/dbraw/zinc/91/00/85/806910085.db2.gz NIXVOZQDYNPIPH-BUSCQBHZSA-N 1 1 331.416 2.451 20 5 EEBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000786813871 806910090 /nfs/dbraw/zinc/91/00/90/806910090.db2.gz NIXVOZQDYNPIPH-BUSCQBHZSA-N 1 1 331.416 2.451 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CC3CCCCC3)C[C@H]2CC1 ZINC000946589389 801544093 /nfs/dbraw/zinc/54/40/93/801544093.db2.gz WUUOCJSLSHQABW-XMTFNYHQSA-N 1 1 349.475 2.402 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](CC3CCCCC3)C[C@H]2CC1 ZINC000946589389 801544098 /nfs/dbraw/zinc/54/40/98/801544098.db2.gz WUUOCJSLSHQABW-XMTFNYHQSA-N 1 1 349.475 2.402 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CC3CCCCC3)C[C@H]2CC1 ZINC000946589389 801544102 /nfs/dbraw/zinc/54/41/02/801544102.db2.gz WUUOCJSLSHQABW-XMTFNYHQSA-N 1 1 349.475 2.402 20 5 EEBDMO CSCC[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC001168969957 803554126 /nfs/dbraw/zinc/55/41/26/803554126.db2.gz GRAHBSADYJCRAN-UPJWGTAASA-N 1 1 332.466 2.485 20 5 EEBDMO CC(C)(C)OC(=O)N1C[C@@H]2CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]21 ZINC001169010301 803570784 /nfs/dbraw/zinc/57/07/84/803570784.db2.gz CMPXHEAJXRZUQG-XQLPTFJDSA-N 1 1 339.436 2.373 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[C@H]2C[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@H]21 ZINC001169012488 803571402 /nfs/dbraw/zinc/57/14/02/803571402.db2.gz QOIZOCFUGXGGTE-BYNSBNAKSA-N 1 1 339.436 2.373 20 5 EEBDMO CC(C)(C)OC(=O)NCC12CC(C1)C[N@H+]2[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169014053 803571738 /nfs/dbraw/zinc/57/17/38/803571738.db2.gz YNKKAHLUKYIYIG-ZBUZPQQSSA-N 1 1 339.436 2.421 20 5 EEBDMO CC(C)(C)OC(=O)NC[C@@H]1CCC[N@H+]1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169038439 803582232 /nfs/dbraw/zinc/58/22/32/803582232.db2.gz YWEPFXYCXPBGKH-MCIONIFRSA-N 1 1 327.425 2.421 20 5 EEBDMO COCC[C@@H]1CO[C@@]2(C1)CCC[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169022224 803588526 /nfs/dbraw/zinc/58/85/26/803588526.db2.gz QWRZCNJRMGTTJB-MWDXBVQZSA-N 1 1 326.437 2.339 20 5 EEBDMO COc1ccc(O[C@@H]2CCC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)nc1 ZINC001169050620 803595037 /nfs/dbraw/zinc/59/50/37/803595037.db2.gz BYRBVNDDNZMDKD-SQWLQELKSA-N 1 1 335.404 2.379 20 5 EEBDMO COc1ccnc(N([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C2CC[NH2+]CC2)c1 ZINC001169050622 803595406 /nfs/dbraw/zinc/59/54/06/803595406.db2.gz BYXCTJKCELJIIH-HIFRSBDPSA-N 1 1 334.420 2.094 20 5 EEBDMO COC(=O)[C@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C[C@@H]1c1ccccc1 ZINC001169057876 803598258 /nfs/dbraw/zinc/59/82/58/803598258.db2.gz YNQKHLSZLPKPLN-LLLHUVSDSA-N 1 1 332.400 2.320 20 5 EEBDMO Cc1nn(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c2ncc([N+](=O)[O-])cc12 ZINC000789509353 808033509 /nfs/dbraw/zinc/03/35/09/808033509.db2.gz UMCAPBRSTZHVPL-LSDHHAIUSA-N 1 1 331.376 2.249 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000791198164 809096073 /nfs/dbraw/zinc/09/60/73/809096073.db2.gz ZHFQULGIZSLGMU-NSHDSACASA-N 1 1 338.383 2.014 20 5 EEBDMO CNC(=O)[C@H](CCSC)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000808439004 812637408 /nfs/dbraw/zinc/63/74/08/812637408.db2.gz UCECDBRZSPGCQO-LBPRGKRZSA-N 1 1 331.825 2.206 20 5 EEBDMO C[N@@H+](CCCCc1ccccc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174737890 529885676 /nfs/dbraw/zinc/88/56/76/529885676.db2.gz XMIXCXLZKMSERV-QGZVFWFLSA-N 1 1 332.404 2.107 20 5 EEBDMO CCOC1CC[NH+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000067377916 215138797 /nfs/dbraw/zinc/13/87/97/215138797.db2.gz LGEUBHMVEYKPKJ-MRXNPFEDSA-N 1 1 333.388 2.201 20 5 EEBDMO Cc1cc(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)c(N)c([N+](=O)[O-])c1 ZINC000104149555 219352866 /nfs/dbraw/zinc/35/28/66/219352866.db2.gz UIPPCCZKUCUNGW-ZDUSSCGKSA-N 1 1 334.420 2.336 20 5 EEBDMO Cc1ncsc1C[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181863878 234357908 /nfs/dbraw/zinc/35/79/08/234357908.db2.gz CWJVHBBBIXAPAI-GFCCVEGCSA-N 1 1 337.401 2.231 20 5 EEBDMO C[C@H]([NH3+])[C@@H]1COCC[C@@H]1NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000423091600 240362087 /nfs/dbraw/zinc/36/20/87/240362087.db2.gz XUGSRYDIZYEVCX-HERUPUMHSA-N 1 1 347.337 2.456 20 5 EEBDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1(C)C ZINC000072897776 216326377 /nfs/dbraw/zinc/32/63/77/216326377.db2.gz XLFFBCQJNAZJCS-PBHICJAKSA-N 1 1 335.404 2.329 20 5 EEBDMO CO[C@H](CC(C)C)C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000419286041 239458929 /nfs/dbraw/zinc/45/89/29/239458929.db2.gz NREHXUUCGGMEGE-OAHLLOKOSA-N 1 1 349.431 2.414 20 5 EEBDMO O=C(CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)N1CCOCC1 ZINC000451547150 243154289 /nfs/dbraw/zinc/15/42/89/243154289.db2.gz KIQAYWRTNANUDV-INIZCTEOSA-N 1 1 347.415 2.023 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCCN3CCOCC3)C2)cc1 ZINC000451553154 243155849 /nfs/dbraw/zinc/15/58/49/243155849.db2.gz XQNZTLKKPAZRSE-KRWDZBQOSA-N 1 1 333.432 2.497 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2C[C@@H](C3CC3)[C@@H]2C2CC2)c1 ZINC000453030447 243378766 /nfs/dbraw/zinc/37/87/66/243378766.db2.gz HDSZHIVUEBHONC-NJAFHUGGSA-N 1 1 332.400 2.455 20 5 EEBDMO CNC(=O)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000111264726 220125444 /nfs/dbraw/zinc/12/54/44/220125444.db2.gz GVCZJTCKLAPHNJ-ZDUSSCGKSA-N 1 1 335.404 2.340 20 5 EEBDMO 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ZINC000112629906 220360018 /nfs/dbraw/zinc/36/00/18/220360018.db2.gz SVDMISFKJGUCRX-CQSZACIVSA-N 1 1 345.355 2.430 20 5 EEBDMO CN(C)c1cc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc[nH+]1 ZINC000267238039 256040960 /nfs/dbraw/zinc/04/09/60/256040960.db2.gz MBSGHTMCSFSYMU-UHFFFAOYSA-N 1 1 329.360 2.131 20 5 EEBDMO CCCCC[N@H+](CCO)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000118825472 221191002 /nfs/dbraw/zinc/19/10/02/221191002.db2.gz MSEMQWNUPXWSHZ-UHFFFAOYSA-N 1 1 339.392 2.026 20 5 EEBDMO CCCCC[N@@H+](CCO)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000118825472 221191003 /nfs/dbraw/zinc/19/10/03/221191003.db2.gz MSEMQWNUPXWSHZ-UHFFFAOYSA-N 1 1 339.392 2.026 20 5 EEBDMO O=[N+]([O-])c1cccc(OCC[NH+]2CCN(c3cncc(F)c3)CC2)c1 ZINC000270915685 256187242 /nfs/dbraw/zinc/18/72/42/256187242.db2.gz OLWMWZLAMCNDSR-UHFFFAOYSA-N 1 1 346.362 2.330 20 5 EEBDMO CCC1(CO)CC[NH+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000270878482 256183036 /nfs/dbraw/zinc/18/30/36/256183036.db2.gz KZEOWLVTBJIILE-UHFFFAOYSA-N 1 1 335.404 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335.404 2.210 20 5 EEBDMO O=[N+]([O-])c1ccc(CNC[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000344549757 465667112 /nfs/dbraw/zinc/66/71/12/465667112.db2.gz ORZGLHPLDPLLPK-LJQANCHMSA-N 1 1 341.411 2.321 20 5 EEBDMO O=[N+]([O-])c1ccc(C[NH2+]C[C@]2(O)CCN(Cc3ccccc3)C2)cc1 ZINC000344549757 465667115 /nfs/dbraw/zinc/66/71/15/465667115.db2.gz ORZGLHPLDPLLPK-LJQANCHMSA-N 1 1 341.411 2.321 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000348683241 465740115 /nfs/dbraw/zinc/74/01/15/465740115.db2.gz OFXLVAUPXAWQDI-MRXNPFEDSA-N 1 1 349.435 2.180 20 5 EEBDMO Cc1cnc(NC[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000361260654 465869742 /nfs/dbraw/zinc/86/97/42/465869742.db2.gz HSUULDMGTJICEK-GOSISDBHSA-N 1 1 342.399 2.347 20 5 EEBDMO CC(C)[C@@H](O)CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000353520426 465949385 /nfs/dbraw/zinc/94/93/85/465949385.db2.gz OQSCXFAJCKMAPP-HOTGVXAUSA-N 1 1 332.404 2.414 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]C[C@@](C)(O)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000353521388 465949692 /nfs/dbraw/zinc/94/96/92/465949692.db2.gz RNTXDNFVTHJWEA-NVXWUHKLSA-N 1 1 330.388 2.168 20 5 EEBDMO CC(C)[C@](C)(O)C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000353523471 465952058 /nfs/dbraw/zinc/95/20/58/465952058.db2.gz ULWMRDSNGFWVCY-NVXWUHKLSA-N 1 1 332.404 2.414 20 5 EEBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])c(N)n1 ZINC000346202940 465987577 /nfs/dbraw/zinc/98/75/77/465987577.db2.gz AUBACIYYBDMKTN-CQSZACIVSA-N 1 1 344.419 2.536 20 5 EEBDMO COc1ccc(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000346249695 466027806 /nfs/dbraw/zinc/02/78/06/466027806.db2.gz XKRKEQOOVYECLO-KCQAQPDRSA-N 1 1 347.415 2.406 20 5 EEBDMO C[C@H]1C[C@H](Nc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C[N@@H+]1C1CC1 ZINC000301871047 466050867 /nfs/dbraw/zinc/05/08/67/466050867.db2.gz HGXRIUQVPZSUOI-QWRGUYRKSA-N 1 1 339.417 2.035 20 5 EEBDMO C[C@H]1C[C@H](Nc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000301871047 466050874 /nfs/dbraw/zinc/05/08/74/466050874.db2.gz HGXRIUQVPZSUOI-QWRGUYRKSA-N 1 1 339.417 2.035 20 5 EEBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)[C@H](C(N)=O)c1ccc(F)cc1 ZINC000338370679 466067889 /nfs/dbraw/zinc/06/78/89/466067889.db2.gz BJLVLKXMHHAXTJ-INIZCTEOSA-N 1 1 331.347 2.435 20 5 EEBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@H](C(N)=O)c1ccc(F)cc1 ZINC000338370679 466067892 /nfs/dbraw/zinc/06/78/92/466067892.db2.gz BJLVLKXMHHAXTJ-INIZCTEOSA-N 1 1 331.347 2.435 20 5 EEBDMO C[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1O ZINC000349379615 466090550 /nfs/dbraw/zinc/09/05/50/466090550.db2.gz CGTHMHKHLROFTH-LRDDRELGSA-N 1 1 330.388 2.198 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@H](CCO)CC1)OCCO2 ZINC000591504125 468478488 /nfs/dbraw/zinc/47/84/88/468478488.db2.gz OLXXXVCWNWXEOV-ZDUSSCGKSA-N 1 1 336.388 2.351 20 5 EEBDMO COC(=O)C[C@]1([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCOC1 ZINC000361740624 466249442 /nfs/dbraw/zinc/24/94/42/466249442.db2.gz JTZTVAKUVXFHDJ-CQSZACIVSA-N 1 1 328.752 2.060 20 5 EEBDMO C[N@H+]1CCCC[C@H]1CCn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000340708347 466280227 /nfs/dbraw/zinc/28/02/27/466280227.db2.gz BBCYPHRKGNYFSO-ZDUSSCGKSA-N 1 1 332.360 2.286 20 5 EEBDMO C[C@@H](O)[C@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000305183990 466372368 /nfs/dbraw/zinc/37/23/68/466372368.db2.gz OSRZVICJYDFNJX-YPMHNXCESA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@@H](O)[C@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000305183990 466372377 /nfs/dbraw/zinc/37/23/77/466372377.db2.gz OSRZVICJYDFNJX-YPMHNXCESA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@@H](O)C[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000305205381 466378628 /nfs/dbraw/zinc/37/86/28/466378628.db2.gz CJXGTBOWNXLAJM-ZYHUDNBSSA-N 1 1 341.795 2.422 20 5 EEBDMO C[C@@H](O)C[C@H]1CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000305205381 466378637 /nfs/dbraw/zinc/37/86/37/466378637.db2.gz CJXGTBOWNXLAJM-ZYHUDNBSSA-N 1 1 341.795 2.422 20 5 EEBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1 ZINC000347250443 466509200 /nfs/dbraw/zinc/50/92/00/466509200.db2.gz NWJDTAADTTYYAA-TZMCWYRMSA-N 1 1 328.372 2.488 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](N2CCNC2=O)C1 ZINC000368021463 466567506 /nfs/dbraw/zinc/56/75/06/466567506.db2.gz RJAAUZLUKSFAPS-DZGCQCFKSA-N 1 1 332.404 2.454 20 5 EEBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000354465582 466586944 /nfs/dbraw/zinc/58/69/44/466586944.db2.gz YGKFENLFQWICTG-QWHCGFSZSA-N 1 1 343.387 2.053 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000354465582 466586950 /nfs/dbraw/zinc/58/69/50/466586950.db2.gz YGKFENLFQWICTG-QWHCGFSZSA-N 1 1 343.387 2.053 20 5 EEBDMO O=C(Nc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1 ZINC000363824943 466630784 /nfs/dbraw/zinc/63/07/84/466630784.db2.gz MQDYEMURKVSSAH-CVEARBPZSA-N 1 1 348.403 2.360 20 5 EEBDMO Nc1ccc(N2CCC[N@@H+](Cc3ccccc3)CC2)nc1[N+](=O)[O-] ZINC000324010670 466642585 /nfs/dbraw/zinc/64/25/85/466642585.db2.gz LDZXVZVGAHHNRK-UHFFFAOYSA-N 1 1 327.388 2.284 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N(C)CC[N@@H+](C)C2CC2)c1F ZINC000408523650 466678219 /nfs/dbraw/zinc/67/82/19/466678219.db2.gz UKXFCSOOMWAYGE-UHFFFAOYSA-N 1 1 327.331 2.348 20 5 EEBDMO O=C(CC[N@@H+]1CCC[C@@H]1CN1CCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411226982 466788059 /nfs/dbraw/zinc/78/80/59/466788059.db2.gz OIYMRTDUEJJLEO-QGZVFWFLSA-N 1 1 346.431 2.484 20 5 EEBDMO O=C(CC[N@H+]1CCC[C@@H]1CN1CCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411226982 466788061 /nfs/dbraw/zinc/78/80/61/466788061.db2.gz OIYMRTDUEJJLEO-QGZVFWFLSA-N 1 1 346.431 2.484 20 5 EEBDMO C[C@@H]1[C@H](CO)CCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000412066167 466990810 /nfs/dbraw/zinc/99/08/10/466990810.db2.gz CZDCPRVWFVPPAP-YPMHNXCESA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@@H]1[C@H](CO)CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000412066167 466990815 /nfs/dbraw/zinc/99/08/15/466990815.db2.gz CZDCPRVWFVPPAP-YPMHNXCESA-N 1 1 332.360 2.238 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C(C)(C)CN1CCOCC1 ZINC000412097318 467008116 /nfs/dbraw/zinc/00/81/16/467008116.db2.gz OLDLKPIEIPSJQV-UHFFFAOYSA-N 1 1 337.420 2.146 20 5 EEBDMO C[NH+]1CCC(N2CCC(Nc3ncc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000413105207 467170415 /nfs/dbraw/zinc/17/04/15/467170415.db2.gz NDWUMYCZDZAGNS-UHFFFAOYSA-N 1 1 337.399 2.099 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H](O)COCC(F)(F)F)C2CC2)cc1 ZINC000432772826 467262403 /nfs/dbraw/zinc/26/24/03/467262403.db2.gz ALWSUWWSHLXDSF-CQSZACIVSA-N 1 1 348.321 2.499 20 5 EEBDMO CO[C@H]1C[C@H]([N@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])C12CCC2 ZINC000451852939 467273843 /nfs/dbraw/zinc/27/38/43/467273843.db2.gz OOXVUSJIHAZIGH-GJZGRUSLSA-N 1 1 333.388 2.423 20 5 EEBDMO CO[C@H]1C[C@H]([N@@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])C12CCC2 ZINC000451852939 467273845 /nfs/dbraw/zinc/27/38/45/467273845.db2.gz OOXVUSJIHAZIGH-GJZGRUSLSA-N 1 1 333.388 2.423 20 5 EEBDMO CO[C@H]1C[C@@H]([N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000451857275 467274304 /nfs/dbraw/zinc/27/43/04/467274304.db2.gz UGIFTHUHHAFRFY-CVEARBPZSA-N 1 1 347.415 2.447 20 5 EEBDMO CO[C@H]1C[C@@H]([N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000451857275 467274309 /nfs/dbraw/zinc/27/43/09/467274309.db2.gz UGIFTHUHHAFRFY-CVEARBPZSA-N 1 1 347.415 2.447 20 5 EEBDMO C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)C1=CC[N@@H+](C)CC1 ZINC000413726135 467299732 /nfs/dbraw/zinc/29/97/32/467299732.db2.gz RTRUSAHKISYTPZ-AFAVFJNCSA-N 1 1 329.400 2.465 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@@H](CCCO)C3)n2)c1 ZINC000452127665 467333430 /nfs/dbraw/zinc/33/34/30/467333430.db2.gz LHUTXCJQJDJXKZ-GFCCVEGCSA-N 1 1 332.360 2.239 20 5 EEBDMO Cc1c(NC(=O)CC[NH2+][C@@H]2[C@H](C)CCN[C@@H]2C)cccc1[N+](=O)[O-] ZINC000420381197 467386773 /nfs/dbraw/zinc/38/67/73/467386773.db2.gz ZAEHVLAUVVTJBI-CJBNDPTMSA-N 1 1 334.420 2.208 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2c(C(N)=O)cccc2[N+](=O)[O-])C1 ZINC000420584044 467428741 /nfs/dbraw/zinc/42/87/41/467428741.db2.gz KGEXPHFEBCWRSV-BETUJISGSA-N 1 1 334.420 2.474 20 5 EEBDMO CC[N@@H+](CCOc1ccccc1C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000420971140 467522871 /nfs/dbraw/zinc/52/28/71/467522871.db2.gz HMLOQMZTTXRPLX-UHFFFAOYSA-N 1 1 345.399 2.466 20 5 EEBDMO CC(C)C[N@H+](Cc1ccccc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000441542856 467573016 /nfs/dbraw/zinc/57/30/16/467573016.db2.gz HGVFPNLYZYFUSE-QGZVFWFLSA-N 1 1 332.404 2.310 20 5 EEBDMO C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000448945003 467606857 /nfs/dbraw/zinc/60/68/57/467606857.db2.gz GDPGXOXTCPJQDY-SECBINFHSA-N 1 1 331.294 2.390 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000448945003 467606858 /nfs/dbraw/zinc/60/68/58/467606858.db2.gz GDPGXOXTCPJQDY-SECBINFHSA-N 1 1 331.294 2.390 20 5 EEBDMO C[C@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000450474930 467856071 /nfs/dbraw/zinc/85/60/71/467856071.db2.gz UDGPNYSCWTXMPT-ZDUSSCGKSA-N 1 1 344.415 2.424 20 5 EEBDMO C[C@@H]1C[N@@H+](CCN(C)C(=O)/C=C\c2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000493490830 467923932 /nfs/dbraw/zinc/92/39/32/467923932.db2.gz JQUFFPABPCELEH-ZMWOBVFASA-N 1 1 347.415 2.176 20 5 EEBDMO C[C@@H]1C[N@H+](CCN(C)C(=O)/C=C\c2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000493490830 467923934 /nfs/dbraw/zinc/92/39/34/467923934.db2.gz JQUFFPABPCELEH-ZMWOBVFASA-N 1 1 347.415 2.176 20 5 EEBDMO O=C(NC1CC1)c1ccc(NC[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000549852962 468199285 /nfs/dbraw/zinc/19/92/85/468199285.db2.gz JFXUSCUDDAAINK-LBPRGKRZSA-N 1 1 344.415 2.383 20 5 EEBDMO CNc1c(C(=O)N2CCC[C@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000597710849 468646790 /nfs/dbraw/zinc/64/67/90/468646790.db2.gz PGSUBJBUMZJTMJ-QGZVFWFLSA-N 1 1 332.404 2.194 20 5 EEBDMO Cc1sc(S(=O)(=O)N[C@H]2CC[N@@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000594799065 468690889 /nfs/dbraw/zinc/69/08/89/468690889.db2.gz IHODVPRZJUMNBT-JTQLQIEISA-N 1 1 347.462 2.116 20 5 EEBDMO Cc1sc(S(=O)(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000594799065 468690893 /nfs/dbraw/zinc/69/08/93/468690893.db2.gz IHODVPRZJUMNBT-JTQLQIEISA-N 1 1 347.462 2.116 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(OC[C@H](O)C[N@@H+](C)Cc2ccccc2)c1 ZINC000592446730 468700581 /nfs/dbraw/zinc/70/05/81/468700581.db2.gz RSDIHMVHNWSSTI-OAHLLOKOSA-N 1 1 346.383 2.475 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000594957134 468731562 /nfs/dbraw/zinc/73/15/62/468731562.db2.gz NXKGBEBHGYKFAN-ZDUSSCGKSA-N 1 1 335.404 2.328 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1C[C@H]2CCCCN2C1=O ZINC000595052167 468749459 /nfs/dbraw/zinc/74/94/59/468749459.db2.gz RBAVKRVMJYHRFA-ZOWXZIJZSA-N 1 1 333.388 2.407 20 5 EEBDMO COc1cc(C(=O)N2[C@H](C)C[N@@H+](C)[C@H](C)[C@H]2C)cc([N+](=O)[O-])c1C ZINC000593189343 468899210 /nfs/dbraw/zinc/89/92/10/468899210.db2.gz MCFQNRFSYHHKDQ-RAIGVLPGSA-N 1 1 335.404 2.465 20 5 EEBDMO O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598558079 468911790 /nfs/dbraw/zinc/91/17/90/468911790.db2.gz CFXYBNNRXBCMNA-HNNXBMFYSA-N 1 1 347.415 2.212 20 5 EEBDMO C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](CO)Cc1ccccc1 ZINC000595593860 468914526 /nfs/dbraw/zinc/91/45/26/468914526.db2.gz APLLSJFOQXUTEP-OAHLLOKOSA-N 1 1 343.383 2.069 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](CO)Cc1ccccc1 ZINC000595593860 468914531 /nfs/dbraw/zinc/91/45/31/468914531.db2.gz APLLSJFOQXUTEP-OAHLLOKOSA-N 1 1 343.383 2.069 20 5 EEBDMO CN1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@H](CO)C1 ZINC000602717041 469029563 /nfs/dbraw/zinc/02/95/63/469029563.db2.gz XUBVDCCVRAARII-ZDUSSCGKSA-N 1 1 347.440 2.432 20 5 EEBDMO CN1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@H](CO)C1 ZINC000602717041 469029568 /nfs/dbraw/zinc/02/95/68/469029568.db2.gz XUBVDCCVRAARII-ZDUSSCGKSA-N 1 1 347.440 2.432 20 5 EEBDMO COc1cc2c(cc1OC)C[N@H+](CCn1c(C)ncc1[N+](=O)[O-])CC2 ZINC000610677122 469034631 /nfs/dbraw/zinc/03/46/31/469034631.db2.gz PLTBNHQDASKACD-UHFFFAOYSA-N 1 1 346.387 2.175 20 5 EEBDMO COc1cc2c(cc1OC)C[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])CC2 ZINC000610677122 469034635 /nfs/dbraw/zinc/03/46/35/469034635.db2.gz PLTBNHQDASKACD-UHFFFAOYSA-N 1 1 346.387 2.175 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H](C3CCCCC3)C2)c1 ZINC000595881739 469061487 /nfs/dbraw/zinc/06/14/87/469061487.db2.gz VNICZRBQBGGQEG-DOTOQJQBSA-N 1 1 336.436 2.445 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H](C3CCCCC3)C2)c1 ZINC000595881740 469061580 /nfs/dbraw/zinc/06/15/80/469061580.db2.gz VNICZRBQBGGQEG-NVXWUHKLSA-N 1 1 336.436 2.445 20 5 EEBDMO Cc1nn(C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c(C)c1[N+](=O)[O-] ZINC000601957035 469112209 /nfs/dbraw/zinc/11/22/09/469112209.db2.gz SVSQACBCAHOFCZ-KRWDZBQOSA-N 1 1 330.388 2.045 20 5 EEBDMO O=c1[nH]ccc(NCc2cccc(C[NH+]3CCOCC3)c2)c1[N+](=O)[O-] ZINC000596080204 469145222 /nfs/dbraw/zinc/14/52/22/469145222.db2.gz BQWUJAPOWCFUKS-UHFFFAOYSA-N 1 1 344.371 2.140 20 5 EEBDMO Cc1cc(NCCC[N@@H+]2CCC[C@@H]2C(=O)N(C)C)c([N+](=O)[O-])s1 ZINC000596110811 469158474 /nfs/dbraw/zinc/15/84/74/469158474.db2.gz TWFCIOOLVAPWQV-CYBMUJFWSA-N 1 1 340.449 2.319 20 5 EEBDMO C[C@@H]1C[N@H+](CCNc2ccc3cc([N+](=O)[O-])ccc3n2)[C@H](C)CO1 ZINC000596427943 469262393 /nfs/dbraw/zinc/26/23/93/469262393.db2.gz GEMQJNTYXDQWLX-CHWSQXEVSA-N 1 1 330.388 2.664 20 5 EEBDMO C[C@@H]1C[N@@H+](CCNc2ccc3cc([N+](=O)[O-])ccc3n2)[C@H](C)CO1 ZINC000596427943 469262399 /nfs/dbraw/zinc/26/23/99/469262399.db2.gz GEMQJNTYXDQWLX-CHWSQXEVSA-N 1 1 330.388 2.664 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)n1cc(C[N@@H+]2CCC[C@@H]2CO)nn1 ZINC000603252731 469325185 /nfs/dbraw/zinc/32/51/85/469325185.db2.gz PLNFNDGHAQKGNM-CZUORRHYSA-N 1 1 345.403 2.061 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)n1cc(C[N@H+]2CCC[C@@H]2CO)nn1 ZINC000603252731 469325190 /nfs/dbraw/zinc/32/51/90/469325190.db2.gz PLNFNDGHAQKGNM-CZUORRHYSA-N 1 1 345.403 2.061 20 5 EEBDMO CC1(C)CN(c2nc3ccccc3cc2[N+](=O)[O-])CC[N@H+]1CCO ZINC000616063287 469360343 /nfs/dbraw/zinc/36/03/43/469360343.db2.gz GHSSNBQQGNZVHV-UHFFFAOYSA-N 1 1 330.388 2.036 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000618935276 469475837 /nfs/dbraw/zinc/47/58/37/469475837.db2.gz CMUDMSKZCDVEKJ-TZMCWYRMSA-N 1 1 343.387 2.101 20 5 EEBDMO CC[N@H+]1CCN(C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000619584067 469645243 /nfs/dbraw/zinc/64/52/43/469645243.db2.gz VSPGOAQCXXFIPF-AWEZNQCLSA-N 1 1 335.404 2.225 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCc3ccc(O)cc3CC2)c([N+](=O)[O-])c1 ZINC000608866671 469883363 /nfs/dbraw/zinc/88/33/63/469883363.db2.gz PAEIVIFCLIOUKU-UHFFFAOYSA-N 1 1 341.367 2.000 20 5 EEBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000609382851 469923214 /nfs/dbraw/zinc/92/32/14/469923214.db2.gz FKCSHIMQBNAZHJ-ZDUSSCGKSA-N 1 1 328.372 2.290 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000610209674 469988144 /nfs/dbraw/zinc/98/81/44/469988144.db2.gz WNXASGLVSAMPCX-SMDDNHRTSA-N 1 1 332.404 2.382 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCS1 ZINC000181931523 528748196 /nfs/dbraw/zinc/74/81/96/528748196.db2.gz QRQTWBDOWBYIEV-BBRMVZONSA-N 1 1 340.445 2.408 20 5 EEBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000181136996 529023947 /nfs/dbraw/zinc/02/39/47/529023947.db2.gz BNXDXWGNOSPDSL-GFCCVEGCSA-N 1 1 349.387 2.174 20 5 EEBDMO CCO[C@@H]1C[C@H](O)C12CC[NH+](Cc1csc([N+](=O)[O-])c1)CC2 ZINC000266098348 535522214 /nfs/dbraw/zinc/52/22/14/535522214.db2.gz ZXUFVENIXPPRKI-QWHCGFSZSA-N 1 1 326.418 2.408 20 5 EEBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)Cn3ccc4cc([N+](=O)[O-])ccc43)[C@@H]2C1 ZINC000425054933 536487748 /nfs/dbraw/zinc/48/77/48/536487748.db2.gz GDEBYTBBEPCWCJ-WMLDXEAASA-N 1 1 342.399 2.102 20 5 EEBDMO CC(C)[N@@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1CC1 ZINC000726584161 576277681 /nfs/dbraw/zinc/27/76/81/576277681.db2.gz ACVCTUSWYGBHKZ-UHFFFAOYSA-N 1 1 332.360 2.194 20 5 EEBDMO C[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)CC(C)(C)C ZINC000726972017 576363226 /nfs/dbraw/zinc/36/32/26/576363226.db2.gz RHZCQMHMOZRYFH-UHFFFAOYSA-N 1 1 348.447 2.221 20 5 EEBDMO C[N@H+](CCn1cccn1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774626018 577407243 /nfs/dbraw/zinc/40/72/43/577407243.db2.gz JKPRGFRYLCUJEY-UHFFFAOYSA-N 1 1 334.767 2.384 20 5 EEBDMO C[N@@H+](CCn1cccn1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774626018 577407245 /nfs/dbraw/zinc/40/72/45/577407245.db2.gz JKPRGFRYLCUJEY-UHFFFAOYSA-N 1 1 334.767 2.384 20 5 EEBDMO Cn1nccc1[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776279117 577456633 /nfs/dbraw/zinc/45/66/33/577456633.db2.gz XHSMUGWAECVNDF-WMLDXEAASA-N 1 1 330.388 2.241 20 5 EEBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@H]1C ZINC000765930203 577509176 /nfs/dbraw/zinc/50/91/76/577509176.db2.gz PDWVZRNPZCRNTL-GHMZBOCLSA-N 1 1 336.348 2.058 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@H]1C ZINC000765930203 577509177 /nfs/dbraw/zinc/50/91/77/577509177.db2.gz PDWVZRNPZCRNTL-GHMZBOCLSA-N 1 1 336.348 2.058 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1Cn1nccc1[N+](=O)[O-] ZINC000766378520 577518197 /nfs/dbraw/zinc/51/81/97/577518197.db2.gz XJKPWFBHYRHNQI-HUUCEWRRSA-N 1 1 329.404 2.344 20 5 EEBDMO C[C@@]1(CO)CCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000759892953 577653247 /nfs/dbraw/zinc/65/32/47/577653247.db2.gz LWRSFDDISWWKKP-AWEZNQCLSA-N 1 1 327.768 2.034 20 5 EEBDMO C[C@@]1(CO)CCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000759892953 577653248 /nfs/dbraw/zinc/65/32/48/577653248.db2.gz LWRSFDDISWWKKP-AWEZNQCLSA-N 1 1 327.768 2.034 20 5 EEBDMO O=[N+]([O-])c1c(N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)nc2ccccn21 ZINC000763375485 577720197 /nfs/dbraw/zinc/72/01/97/577720197.db2.gz HCMGRJFQTBCVBR-ZIAGYGMSSA-N 1 1 345.403 2.298 20 5 EEBDMO C[N@H+](CCC1CC1)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000746628417 577931299 /nfs/dbraw/zinc/93/12/99/577931299.db2.gz UWFYQRBIBJMPBY-KRWDZBQOSA-N 1 1 346.387 2.051 20 5 EEBDMO C[N@@H+](CCC1CC1)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000746628417 577931300 /nfs/dbraw/zinc/93/13/00/577931300.db2.gz UWFYQRBIBJMPBY-KRWDZBQOSA-N 1 1 346.387 2.051 20 5 EEBDMO O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccc(C(F)F)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001022063553 676629008 /nfs/dbraw/zinc/62/90/08/676629008.db2.gz DHKVUZOVWRQKLB-XJFOESAGSA-N 1 1 339.342 2.026 20 5 EEBDMO CCN1CCN([C@@H](C)C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000892574836 681829082 /nfs/dbraw/zinc/82/90/82/681829082.db2.gz NSKCYPPICRHRJS-ZDUSSCGKSA-N 1 1 340.855 2.364 20 5 EEBDMO C[C@H]1C[C@H](Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000892875650 683159019 /nfs/dbraw/zinc/15/90/19/683159019.db2.gz HPPZRFNXINAJIO-RYUDHWBXSA-N 1 1 342.399 2.484 20 5 EEBDMO O=[N+]([O-])c1cnc2c(Cl)cccc2c1N1CC[N@@H+]2CCOC[C@H]2C1 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Cc1[nH+]ccn1CCCNC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000930344190 1206550889 /nfs/dbraw/zinc/55/08/89/1206550889.db2.gz WACLOXLEDZGSNB-JKSUJKDBSA-N 1 1 328.372 2.410 20 5 EEBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000930369125 1206552880 /nfs/dbraw/zinc/55/28/80/1206552880.db2.gz YMZXLCVBZKCRMZ-VUCTXSBTSA-N 1 1 329.400 2.299 20 5 EEBDMO CC[C@H](C)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)C(N)=O ZINC000931760106 1207457074 /nfs/dbraw/zinc/45/70/74/1207457074.db2.gz ACVUDALODXLIKZ-UFBFGSQYSA-N 1 1 344.209 2.347 20 5 EEBDMO C[C@@H](CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)[N@@H+](C)C1CC1 ZINC000778255992 1207992887 /nfs/dbraw/zinc/99/28/87/1207992887.db2.gz BOTSSERHOWGBLD-JTQLQIEISA-N 1 1 327.331 2.286 20 5 EEBDMO CCCNC(=O)C1CC[NH+](Cn2ncc3ccc([N+](=O)[O-])cc32)CC1 ZINC000042675260 1208311287 /nfs/dbraw/zinc/31/12/87/1208311287.db2.gz HUGIRSJDAAUWSE-UHFFFAOYSA-N 1 1 345.403 2.140 20 5 EEBDMO Cc1nn(C[N@@H+]2CCS[C@@H]3COCC[C@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000245875821 1211985272 /nfs/dbraw/zinc/98/52/72/1211985272.db2.gz MRPVAFIEYAIXRO-GDBMZVCRSA-N 1 1 348.428 2.417 20 5 EEBDMO Cc1nn(C[N@H+]2CCS[C@@H]3COCC[C@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000245875821 1211985279 /nfs/dbraw/zinc/98/52/79/1211985279.db2.gz MRPVAFIEYAIXRO-GDBMZVCRSA-N 1 1 348.428 2.417 20 5 EEBDMO CCCN(CCNC(=O)C[N@@H+](C)CCC)c1ccccc1[N+](=O)[O-] ZINC001101163617 1245470929 /nfs/dbraw/zinc/47/09/29/1245470929.db2.gz ZRWOSUPVGDWUOS-UHFFFAOYSA-N 1 1 336.436 2.269 20 5 EEBDMO CON(C)C(=O)[C@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000858319905 1294081388 /nfs/dbraw/zinc/08/13/88/1294081388.db2.gz KFTMRHZATUVQDE-NSHDSACASA-N 1 1 333.344 2.353 20 5 EEBDMO C[NH+]1CCN(c2ncc(Nc3ccc(F)cc3[N+](=O)[O-])cn2)CC1 ZINC001210951479 1295594014 /nfs/dbraw/zinc/59/40/14/1295594014.db2.gz GQGZUGLOYPCHMX-UHFFFAOYSA-N 1 1 332.339 2.019 20 5 EEBDMO CC[C@@H](NC(=O)N1C[C@H]2CC[N@@H+](C)[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC001230506412 1303234338 /nfs/dbraw/zinc/23/43/38/1303234338.db2.gz SFALOYANEMMMNK-BMFZPTHFSA-N 1 1 332.404 2.391 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799190970 1305180783 /nfs/dbraw/zinc/18/07/83/1305180783.db2.gz VXOZUBXADAJTFH-GJZGRUSLSA-N 1 1 343.383 2.219 20 5 EEBDMO CC[C@H](C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Br)C(N)=O ZINC001119438789 1309073677 /nfs/dbraw/zinc/07/36/77/1309073677.db2.gz ORNWDKAQIVYVKM-UFBFGSQYSA-N 1 1 344.209 2.347 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCn3cnc(CO)c3C1)CC2 ZINC001246703635 1310386336 /nfs/dbraw/zinc/38/63/36/1310386336.db2.gz KLCPKCMYGLJOGQ-OAHLLOKOSA-N 1 1 342.399 2.047 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCn3cnc(CO)c3C1)CC2 ZINC001246703635 1310386354 /nfs/dbraw/zinc/38/63/54/1310386354.db2.gz KLCPKCMYGLJOGQ-OAHLLOKOSA-N 1 1 342.399 2.047 20 5 EEBDMO [NH3+][C@H](Cc1ccccc1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001247505126 1310621962 /nfs/dbraw/zinc/62/19/62/1310621962.db2.gz SPCGJUYEQWYBEJ-LLVKDONJSA-N 1 1 329.291 2.421 20 5 EEBDMO COCC[N@@H+](C)CCCNC(=O)c1cc(Cl)c(C)cc1[N+](=O)[O-] ZINC000836369085 1314991303 /nfs/dbraw/zinc/99/13/03/1314991303.db2.gz DPQBKDOSEMWWRW-UHFFFAOYSA-N 1 1 343.811 2.255 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000840182930 1315319752 /nfs/dbraw/zinc/31/97/52/1315319752.db2.gz BMQAGDMSSBDVPX-MRXNPFEDSA-N 1 1 332.360 2.177 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000840182930 1315319755 /nfs/dbraw/zinc/31/97/55/1315319755.db2.gz BMQAGDMSSBDVPX-MRXNPFEDSA-N 1 1 332.360 2.177 20 5 EEBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccncn2)CC1 ZINC001254564368 1318122812 /nfs/dbraw/zinc/12/28/12/1318122812.db2.gz KRLFIAYKZSMQTM-AWEZNQCLSA-N 1 1 327.388 2.138 20 5 EEBDMO O=C(N1CCCC1)C12CC(C1)C[N@@H+]2[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254596929 1318138698 /nfs/dbraw/zinc/13/86/98/1318138698.db2.gz SMGQJKCFBXMEKJ-IUNXBHMESA-N 1 1 341.411 2.149 20 5 EEBDMO CC(C)CC(=O)N1CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603443 1318141016 /nfs/dbraw/zinc/14/10/16/1318141016.db2.gz NFDSFMZQGRVCQX-QGZVFWFLSA-N 1 1 331.416 2.252 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CC[C@@H](Oc3ncccn3)C1)C2 ZINC001254606588 1318142620 /nfs/dbraw/zinc/14/26/20/1318142620.db2.gz GRUNVOFYSKVLSS-JKSUJKDBSA-N 1 1 326.356 2.005 20 5 EEBDMO COc1cc(N2CCC([N@@H+](C)C[C@@H](C)C[NH3+])CC2)ccc1[N+](=O)[O-] ZINC001256101682 1318647398 /nfs/dbraw/zinc/64/73/98/1318647398.db2.gz ONNIBZRROXFVHM-ZDUSSCGKSA-N 1 1 336.436 2.099 20 5 EEBDMO COc1ccc(C(C)C)cc1C[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001157767030 1318845370 /nfs/dbraw/zinc/84/53/70/1318845370.db2.gz DJWBXONCMALFKD-HZPDHXFCSA-N 1 1 349.431 2.080 20 5 EEBDMO C[C@H]1C[NH+](CCc2nnc(/C=C/c3ccc([N+](=O)[O-])o3)o2)C[C@H](C)O1 ZINC001258045475 1319153066 /nfs/dbraw/zinc/15/30/66/1319153066.db2.gz CTAJFBPJRLJYFV-SCBUBVSKSA-N 1 1 348.359 2.393 20 5 EEBDMO CCOc1nc(NCC[C@@H]2CC[NH2+]CC2(F)F)ccc1[N+](=O)[O-] ZINC001162813668 1320965903 /nfs/dbraw/zinc/96/59/03/1320965903.db2.gz YAFIQXWCDIXAQV-JTQLQIEISA-N 1 1 330.335 2.435 20 5 EEBDMO COc1nc(N[C@H](C[NH+]2CCOCC2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC001162877647 1320980320 /nfs/dbraw/zinc/98/03/20/1320980320.db2.gz LXMGGXOFWHAITQ-CYBMUJFWSA-N 1 1 338.408 2.157 20 5 EEBDMO [NH3+][C@@H]1CN(C(F)(F)c2cc([N+](=O)[O-])cnc2Cl)CCC1(F)F ZINC001164319448 1321350539 /nfs/dbraw/zinc/35/05/39/1321350539.db2.gz GWLGOXUPWMCZBP-MRVPVSSYSA-N 1 1 342.680 2.361 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(c3cc([N+](=O)[O-])cc4c(Cl)ncnc43)C[C@H]2C1 ZINC001165151869 1321466716 /nfs/dbraw/zinc/46/67/16/1321466716.db2.gz SDCJRJAACVYDHD-AOOOYVTPSA-N 1 1 333.779 2.189 20 5 EEBDMO COc1cc(C[NH2+][C@@H](CO)CC(F)(F)F)c([N+](=O)[O-])cc1OC ZINC001262107348 1322235638 /nfs/dbraw/zinc/23/56/38/1322235638.db2.gz KIAYASDEMSZMJX-SECBINFHSA-N 1 1 338.282 2.015 20 5 EEBDMO C[C@@H]1C[C@H]2CC[C@@H](C(=O)NCCc3ccc([N+](=O)[O-])cc3)C[N@H+]2C1 ZINC001263712184 1322506819 /nfs/dbraw/zinc/50/68/19/1322506819.db2.gz XOOHHZKEMQRRTF-FRFSOERESA-N 1 1 331.416 2.374 20 5 EEBDMO CC1(C)CCC[N@H+]1CCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001609145186 1351860601 /nfs/dbraw/zinc/86/06/01/1351860601.db2.gz DIRMEAQZEKVJSK-UHFFFAOYSA-N 1 1 331.380 2.061 20 5 EEBDMO CCOC(=O)C[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001327312066 1334264355 /nfs/dbraw/zinc/26/43/55/1334264355.db2.gz HBNHZDSRUNXREI-HNNXBMFYSA-N 1 1 349.387 2.341 20 5 EEBDMO COc1cc(C[NH2+]Cc2ccccc2[N+](=O)[O-])ccc1-c1nn[nH]n1 ZINC001609344124 1351939453 /nfs/dbraw/zinc/93/94/53/1351939453.db2.gz DEBLBKRSLYKPBP-UHFFFAOYSA-N 1 1 340.343 2.073 20 5 EEBDMO Cn1c2ccccc2c(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1=O ZINC001333630860 1336091563 /nfs/dbraw/zinc/09/15/63/1336091563.db2.gz XEFFXTOEDMHQPL-STQMWFEESA-N 1 1 342.399 2.485 20 5 EEBDMO CNc1nccc(C(=O)OC[C@@H]2CCCC[N@H+]2C(C)C)c1[N+](=O)[O-] ZINC000848790089 1338764607 /nfs/dbraw/zinc/76/46/07/1338764607.db2.gz JRVQGHKXTUJTLM-LBPRGKRZSA-N 1 1 336.392 2.451 20 5 EEBDMO CCC[N@@H+](CC)C[C@@H](C)Nc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590624294 1349378705 /nfs/dbraw/zinc/37/87/05/1349378705.db2.gz IPIMESWTQLMNJZ-LLVKDONJSA-N 1 1 333.396 2.307 20 5 EEBDMO Nc1ccc(NC(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000823921503 1368096298 /nfs/dbraw/zinc/09/62/98/1368096298.db2.gz VSRYVVLXBOCGDO-KBPBESRZSA-N 1 1 333.392 2.315 20 5 EEBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CC1(C)COC1 ZINC000859570829 1369438919 /nfs/dbraw/zinc/43/89/19/1369438919.db2.gz IXSWWGTZMXPAOU-UHFFFAOYSA-N 1 1 325.340 2.031 20 5 EEBDMO O=C(CCc1cnc[nH]1)NCC1(Nc2ccccc2[N+](=O)[O-])CCC1 ZINC001111919985 1371311734 /nfs/dbraw/zinc/31/17/34/1371311734.db2.gz DNAIVHNWJZNXBZ-UHFFFAOYSA-N 1 1 343.387 2.402 20 5 EEBDMO C[C@]([NH3+])(C(=O)Nc1ccc2c(c1)C(=O)OC2)c1cccc([N+](=O)[O-])c1 ZINC001576086751 1403559928 /nfs/dbraw/zinc/55/99/28/1403559928.db2.gz ZZLCUTPCEUHBJP-QGZVFWFLSA-N 1 1 341.323 2.078 20 5 EEBDMO CC(F)(F)C(=O)NCC1=CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001755879339 1407932784 /nfs/dbraw/zinc/93/27/84/1407932784.db2.gz HYRFYZDSBYKBGP-UHFFFAOYSA-N 1 1 339.342 2.498 20 5 EEBDMO Cc1ccnc(N2CC[NH+](CCOc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000265162329 721954224 /nfs/dbraw/zinc/95/42/24/721954224.db2.gz FFQAFCPJOWAJOK-UHFFFAOYSA-N 1 1 342.399 2.499 20 5 EEBDMO C[C@@H]1CC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)[C@@H]1C ZINC000174954877 773407937 /nfs/dbraw/zinc/40/79/37/773407937.db2.gz PXPYZCVCFKWIQL-PSTGCABASA-N 1 1 346.387 2.050 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N(C)CCCN(C)c1ccc([N+](=O)[O-])cc1 ZINC001112120640 780858252 /nfs/dbraw/zinc/85/82/52/780858252.db2.gz DVFOSYZTGDFIFZ-UHFFFAOYSA-N 1 1 336.436 2.221 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NC/C=C/CNc1cccc(F)c1[N+](=O)[O-] ZINC001107231251 786532119 /nfs/dbraw/zinc/53/21/19/786532119.db2.gz BCSLVRDHDPRYDO-SNAWJCMRSA-N 1 1 338.383 2.158 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)[C@@H](C)C1 ZINC000910286610 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RNTXDNFVTHJWEA-WBVHZDCISA-N 1 1 330.388 2.168 20 5 EEBDMO COc1ccc(C(=O)Nc2c[nH+]ccc2-n2cccn2)cc1[N+](=O)[O-] ZINC000358616935 163944162 /nfs/dbraw/zinc/94/41/62/163944162.db2.gz QLDHAFMTQBETNA-UHFFFAOYSA-N 1 1 339.311 2.436 20 5 EEBDMO CCC[C@@H]1CNCC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000359051457 164046954 /nfs/dbraw/zinc/04/69/54/164046954.db2.gz FCTZGUDKLYMYBH-CQSZACIVSA-N 1 1 334.420 2.306 20 5 EEBDMO CCC[C@@H]1CNCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000359051457 164046956 /nfs/dbraw/zinc/04/69/56/164046956.db2.gz FCTZGUDKLYMYBH-CQSZACIVSA-N 1 1 334.420 2.306 20 5 EEBDMO CC(C)[C@@]1(CO)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000368053777 166042804 /nfs/dbraw/zinc/04/28/04/166042804.db2.gz BOONPIPYGYUODN-KRWDZBQOSA-N 1 1 335.404 2.264 20 5 EEBDMO C[C@@H]1C[C@@H](NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000360667402 164360671 /nfs/dbraw/zinc/36/06/71/164360671.db2.gz XCMPHAIJDZSNMN-ZJUUUORDSA-N 1 1 347.824 2.009 20 5 EEBDMO COc1ccc(C(=O)NCc2c[nH+]c3n2CCCC3)cc1[N+](=O)[O-] ZINC000375385092 167123315 /nfs/dbraw/zinc/12/33/15/167123315.db2.gz VPALFORWMRUCCO-UHFFFAOYSA-N 1 1 330.344 2.066 20 5 EEBDMO CCOC(=O)[C@H](C)[C@@H](C)[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000274114254 269023971 /nfs/dbraw/zinc/02/39/71/269023971.db2.gz WDLORGODKDNYGV-GHMZBOCLSA-N 1 1 348.359 2.322 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)CCCCCO ZINC000279835282 269310115 /nfs/dbraw/zinc/31/01/15/269310115.db2.gz ZXFPDCFGTRNRDO-GFCCVEGCSA-N 1 1 339.392 2.025 20 5 EEBDMO COCC[NH+]1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000263790613 274030571 /nfs/dbraw/zinc/03/05/71/274030571.db2.gz XUHWBJNIUACBSO-UHFFFAOYSA-N 1 1 344.209 2.126 20 5 EEBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CC[N@@H+](C)[C@H](Cc2ccccc2)C1 ZINC000288362360 275050501 /nfs/dbraw/zinc/05/05/01/275050501.db2.gz HDRXDJNXVHDMPU-MRXNPFEDSA-N 1 1 343.431 2.483 20 5 EEBDMO O=C(NCc1ccccc1[N+](=O)[O-])c1cc(C[NH+]2CCCC2)on1 ZINC000292571636 275448898 /nfs/dbraw/zinc/44/88/98/275448898.db2.gz KKCGBGUQZBLPFC-UHFFFAOYSA-N 1 1 330.344 2.109 20 5 EEBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(C)c2[nH+]ccn2c1 ZINC000293765916 293289996 /nfs/dbraw/zinc/28/99/96/293289996.db2.gz AIKVJHVYEXFDGR-UHFFFAOYSA-N 1 1 328.332 2.085 20 5 EEBDMO C[C@@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C[C@H](C)[N@H+]1C ZINC000293979586 293342648 /nfs/dbraw/zinc/34/26/48/293342648.db2.gz MVBPLKSEMAKDBG-TXEJJXNPSA-N 1 1 332.404 2.334 20 5 EEBDMO C[C@@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C ZINC000293979586 293342651 /nfs/dbraw/zinc/34/26/51/293342651.db2.gz MVBPLKSEMAKDBG-TXEJJXNPSA-N 1 1 332.404 2.334 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[NH2+]Cc2ccccc21 ZINC000261661769 302043717 /nfs/dbraw/zinc/04/37/17/302043717.db2.gz KQCRTIJLUJYAGD-UHFFFAOYSA-N 1 1 347.396 2.202 20 5 EEBDMO C[C@@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)C1=CC[N@@H+](C)CC1 ZINC000332500388 312016054 /nfs/dbraw/zinc/01/60/54/312016054.db2.gz QZVNAKNBDPHNID-CYBMUJFWSA-N 1 1 344.415 2.313 20 5 EEBDMO COc1c(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000332514798 312018260 /nfs/dbraw/zinc/01/82/60/312018260.db2.gz JMOJYLIIZOWRLB-GXTWGEPZSA-N 1 1 333.388 2.160 20 5 EEBDMO [NH3+]C[C@@H]1CN(C/C=C\c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414780884 313086845 /nfs/dbraw/zinc/08/68/45/313086845.db2.gz MCFQOWUAFCSWIU-OICCZTGUSA-N 1 1 331.416 2.295 20 5 EEBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000421705163 314145802 /nfs/dbraw/zinc/14/58/02/314145802.db2.gz QRIJQDAJMJSMJP-CYBMUJFWSA-N 1 1 325.796 2.343 20 5 EEBDMO C[C@@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])C[NH+]1CCOCC1 ZINC000436384103 314960257 /nfs/dbraw/zinc/96/02/57/314960257.db2.gz FQFHBDBEOSSVEO-JTQLQIEISA-N 1 1 348.325 2.389 20 5 EEBDMO O=[N+]([O-])c1ccccc1OCC[N@H+](CCO)[C@H]1CCCSC1 ZINC000438996801 315062686 /nfs/dbraw/zinc/06/26/86/315062686.db2.gz ICKYFBPUKWEJJB-ZDUSSCGKSA-N 1 1 326.418 2.164 20 5 EEBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1c[nH+]c2n1CCCC2 ZINC000560113770 318764863 /nfs/dbraw/zinc/76/48/63/318764863.db2.gz LWASRQCXMFARKL-UHFFFAOYSA-N 1 1 343.387 2.469 20 5 EEBDMO CC(C)N1CCC([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000564843921 319116905 /nfs/dbraw/zinc/11/69/05/319116905.db2.gz GXAGWSZQAWZUHG-UHFFFAOYSA-N 1 1 334.420 2.386 20 5 EEBDMO C[N@H+]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC1(C)C ZINC000576120258 320143368 /nfs/dbraw/zinc/14/33/68/320143368.db2.gz AWMBWWVCEFPGLU-UHFFFAOYSA-N 1 1 330.388 2.102 20 5 EEBDMO CN(C)S(=O)(=O)c1cccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000326654197 465042745 /nfs/dbraw/zinc/04/27/45/465042745.db2.gz YXWDSRBVKURKEJ-UHFFFAOYSA-N 1 1 349.412 2.135 20 5 EEBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000358416634 465108924 /nfs/dbraw/zinc/10/89/24/465108924.db2.gz DDDHIPBZDAUVEQ-AWEZNQCLSA-N 1 1 349.406 2.467 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)CCC(C)(C)[N+](=O)[O-] ZINC000296209158 465117792 /nfs/dbraw/zinc/11/77/92/465117792.db2.gz FYVLKAQINXTQFV-ZBFHGGJFSA-N 1 1 333.432 2.459 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])C[C@H]2C1 ZINC000296451669 465199893 /nfs/dbraw/zinc/19/98/93/465199893.db2.gz XBBJGGPANTWGFL-AOOOYVTPSA-N 1 1 343.305 2.247 20 5 EEBDMO COCC[N@@H+](C)CCCNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000085620859 462555184 /nfs/dbraw/zinc/55/51/84/462555184.db2.gz NWEOKZAYHDKARC-UHFFFAOYSA-N 1 1 338.408 2.301 20 5 EEBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000045313720 462576676 /nfs/dbraw/zinc/57/66/76/462576676.db2.gz VJYYIYWRVGIPRC-LBPRGKRZSA-N 1 1 328.372 2.100 20 5 EEBDMO CCOc1ccc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc1 ZINC000088523128 462633332 /nfs/dbraw/zinc/63/33/32/462633332.db2.gz HXEJQFJCPGHRGE-CQSZACIVSA-N 1 1 343.387 2.470 20 5 EEBDMO CCOc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc1 ZINC000088523128 462633339 /nfs/dbraw/zinc/63/33/39/462633339.db2.gz HXEJQFJCPGHRGE-CQSZACIVSA-N 1 1 343.387 2.470 20 5 EEBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1 ZINC000063722023 462665397 /nfs/dbraw/zinc/66/53/97/462665397.db2.gz VCLHQOHHVGMELN-UHFFFAOYSA-N 1 1 338.383 2.263 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C)cc1OC[C@H](O)C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000153762977 462688031 /nfs/dbraw/zinc/68/80/31/462688031.db2.gz QHLVLTGIECUPJF-QLFBSQMISA-N 1 1 338.404 2.061 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C)cc1OC[C@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000153762977 462688037 /nfs/dbraw/zinc/68/80/37/462688037.db2.gz QHLVLTGIECUPJF-QLFBSQMISA-N 1 1 338.404 2.061 20 5 EEBDMO Cc1n[nH]c(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)c1[N+](=O)[O-] ZINC000064334705 462695662 /nfs/dbraw/zinc/69/56/62/462695662.db2.gz NXNJLMAYFBYVPN-LBPRGKRZSA-N 1 1 347.375 2.176 20 5 EEBDMO CC[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCS1 ZINC000076072485 462800705 /nfs/dbraw/zinc/80/07/05/462800705.db2.gz RUMXVGRPRGUYNI-DZGCQCFKSA-N 1 1 326.418 2.162 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)CC[C@@H]21 ZINC000155760976 462940230 /nfs/dbraw/zinc/94/02/30/462940230.db2.gz OIVCSOYKZCRMDE-NHYWBVRUSA-N 1 1 348.359 2.059 20 5 EEBDMO CCCNC(=O)[C@H]1CCC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000050995355 463015199 /nfs/dbraw/zinc/01/51/99/463015199.db2.gz RTHOUHRKJRDSSY-AWEZNQCLSA-N 1 1 335.404 2.342 20 5 EEBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1(C)C ZINC000120605690 463017896 /nfs/dbraw/zinc/01/78/96/463017896.db2.gz RMKDIQQAZFLMNC-GJZGRUSLSA-N 1 1 335.404 2.329 20 5 EEBDMO Cn1c[nH+]cc1CCNc1ncc(Br)cc1[N+](=O)[O-] ZINC000096011379 463141750 /nfs/dbraw/zinc/14/17/50/463141750.db2.gz NDGFVUOIBGUAJF-UHFFFAOYSA-N 1 1 326.154 2.140 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOCC12CCC2 ZINC000135547985 463172394 /nfs/dbraw/zinc/17/23/94/463172394.db2.gz JYYGJWONMWLTNE-UHFFFAOYSA-N 1 1 333.388 2.487 20 5 EEBDMO O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000053721566 463185850 /nfs/dbraw/zinc/18/58/50/463185850.db2.gz NUGSMHNSBNSGSY-UHFFFAOYSA-N 1 1 328.372 2.271 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)Cn1cc[nH+]c1C ZINC000054625299 463250314 /nfs/dbraw/zinc/25/03/14/463250314.db2.gz KXNGVJXVANXPNO-LLVKDONJSA-N 1 1 332.360 2.174 20 5 EEBDMO Cc1cc(C(=O)N(C)CC[N@@H+](C)C2CCN(C)CC2)cc([N+](=O)[O-])c1 ZINC000123183504 463323347 /nfs/dbraw/zinc/32/33/47/463323347.db2.gz WWIKFDOWYPXNQN-UHFFFAOYSA-N 1 1 348.447 2.001 20 5 EEBDMO Cc1cc(C(=O)N(C)CCN(C)C2CC[NH+](C)CC2)cc([N+](=O)[O-])c1 ZINC000123183504 463323351 /nfs/dbraw/zinc/32/33/51/463323351.db2.gz WWIKFDOWYPXNQN-UHFFFAOYSA-N 1 1 348.447 2.001 20 5 EEBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC(C)(C)CN1CCOCC1 ZINC000124437220 463422817 /nfs/dbraw/zinc/42/28/17/463422817.db2.gz JFOFIQOAWWONIF-UHFFFAOYSA-N 1 1 335.448 2.428 20 5 EEBDMO C[C@@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H](C)S1 ZINC000072771791 463542353 /nfs/dbraw/zinc/54/23/53/463542353.db2.gz VNKXHOHLKZFNDV-TXEJJXNPSA-N 1 1 335.429 2.310 20 5 EEBDMO C[C@@H]1C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H](C)S1 ZINC000072771791 463542357 /nfs/dbraw/zinc/54/23/57/463542357.db2.gz VNKXHOHLKZFNDV-TXEJJXNPSA-N 1 1 335.429 2.310 20 5 EEBDMO CC(C)[N@H+](CC(=O)N1C[C@@H](C)O[C@@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000125763791 463576336 /nfs/dbraw/zinc/57/63/36/463576336.db2.gz SBKPXXWMMATWML-GASCZTMLSA-N 1 1 349.431 2.441 20 5 EEBDMO CC(C)[N@@H+](CC(=O)N1C[C@@H](C)O[C@@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000125763791 463576339 /nfs/dbraw/zinc/57/63/39/463576339.db2.gz SBKPXXWMMATWML-GASCZTMLSA-N 1 1 349.431 2.441 20 5 EEBDMO COCC[NH+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000073092637 463582531 /nfs/dbraw/zinc/58/25/31/463582531.db2.gz PVKGQCZAZBZTRP-UHFFFAOYSA-N 1 1 333.310 2.382 20 5 EEBDMO O=C(NCc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000073100406 463583418 /nfs/dbraw/zinc/58/34/18/463583418.db2.gz UNDDIRJVARKHPQ-QGZVFWFLSA-N 1 1 340.383 2.271 20 5 EEBDMO O=C(NCc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@H+]1Cc1ccccn1 ZINC000073100406 463583422 /nfs/dbraw/zinc/58/34/22/463583422.db2.gz UNDDIRJVARKHPQ-QGZVFWFLSA-N 1 1 340.383 2.271 20 5 EEBDMO C[NH+](C)[C@H]1CCC[C@@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000177451906 463707866 /nfs/dbraw/zinc/70/78/66/463707866.db2.gz HRTGWPWBZQMABD-MNOVXSKESA-N 1 1 331.376 2.074 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](Cn3ccnn3)C2)c([N+](=O)[O-])c1 ZINC000194080344 463787543 /nfs/dbraw/zinc/78/75/43/463787543.db2.gz NJYBOLYAFLAKKP-LBPRGKRZSA-N 1 1 346.347 2.007 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](Cn3ccnn3)C2)c([N+](=O)[O-])c1 ZINC000194080344 463787547 /nfs/dbraw/zinc/78/75/47/463787547.db2.gz NJYBOLYAFLAKKP-LBPRGKRZSA-N 1 1 346.347 2.007 20 5 EEBDMO Cc1cccc(CC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1 ZINC000568744796 468381642 /nfs/dbraw/zinc/38/16/42/468381642.db2.gz GBINSEYSUPIYSV-HNNXBMFYSA-N 1 1 327.388 2.422 20 5 EEBDMO CCOC(=O)c1ccnc(N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c1[N+](=O)[O-] ZINC000269113378 463879520 /nfs/dbraw/zinc/87/95/20/463879520.db2.gz YHFDGWLOKZOOTK-TZMCWYRMSA-N 1 1 348.403 2.087 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1cccs1 ZINC000269161986 463894137 /nfs/dbraw/zinc/89/41/37/463894137.db2.gz YICFTBJKTCFCGX-ZDUSSCGKSA-N 1 1 335.385 2.395 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000194618800 463896414 /nfs/dbraw/zinc/89/64/14/463896414.db2.gz OWPZKOUCNXHJBP-OLZOCXBDSA-N 1 1 333.388 2.302 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1CCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000194773023 463926049 /nfs/dbraw/zinc/92/60/49/463926049.db2.gz NJTCFJRCXLBSFT-CYBMUJFWSA-N 1 1 341.433 2.138 20 5 EEBDMO CCC[C@]1(COC)CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000194935621 463962116 /nfs/dbraw/zinc/96/21/16/463962116.db2.gz VTYGUPOYGZCQMN-QGZVFWFLSA-N 1 1 335.404 2.475 20 5 EEBDMO CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)N1CCN(C)CC1 ZINC000283919555 464042290 /nfs/dbraw/zinc/04/22/90/464042290.db2.gz DOYMWDNHKIYORY-KBXCAEBGSA-N 1 1 349.479 2.100 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccccc1Cl ZINC000179165170 464072309 /nfs/dbraw/zinc/07/23/09/464072309.db2.gz KBKLLRVGAPIZCQ-NSHDSACASA-N 1 1 337.767 2.004 20 5 EEBDMO C[C@H](O)C[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000269810958 464102308 /nfs/dbraw/zinc/10/23/08/464102308.db2.gz OTBCTOXOJPGYBQ-JQWIXIFHSA-N 1 1 341.795 2.422 20 5 EEBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000269810958 464102313 /nfs/dbraw/zinc/10/23/13/464102313.db2.gz OTBCTOXOJPGYBQ-JQWIXIFHSA-N 1 1 341.795 2.422 20 5 EEBDMO C[N@H+]1CC[C@H]2OCCN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)[C@@H]2C1 ZINC000284447972 464194920 /nfs/dbraw/zinc/19/49/20/464194920.db2.gz CJJDYZBAPFFZPV-CHWSQXEVSA-N 1 1 343.330 2.106 20 5 EEBDMO CCN(CCC[NH+]1CCCC1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000188117197 464203831 /nfs/dbraw/zinc/20/38/31/464203831.db2.gz NIWNUBSYWLTHCH-UHFFFAOYSA-N 1 1 345.403 2.419 20 5 EEBDMO C[N@H+]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000270259435 464236591 /nfs/dbraw/zinc/23/65/91/464236591.db2.gz XAEWPFVFHJNSRM-UHFFFAOYSA-N 1 1 331.294 2.391 20 5 EEBDMO O=C1NC[C@H]2C[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CCN12 ZINC000180479946 464320063 /nfs/dbraw/zinc/32/00/63/464320063.db2.gz ICCBKAAUOAUMNA-AWEZNQCLSA-N 1 1 342.355 2.064 20 5 EEBDMO O=C1NC[C@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CCN12 ZINC000180479946 464320066 /nfs/dbraw/zinc/32/00/66/464320066.db2.gz ICCBKAAUOAUMNA-AWEZNQCLSA-N 1 1 342.355 2.064 20 5 EEBDMO CCCC[N@@H+](CCOC)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000264553380 464369966 /nfs/dbraw/zinc/36/99/66/464369966.db2.gz KAHHSSGSNGQRHO-HNNXBMFYSA-N 1 1 326.393 2.083 20 5 EEBDMO CNC(=O)[C@@]1(C)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000281257410 464389736 /nfs/dbraw/zinc/38/97/36/464389736.db2.gz VGFFTJXDDKCJSP-KRWDZBQOSA-N 1 1 335.404 2.340 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](CO)CC2)cccc1[N+](=O)[O-] ZINC000293357121 464401818 /nfs/dbraw/zinc/40/18/18/464401818.db2.gz ZQQLODPFEJJHPF-CQSZACIVSA-N 1 1 335.404 2.326 20 5 EEBDMO CSc1ccc([C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000294230813 464438942 /nfs/dbraw/zinc/43/89/42/464438942.db2.gz AQONBOGYFGQAFK-GFCCVEGCSA-N 1 1 349.416 2.073 20 5 EEBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)CCC(C)(C)[N+](=O)[O-])cn1 ZINC000294353263 464474755 /nfs/dbraw/zinc/47/47/55/464474755.db2.gz GRHXVDKWKQYLMW-UHFFFAOYSA-N 1 1 331.376 2.027 20 5 EEBDMO CCC[N@@H+](CCO)Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000272237617 464531165 /nfs/dbraw/zinc/53/11/65/464531165.db2.gz FVWBLOYGEWYEAL-UHFFFAOYSA-N 1 1 348.346 2.452 20 5 EEBDMO CCCC[N@@H+](CCCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000182140731 464581690 /nfs/dbraw/zinc/58/16/90/464581690.db2.gz GQSWVPKSBWSEJX-UHFFFAOYSA-N 1 1 339.392 2.026 20 5 EEBDMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000246696137 464612340 /nfs/dbraw/zinc/61/23/40/464612340.db2.gz IVMDIJCMKIQPEW-ZWNOBZJWSA-N 1 1 340.330 2.123 20 5 EEBDMO C[C@@H](c1cccnc1)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182287634 464619816 /nfs/dbraw/zinc/61/98/16/464619816.db2.gz IPUQKLQUPDVAOP-ZFWWWQNUSA-N 1 1 331.372 2.423 20 5 EEBDMO C[C@@H](c1ccncc1)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182287104 464620483 /nfs/dbraw/zinc/62/04/83/464620483.db2.gz IJIYPPHVUVEKAD-ZFWWWQNUSA-N 1 1 331.372 2.423 20 5 EEBDMO O=C1NC[C@H]2C[N@H+](Cc3cc(=O)oc4ccc5ccccc5c34)CCN12 ZINC000175919046 464659243 /nfs/dbraw/zinc/65/92/43/464659243.db2.gz UEBUNMSLFJUWSS-HNNXBMFYSA-N 1 1 349.390 2.156 20 5 EEBDMO O=C1NC[C@H]2C[N@@H+](Cc3cc(=O)oc4ccc5ccccc5c34)CCN12 ZINC000175919046 464659249 /nfs/dbraw/zinc/65/92/49/464659249.db2.gz UEBUNMSLFJUWSS-HNNXBMFYSA-N 1 1 349.390 2.156 20 5 EEBDMO CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1ccccc1C ZINC000176192859 464716300 /nfs/dbraw/zinc/71/63/00/464716300.db2.gz DZKDNYGLJRUJQZ-UHFFFAOYSA-N 1 1 345.403 2.450 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(CCn2ccc([N+](=O)[O-])n2)C1 ZINC000176244410 464728965 /nfs/dbraw/zinc/72/89/65/464728965.db2.gz HRZQRCFRBCAGCO-HZPDHXFCSA-N 1 1 335.452 2.378 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCC[C@H]1S(C)(=O)=O ZINC000182829491 464736935 /nfs/dbraw/zinc/73/69/35/464736935.db2.gz FPZBVPHKXWVFBR-UKRRQHHQSA-N 1 1 342.417 2.049 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)c1 ZINC000282373543 464794017 /nfs/dbraw/zinc/79/40/17/464794017.db2.gz ABEOJGMULRSTPO-GDBMZVCRSA-N 1 1 333.388 2.350 20 5 EEBDMO C[C@@H](c1ccccc1)[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000266750733 464808598 /nfs/dbraw/zinc/80/85/98/464808598.db2.gz PRYWAFCQXGYRTC-GUYCJALGSA-N 1 1 330.388 2.378 20 5 EEBDMO C[C@H]1C[C@H](N2CCOCC2)C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000286231450 464847134 /nfs/dbraw/zinc/84/71/34/464847134.db2.gz ZDXACXXNTJRQRL-JSGCOSHPSA-N 1 1 346.387 2.031 20 5 EEBDMO C[C@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000286231450 464847140 /nfs/dbraw/zinc/84/71/40/464847140.db2.gz ZDXACXXNTJRQRL-JSGCOSHPSA-N 1 1 346.387 2.031 20 5 EEBDMO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)NCCF ZINC000282543613 464858450 /nfs/dbraw/zinc/85/84/50/464858450.db2.gz CHVSJRYEWNWTAN-NSHDSACASA-N 1 1 335.335 2.419 20 5 EEBDMO C[C@@H]1[C@H](Cc2ccccc2)CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266958926 464885521 /nfs/dbraw/zinc/88/55/21/464885521.db2.gz XEBDVWYRURWUTD-UWWQBHOKSA-N 1 1 344.415 2.105 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000298737115 465489076 /nfs/dbraw/zinc/48/90/76/465489076.db2.gz NCGXTJBAKCNCSW-OCCSQVGLSA-N 1 1 334.376 2.352 20 5 EEBDMO Cc1[nH+]ccn1CCCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276355814 464902667 /nfs/dbraw/zinc/90/26/67/464902667.db2.gz UZNYRPBDOXJHMD-UHFFFAOYSA-N 1 1 338.389 2.005 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC3(CCC3)[C@@H]2c2ccccc2)c1 ZINC000295903876 465001112 /nfs/dbraw/zinc/00/11/12/465001112.db2.gz GTRJNTHKIWUVRL-SJORKVTESA-N 1 1 342.399 2.379 20 5 EEBDMO C[N@H+]1CCCC[C@H]1CCn1cc(Br)c(=O)c([N+](=O)[O-])c1 ZINC000330506456 465686133 /nfs/dbraw/zinc/68/61/33/465686133.db2.gz HIUAOVFVJWPTRE-JTQLQIEISA-N 1 1 344.209 2.393 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C)CCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000331007263 465895606 /nfs/dbraw/zinc/89/56/06/465895606.db2.gz TVUXHXHBRCTRLV-OAHLLOKOSA-N 1 1 345.403 2.417 20 5 EEBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000301114811 465905629 /nfs/dbraw/zinc/90/56/29/465905629.db2.gz PDMKUSHVMJWOIS-QWHCGFSZSA-N 1 1 334.420 2.487 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@H](CO)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000353511425 465943702 /nfs/dbraw/zinc/94/37/02/465943702.db2.gz OXFYUSVHINOBIW-HOCLYGCPSA-N 1 1 330.388 2.026 20 5 EEBDMO COc1cc(N2CC[NH+](Cc3cccnc3)CC2)ccc1[N+](=O)[O-] ZINC000301372263 465952001 /nfs/dbraw/zinc/95/20/01/465952001.db2.gz UCSUXWKHNOBRJX-UHFFFAOYSA-N 1 1 328.372 2.321 20 5 EEBDMO CS(=O)(=O)c1cccc(NC2CC[NH+](C3CC3)CC2)c1[N+](=O)[O-] ZINC000301859949 466048157 /nfs/dbraw/zinc/04/81/57/466048157.db2.gz BZQQQFJZMHFVSF-UHFFFAOYSA-N 1 1 339.417 2.037 20 5 EEBDMO C[N@H+]1CCO[C@@H]2CN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])C[C@@H]21 ZINC000357616887 466179883 /nfs/dbraw/zinc/17/98/83/466179883.db2.gz KDZCOIJEZVIKDC-NWDGAFQWSA-N 1 1 332.187 2.421 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)c1cc[nH+]c(C)c1 ZINC000361823671 466322728 /nfs/dbraw/zinc/32/27/28/466322728.db2.gz WQYYJXXELTVWJR-UHFFFAOYSA-N 1 1 337.357 2.132 20 5 EEBDMO C[N@H+](Cc1ccc(Cl)c(F)c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000305709903 466432201 /nfs/dbraw/zinc/43/22/01/466432201.db2.gz XFJGMYJLHHEVEM-LBPRGKRZSA-N 1 1 342.758 2.077 20 5 EEBDMO Cn1cc[nH+]c1N1CCN(C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000597253614 468497440 /nfs/dbraw/zinc/49/74/40/468497440.db2.gz FGRKAFFQKJNYAN-XQRVVYSFSA-N 1 1 327.388 2.164 20 5 EEBDMO O=C(Nc1cccc([N+](=O)[O-])c1)N[C@H]1CCCC[C@@H]1[NH+]1CCOCC1 ZINC000363824945 466631349 /nfs/dbraw/zinc/63/13/49/466631349.db2.gz MQDYEMURKVSSAH-HOTGVXAUSA-N 1 1 348.403 2.360 20 5 EEBDMO CC(C)Oc1cc(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000411616100 466856524 /nfs/dbraw/zinc/85/65/24/466856524.db2.gz JGBPCYDJKHYJAU-CYBMUJFWSA-N 1 1 333.388 2.349 20 5 EEBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1)c1ccc([N+](=O)[O-])o1 ZINC000428546469 467245775 /nfs/dbraw/zinc/24/57/75/467245775.db2.gz NBASQRPYTQULFA-ZDUSSCGKSA-N 1 1 331.328 2.007 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](O)C12CCCC2 ZINC000433034777 467285972 /nfs/dbraw/zinc/28/59/72/467285972.db2.gz ULHNDTWSBUTDHG-HNNXBMFYSA-N 1 1 333.388 2.221 20 5 EEBDMO CC[C@@H](NC(=O)CCCN1CCC([NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000433145266 467298692 /nfs/dbraw/zinc/29/86/92/467298692.db2.gz GLLVRHMMQPGPKC-QGZVFWFLSA-N 1 1 348.447 2.365 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@@H]1CC[N@H+](C(C)C)C1 ZINC000452103281 467323732 /nfs/dbraw/zinc/32/37/32/467323732.db2.gz KDLHTDHSMVLFOY-CYBMUJFWSA-N 1 1 341.433 2.006 20 5 EEBDMO COc1ccc(OCC[N@H+]2CC(C)(C)[C@@H]3COC[C@@H]32)c([N+](=O)[O-])c1 ZINC000452111921 467326768 /nfs/dbraw/zinc/32/67/68/467326768.db2.gz WFWGGZSHLRVJNT-HIFRSBDPSA-N 1 1 336.388 2.339 20 5 EEBDMO Cc1cc(C(=O)N2CCC3(CCC[N@@H+]3C)CC2)c(N)c([N+](=O)[O-])c1 ZINC000378510162 467327429 /nfs/dbraw/zinc/32/74/29/467327429.db2.gz CJSNVGAIVXRFAU-UHFFFAOYSA-N 1 1 332.404 2.186 20 5 EEBDMO CCCN(CCOc1ccc(OC)cc1[N+](=O)[O-])C1CC[NH2+]CC1 ZINC000431070430 467491908 /nfs/dbraw/zinc/49/19/08/467491908.db2.gz KZOGHOPQMRLLDE-UHFFFAOYSA-N 1 1 337.420 2.446 20 5 EEBDMO CC(C)C[N@H+](Cc1ccccc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000441542855 467572936 /nfs/dbraw/zinc/57/29/36/467572936.db2.gz HGVFPNLYZYFUSE-KRWDZBQOSA-N 1 1 332.404 2.310 20 5 EEBDMO CCCN(CC[NH+](C)C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000448907210 467605287 /nfs/dbraw/zinc/60/52/87/467605287.db2.gz 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ZINC000157171669 1208369585 /nfs/dbraw/zinc/36/95/85/1208369585.db2.gz NEKCCGXZMKDKBK-UHFFFAOYSA-N 1 1 344.400 2.442 20 5 EEBDMO C[N@@H+](CCc1nccs1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000157171669 1208369588 /nfs/dbraw/zinc/36/95/88/1208369588.db2.gz NEKCCGXZMKDKBK-UHFFFAOYSA-N 1 1 344.400 2.442 20 5 EEBDMO COC[C@H]1CCC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000112960287 1226369547 /nfs/dbraw/zinc/36/95/47/1226369547.db2.gz RXHSYEQUGIXBMZ-ZDUSSCGKSA-N 1 1 331.376 2.169 20 5 EEBDMO O=C(N[C@H]1C[C@H]([NH2+]Cc2cccc(C(F)F)c2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001020139656 1229505428 /nfs/dbraw/zinc/50/54/28/1229505428.db2.gz KIWRIPLZIFKKIK-AAVRWANBSA-N 1 1 339.342 2.026 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC([N@@H+](CC2CC2)CC2CCC2)CC1 ZINC001039485495 1230650966 /nfs/dbraw/zinc/65/09/66/1230650966.db2.gz BBERHBUAWPMDFA-IAGOWNOFSA-N 1 1 335.448 2.155 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([N@H+](CC2CC2)CC2CCC2)CC1 ZINC001039485495 1230650971 /nfs/dbraw/zinc/65/09/71/1230650971.db2.gz BBERHBUAWPMDFA-IAGOWNOFSA-N 1 1 335.448 2.155 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([N@@H+](CC2CC2)CC2CCC2)CC1 ZINC001039485495 1230650972 /nfs/dbraw/zinc/65/09/72/1230650972.db2.gz BBERHBUAWPMDFA-IAGOWNOFSA-N 1 1 335.448 2.155 20 5 EEBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2ccccc2F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050326081 1243351812 /nfs/dbraw/zinc/35/18/12/1243351812.db2.gz QSQMUDGKAPXJGJ-DNNBLBMLSA-N 1 1 349.406 2.256 20 5 EEBDMO CN1CCN(c2cc[nH+]cc2Nc2cc(O)cc([N+](=O)[O-])c2)CC1 ZINC001199828559 1285871130 /nfs/dbraw/zinc/87/11/30/1285871130.db2.gz MMCWYNKZNXSTGH-UHFFFAOYSA-N 1 1 329.360 2.191 20 5 EEBDMO Cn1nccc1[C@@H](O)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000856799307 1293636735 /nfs/dbraw/zinc/63/67/35/1293636735.db2.gz PRSLBGLINRXRIC-KRWDZBQOSA-N 1 1 348.378 2.413 20 5 EEBDMO O=c1[nH]cnc(O[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001228143893 1302123681 /nfs/dbraw/zinc/12/36/81/1302123681.db2.gz QXCRYVZMVWJYOX-ZDUSSCGKSA-N 1 1 330.344 2.134 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1[O-] ZINC001228811000 1302462209 /nfs/dbraw/zinc/46/22/09/1302462209.db2.gz MHWVBSBGVOGXPD-URLYPYJESA-N 1 1 336.344 2.091 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1O ZINC001228811000 1302462243 /nfs/dbraw/zinc/46/22/43/1302462243.db2.gz MHWVBSBGVOGXPD-URLYPYJESA-N 1 1 336.344 2.091 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1O ZINC001228811000 1302462248 /nfs/dbraw/zinc/46/22/48/1302462248.db2.gz MHWVBSBGVOGXPD-URLYPYJESA-N 1 1 336.344 2.091 20 5 EEBDMO CO[C@@H]1CC[N@@H+](CCOc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC001229140617 1302639269 /nfs/dbraw/zinc/63/92/69/1302639269.db2.gz FMWNOCRPBVYVJF-GFCCVEGCSA-N 1 1 345.193 2.457 20 5 EEBDMO CC[C@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@H]1[NH3+] ZINC000843376787 1315903476 /nfs/dbraw/zinc/90/34/76/1315903476.db2.gz DJWNIKAXVUGQHP-SMDDNHRTSA-N 1 1 338.383 2.122 20 5 EEBDMO COC(=O)[C@H]1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254473866 1318082558 /nfs/dbraw/zinc/08/25/58/1318082558.db2.gz IWNBHVWWTKRXGB-ZDUSSCGKSA-N 1 1 333.388 2.059 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CC[C@H](O)C[C@H]3C)CC2)ccc1[N+](=O)[O-] ZINC001256100991 1318646863 /nfs/dbraw/zinc/64/68/63/1318646863.db2.gz XNKFBJSGVFNZLU-CJNGLKHVSA-N 1 1 349.431 2.417 20 5 EEBDMO COC(=O)[C@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C(F)(F)F ZINC001159879495 1320011207 /nfs/dbraw/zinc/01/12/07/1320011207.db2.gz PNGDRAJTXYBBOR-ZWNMCFTASA-N 1 1 348.281 2.038 20 5 EEBDMO C[NH+](C)/C=C/c1cc(NCCO[C@H]2CCCCO2)ncc1[N+](=O)[O-] ZINC001160923804 1320317571 /nfs/dbraw/zinc/31/75/71/1320317571.db2.gz RETCCUMKDFKCJB-BVBGJJFLSA-N 1 1 336.392 2.477 20 5 EEBDMO COc1cc(C)c([N+](=O)[O-])cc1NCC1(N(C)C)CC[NH+](C)CC1 ZINC001164213109 1321319640 /nfs/dbraw/zinc/31/96/40/1321319640.db2.gz PAAUWEOKCCWVIX-UHFFFAOYSA-N 1 1 336.436 2.350 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(C(F)(F)c3cnc(Cl)c([N+](=O)[O-])c3)C[C@H]2C1 ZINC001165144329 1321465170 /nfs/dbraw/zinc/46/51/70/1321465170.db2.gz HWMDMKHPXGOPDU-DTORHVGOSA-N 1 1 332.738 2.186 20 5 EEBDMO C[N@@H+](C1CN(c2ncc([N+](=O)[O-])c3ccccc32)C1)[C@@H]1CCOC1 ZINC001165205924 1321472651 /nfs/dbraw/zinc/47/26/51/1321472651.db2.gz YJHDWFJWOKRUFL-GFCCVEGCSA-N 1 1 328.372 2.052 20 5 EEBDMO O=[N+]([O-])c1cnccc1Nc1ccc(N2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC001307197865 1331516194 /nfs/dbraw/zinc/51/61/94/1331516194.db2.gz GKJSJFGALIBHHX-MRXNPFEDSA-N 1 1 339.399 2.440 20 5 EEBDMO C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccnn1C ZINC001308017893 1331558201 /nfs/dbraw/zinc/55/82/01/1331558201.db2.gz XSMRJGYFJUFZIK-VIFPVBQESA-N 1 1 337.767 2.271 20 5 EEBDMO CC(C)[N@@H+](CCc1ccccc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC001319181896 1332661325 /nfs/dbraw/zinc/66/13/25/1332661325.db2.gz RGOXBTCIVONKOA-KRWDZBQOSA-N 1 1 332.404 2.105 20 5 EEBDMO Cc1cc(NCCCC[N@H+](C)C2CC2)c(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001609409205 1351965150 /nfs/dbraw/zinc/96/51/50/1351965150.db2.gz BACBQKPOULBETD-UHFFFAOYSA-N 1 1 345.407 2.370 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@H]3OCCC[C@@H]3C1)OCCO2 ZINC001337033244 1336633829 /nfs/dbraw/zinc/63/38/29/1336633829.db2.gz SBUGOVHYAGCTGI-DOMZBBRYSA-N 1 1 334.372 2.367 20 5 EEBDMO C[N@H+]1CCCC[C@H]1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC001339266773 1336982982 /nfs/dbraw/zinc/98/29/82/1336982982.db2.gz WEDUNCJICRNARK-HNNXBMFYSA-N 1 1 346.431 2.409 20 5 EEBDMO COc1ccc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC001579225666 1344354614 /nfs/dbraw/zinc/35/46/14/1344354614.db2.gz SKNWPJSCDIIECC-KRWDZBQOSA-N 1 1 345.355 2.425 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNc1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1 ZINC001589136864 1348964883 /nfs/dbraw/zinc/96/48/83/1348964883.db2.gz UBTLQASPBAQHEC-LLVKDONJSA-N 1 1 331.380 2.060 20 5 EEBDMO CC(C)CCC(N)=[NH+]OCc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001589587241 1349006734 /nfs/dbraw/zinc/00/67/34/1349006734.db2.gz VKXASTLDMLUWRP-UHFFFAOYSA-N 1 1 333.352 2.210 20 5 EEBDMO C[C@H](CNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC001590259542 1349233853 /nfs/dbraw/zinc/23/38/53/1349233853.db2.gz LCDMXGFESNUJLG-VXGBXAGGSA-N 1 1 345.407 2.307 20 5 EEBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[N@H+]1CCC[C@@H](C)C1 ZINC001590259676 1349235734 /nfs/dbraw/zinc/23/57/34/1349235734.db2.gz LWXMNDAFVBQVST-NEPJUHHUSA-N 1 1 345.407 2.307 20 5 EEBDMO C[C@H](CNc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC001603895462 1350796618 /nfs/dbraw/zinc/79/66/18/1350796618.db2.gz LJGLFLDLPRASQV-NWDGAFQWSA-N 1 1 345.407 2.450 20 5 EEBDMO C[C@H](CNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC001603893742 1350797248 /nfs/dbraw/zinc/79/72/48/1350797248.db2.gz AMVSXJJSFJGPIN-NWDGAFQWSA-N 1 1 345.407 2.450 20 5 EEBDMO C[C@H](O)C[C@@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1 ZINC000853504367 1369340886 /nfs/dbraw/zinc/34/08/86/1369340886.db2.gz QHWJRMAVHVUFAC-STQMWFEESA-N 1 1 331.376 2.046 20 5 EEBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1 ZINC000853504367 1369340887 /nfs/dbraw/zinc/34/08/87/1369340887.db2.gz QHWJRMAVHVUFAC-STQMWFEESA-N 1 1 331.376 2.046 20 5 EEBDMO COC(=O)N1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC001119248515 1371790303 /nfs/dbraw/zinc/79/03/03/1371790303.db2.gz LGLMLGGLSXMLSR-UHFFFAOYSA-N 1 1 337.376 2.138 20 5 EEBDMO C[C@]([NH3+])(C(=O)Nc1cccc2nccn21)c1cccc([N+](=O)[O-])c1 ZINC001576086285 1403559965 /nfs/dbraw/zinc/55/99/65/1403559965.db2.gz QOFZJBAJRCXIGM-MRXNPFEDSA-N 1 1 325.328 2.055 20 5 EEBDMO C[C@@]([NH3+])(C(=O)Nc1n[nH]c2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC001576086113 1403560154 /nfs/dbraw/zinc/56/01/54/1403560154.db2.gz PNRIHFQMQZNVDJ-INIZCTEOSA-N 1 1 343.318 2.423 20 5 EEBDMO Cc1nc(N2CC[NH+](CCOc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000268468908 721951906 /nfs/dbraw/zinc/95/19/06/721951906.db2.gz IWMMYAIKLVKJDX-UHFFFAOYSA-N 1 1 342.399 2.499 20 5 EEBDMO O=[N+]([O-])c1cnc(Cl)cc1N1CC[NH+](CCc2ccccn2)CC1 ZINC001165054437 722009899 /nfs/dbraw/zinc/00/98/99/722009899.db2.gz YBNGLLHAMPZNRG-UHFFFAOYSA-N 1 1 347.806 2.403 20 5 EEBDMO Cc1[nH]ccc1C(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001031605822 770112344 /nfs/dbraw/zinc/11/23/44/770112344.db2.gz LSYTUVMOKYITHS-UHFFFAOYSA-N 1 1 328.372 2.093 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000920275796 770649060 /nfs/dbraw/zinc/64/90/60/770649060.db2.gz LKQHZNUHAGUNHH-KRWDZBQOSA-N 1 1 346.431 2.118 20 5 EEBDMO Cn1cc([C@H]2C[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2(C)C)cn1 ZINC000846929988 790733738 /nfs/dbraw/zinc/73/37/38/790733738.db2.gz FFKHRVACWJYITI-IAGOWNOFSA-N 1 1 344.415 2.487 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NC[C@H]1C[C@H](Nc2ncccc2[N+](=O)[O-])C1 ZINC001091469449 790936861 /nfs/dbraw/zinc/93/68/61/790936861.db2.gz DAESEHPLWVDQRR-HDJSIYSDSA-N 1 1 349.435 2.028 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H](C2CC2)[C@H]2CNCCO2)c1 ZINC000817907119 785061958 /nfs/dbraw/zinc/06/19/58/785061958.db2.gz KFLIPCKYFNUCOQ-CABCVRRESA-N 1 1 325.796 2.105 20 5 EEBDMO C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)CC12CCCCC2 ZINC000908573742 785539962 /nfs/dbraw/zinc/53/99/62/785539962.db2.gz ONWCRZZERDUIGL-UHFFFAOYSA-N 1 1 332.404 2.268 20 5 EEBDMO C[N@H+]1CC[C@]2(CCN(C(=O)[C@H]3C[C@H]3c3cccc([N+](=O)[O-])c3)C2)C1 ZINC000820342675 785879679 /nfs/dbraw/zinc/87/96/79/785879679.db2.gz MXTGRORRZFMLER-BQFCYCMXSA-N 1 1 329.400 2.253 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCCCC[N@H+]1CCC[C@@H]1CO ZINC000821081533 786591116 /nfs/dbraw/zinc/59/11/16/786591116.db2.gz QLIFSENIQJVZRS-OAHLLOKOSA-N 1 1 349.431 2.178 20 5 EEBDMO CC1(C)C(=O)N[C@H]1C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000821337130 786702554 /nfs/dbraw/zinc/70/25/54/786702554.db2.gz TVEHTSDBRGSPHH-HNNXBMFYSA-N 1 1 335.379 2.471 20 5 EEBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]2C[N@@H+](C)C[C@H]21 ZINC000823276288 787651543 /nfs/dbraw/zinc/65/15/43/787651543.db2.gz PPKVTDPRFUSDRF-SMDDNHRTSA-N 1 1 335.429 2.483 20 5 EEBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1C1CC1 ZINC000844479688 789131271 /nfs/dbraw/zinc/13/12/71/789131271.db2.gz QFNXSBFNSPFPCV-UONOGXRCSA-N 1 1 349.343 2.134 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(Cn3ncc4ccc([N+](=O)[O-])cc43)CC[C@@H]21 ZINC000164780972 789295354 /nfs/dbraw/zinc/29/53/54/789295354.db2.gz XXQMIUGUUDDDHX-ZBFHGGJFSA-N 1 1 329.404 2.318 20 5 EEBDMO Cn1c(C(=O)N2C[C@@H]3C[C@H]2C[N@@H+]3Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000913684282 794093525 /nfs/dbraw/zinc/09/35/25/794093525.db2.gz OHJBWUUMKKNAFZ-GJZGRUSLSA-N 1 1 340.383 2.032 20 5 EEBDMO Cn1c(C(=O)N2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000913684282 794093538 /nfs/dbraw/zinc/09/35/38/794093538.db2.gz OHJBWUUMKKNAFZ-GJZGRUSLSA-N 1 1 340.383 2.032 20 5 EEBDMO COC(=O)[C@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCCO1 ZINC001172913689 797147929 /nfs/dbraw/zinc/14/79/29/797147929.db2.gz UFOSTDDFKTWZQL-NVXWUHKLSA-N 1 1 348.399 2.106 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N1CCC(Nc2ncc(C)cc2[N+](=O)[O-])CC1 ZINC001095235708 797568905 /nfs/dbraw/zinc/56/89/05/797568905.db2.gz IDXIAUWNNABTNT-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO COc1ccc(Nc2c[nH+]ccc2N2CCN(C)CC2)cc1[N+](=O)[O-] ZINC001176363523 798441406 /nfs/dbraw/zinc/44/14/06/798441406.db2.gz PCVROCLZLAXKRW-UHFFFAOYSA-N 1 1 343.387 2.494 20 5 EEBDMO CCc1[nH]nc(C(=O)N2CCCC[C@@H]2[C@@H](C)C[NH+](C)C)c1[N+](=O)[O-] ZINC000823484750 798737843 /nfs/dbraw/zinc/73/78/43/798737843.db2.gz XELQPFMDBMBOND-WCQYABFASA-N 1 1 337.424 2.073 20 5 EEBDMO O=C(CCC[NH+]1CCCCC1)NCCNCc1ccccc1[N+](=O)[O-] ZINC001151361497 801763060 /nfs/dbraw/zinc/76/30/60/801763060.db2.gz IXZVXXJXNJUZFW-UHFFFAOYSA-N 1 1 348.447 2.067 20 5 EEBDMO O=C(NC[C@H]1C[C@@H]([NH2+]Cc2ccccc2C2CC2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086084564 802115627 /nfs/dbraw/zinc/11/56/27/802115627.db2.gz VXUBLEIRUNEIEL-UOAMXJAYSA-N 1 1 343.427 2.214 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](C[N@H+]2[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169010126 803570889 /nfs/dbraw/zinc/57/08/89/803570889.db2.gz BJNSAHSDLZKJCM-KBUPBQIOSA-N 1 1 339.436 2.373 20 5 EEBDMO C[C@H]1CN(C(=O)OC(C)(C)C)CC[N@H+]1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169011540 803571486 /nfs/dbraw/zinc/57/14/86/803571486.db2.gz KTZWKGBDSJLFPI-IHRRRGAJSA-N 1 1 327.425 2.373 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCCn3cnc(Cn4cccc4)c3C2)C1 ZINC001169026417 803591862 /nfs/dbraw/zinc/59/18/62/803591862.db2.gz WSWDPBGKQGFKJE-CVEARBPZSA-N 1 1 343.431 2.384 20 5 EEBDMO O=C1c2ccccc2CN1[C@H]1CC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169054233 803596326 /nfs/dbraw/zinc/59/63/26/803596326.db2.gz KZJVGACDVOXPTB-IMJJTQAJSA-N 1 1 329.400 2.162 20 5 EEBDMO C[C@@H]1CN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C ZINC000790910451 808992897 /nfs/dbraw/zinc/99/28/97/808992897.db2.gz APFSAULBJRWXKH-ZJUUUORDSA-N 1 1 343.786 2.481 20 5 EEBDMO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792204315 809653173 /nfs/dbraw/zinc/65/31/73/809653173.db2.gz QQTAYFWULLGHDG-GHMZBOCLSA-N 1 1 337.332 2.419 20 5 EEBDMO C[C@@H](COC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C[NH+]1CCOCC1 ZINC001526555716 1120542702 /nfs/dbraw/zinc/54/27/02/1120542702.db2.gz SFYXUCCQUJQANH-GFCCVEGCSA-N 1 1 348.355 2.466 20 5 EEBDMO CC[C@@]1(CO)CCC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000187521953 529552376 /nfs/dbraw/zinc/55/23/76/529552376.db2.gz MYXMZKJNMCJLAG-QGZVFWFLSA-N 1 1 338.404 2.467 20 5 EEBDMO COc1ccc(OCC[N@@H+](C)C[C@@H]2CCCC[C@@H]2O)c([N+](=O)[O-])c1 ZINC000181461767 234195044 /nfs/dbraw/zinc/19/50/44/234195044.db2.gz UFKCVBIMXPIRJB-BBRMVZONSA-N 1 1 338.404 2.465 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000072857780 216318906 /nfs/dbraw/zinc/31/89/06/216318906.db2.gz JJCLCELSQOIHKV-CYBMUJFWSA-N 1 1 335.404 2.235 20 5 EEBDMO COCC[N@@H+](C)CCCNC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000191340380 239053318 /nfs/dbraw/zinc/05/33/18/239053318.db2.gz MIKKQXUGBVCEER-UHFFFAOYSA-N 1 1 338.408 2.301 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC[C@H]3C[N@H+](C)C[C@H]32)c1 ZINC000425058778 241113772 /nfs/dbraw/zinc/11/37/72/241113772.db2.gz PNFJVEDJYCLDOQ-GOEBONIOSA-N 1 1 347.415 2.225 20 5 EEBDMO O=C(NCC[NH+]1CCSCC1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000226225922 242090926 /nfs/dbraw/zinc/09/09/26/242090926.db2.gz OGXCKQXSVSBQLD-UHFFFAOYSA-N 1 1 329.809 2.027 20 5 EEBDMO CCOC[C@H]1CCCC[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000459698491 245214492 /nfs/dbraw/zinc/21/44/92/245214492.db2.gz CDKWZWRFHIPIDY-MRXNPFEDSA-N 1 1 347.415 2.375 20 5 EEBDMO CCOC[C@H]1CCCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000459698491 245214499 /nfs/dbraw/zinc/21/44/99/245214499.db2.gz CDKWZWRFHIPIDY-MRXNPFEDSA-N 1 1 347.415 2.375 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC2(COC(=O)N2)CC1 ZINC000495047626 247058588 /nfs/dbraw/zinc/05/85/88/247058588.db2.gz MEDZDTKNUUXJFZ-UHFFFAOYSA-N 1 1 335.360 2.068 20 5 EEBDMO CC(C)[N@H+](Cc1ccccc1F)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266534850 248349629 /nfs/dbraw/zinc/34/96/29/248349629.db2.gz NTTVNWGFBUDOKN-HNNXBMFYSA-N 1 1 336.367 2.202 20 5 EEBDMO COCC[N@@H+](C)CCCNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000093962721 218258614 /nfs/dbraw/zinc/25/86/14/218258614.db2.gz XUQXCIQENNWGBN-UHFFFAOYSA-N 1 1 337.420 2.218 20 5 EEBDMO COC(=O)[C@@H]1CCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000112629905 220359813 /nfs/dbraw/zinc/35/98/13/220359813.db2.gz SVDMISFKJGUCRX-AWEZNQCLSA-N 1 1 345.355 2.430 20 5 EEBDMO COC(=O)[C@@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000112629905 220359816 /nfs/dbraw/zinc/35/98/16/220359816.db2.gz SVDMISFKJGUCRX-AWEZNQCLSA-N 1 1 345.355 2.430 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@]1(C)CCCO ZINC000271204117 256219499 /nfs/dbraw/zinc/21/94/99/256219499.db2.gz RPOSKYKEQGMGAN-QGZVFWFLSA-N 1 1 335.404 2.469 20 5 EEBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000119290162 221287297 /nfs/dbraw/zinc/28/72/97/221287297.db2.gz DVAAOMNDBRILJC-CQSZACIVSA-N 1 1 334.420 2.101 20 5 EEBDMO COC(=O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000249155421 160375793 /nfs/dbraw/zinc/37/57/93/160375793.db2.gz YOXIPKCQGZQWOF-SWLSCSKDSA-N 1 1 349.387 2.054 20 5 EEBDMO CC(C)OCC[NH+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000083216761 159162380 /nfs/dbraw/zinc/16/23/80/159162380.db2.gz KIUFYCYXCHCRGR-UHFFFAOYSA-N 1 1 348.403 2.279 20 5 EEBDMO COc1ccc(NC(=O)C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000246488313 160281538 /nfs/dbraw/zinc/28/15/38/160281538.db2.gz DOLWYSPOUPBSHC-LRDDRELGSA-N 1 1 349.387 2.043 20 5 EEBDMO COc1ccc(NC(=O)C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000246488313 160281540 /nfs/dbraw/zinc/28/15/40/160281540.db2.gz DOLWYSPOUPBSHC-LRDDRELGSA-N 1 1 349.387 2.043 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H]2OCCC[C@@H]2C1 ZINC000246728269 160291733 /nfs/dbraw/zinc/29/17/33/160291733.db2.gz OMHYFLJOQZKFFW-IOASZLSFSA-N 1 1 333.388 2.423 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2OCCC[C@@H]2C1 ZINC000246728269 160291734 /nfs/dbraw/zinc/29/17/34/160291734.db2.gz OMHYFLJOQZKFFW-IOASZLSFSA-N 1 1 333.388 2.423 20 5 EEBDMO Cc1ccc([C@H](C)NC(=O)[C@@H]2CC[NH2+]CC2(F)F)cc1[N+](=O)[O-] ZINC000342644577 161080277 /nfs/dbraw/zinc/08/02/77/161080277.db2.gz BYKBFSLMVFZZHW-JQWIXIFHSA-N 1 1 327.331 2.325 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCO[C@H]2CCC[C@H]21 ZINC000343909492 161179368 /nfs/dbraw/zinc/17/93/68/161179368.db2.gz OVTMEWIKFLVEMT-HIFRSBDPSA-N 1 1 347.371 2.146 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCO[C@H]2CCC[C@H]21 ZINC000343909492 161179369 /nfs/dbraw/zinc/17/93/69/161179369.db2.gz OVTMEWIKFLVEMT-HIFRSBDPSA-N 1 1 347.371 2.146 20 5 EEBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)CN1CCN(C)CC1 ZINC000344791878 161246172 /nfs/dbraw/zinc/24/61/72/161246172.db2.gz LHOKOLREJUGFCG-NIFLVVHWSA-N 1 1 346.475 2.471 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCC[C@H]1O ZINC000352668137 162236969 /nfs/dbraw/zinc/23/69/69/162236969.db2.gz PXJRZEZPDQVSCV-QWHCGFSZSA-N 1 1 327.768 2.032 20 5 EEBDMO CCc1ccc([C@@H](CO)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000359626278 164140398 /nfs/dbraw/zinc/14/03/98/164140398.db2.gz RATIJFOMDSTKLH-MRXNPFEDSA-N 1 1 343.383 2.079 20 5 EEBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@@H](O)C[C@@H]2CO)s1 ZINC000376297301 167299801 /nfs/dbraw/zinc/29/98/01/167299801.db2.gz YPWZCCCTMXKKQK-NEPJUHHUSA-N 1 1 334.397 2.251 20 5 EEBDMO CC(C)NC(=O)c1ccc(N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)c([N+](=O)[O-])c1 ZINC000272233829 268933138 /nfs/dbraw/zinc/93/31/38/268933138.db2.gz VCCFDQFFSQRFFM-SUMWQHHRSA-N 1 1 346.431 2.263 20 5 EEBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000275155620 269098948 /nfs/dbraw/zinc/09/89/48/269098948.db2.gz YXGABFWNEBWFDY-LLVKDONJSA-N 1 1 331.294 2.095 20 5 EEBDMO CC1(C)C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@@H]1O ZINC000275533181 269122109 /nfs/dbraw/zinc/12/21/09/269122109.db2.gz XKAAIHCIRLNLRG-AWEZNQCLSA-N 1 1 339.367 2.155 20 5 EEBDMO COc1cc(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000275600956 269129359 /nfs/dbraw/zinc/12/93/59/269129359.db2.gz SEFIOCNRBAARDE-LLVKDONJSA-N 1 1 341.383 2.024 20 5 EEBDMO CC[NH+]1CCN(C[C@H](C)CNc2c3c(ccc2[N+](=O)[O-])NCC3)CC1 ZINC000278435139 269231498 /nfs/dbraw/zinc/23/14/98/269231498.db2.gz PYKJEPFKUZSLOY-CQSZACIVSA-N 1 1 347.463 2.248 20 5 EEBDMO C[C@H](O)C[C@@H]1CCCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000279066568 269260536 /nfs/dbraw/zinc/26/05/36/269260536.db2.gz ACSLRYKSSBKKIH-ZFWWWQNUSA-N 1 1 347.415 2.109 20 5 EEBDMO C[C@H]1CCSCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000279361289 269274201 /nfs/dbraw/zinc/27/42/01/269274201.db2.gz WIQBEDBLVSBFCW-JSGCOSHPSA-N 1 1 326.418 2.162 20 5 EEBDMO C[C@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)C1=CC[N@@H+](C)CC1 ZINC000272750025 274180682 /nfs/dbraw/zinc/18/06/82/274180682.db2.gz NJJQPFZTIMTLPG-ZDUSSCGKSA-N 1 1 332.404 2.087 20 5 EEBDMO C[C@@H](CO)[N@H+]1CCCN(c2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450471230 274228050 /nfs/dbraw/zinc/22/80/50/274228050.db2.gz CHSGWAKMWPDZIC-ZDUSSCGKSA-N 1 1 330.388 2.036 20 5 EEBDMO O=C(Nc1c[nH+]ccc1-n1cccn1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000347430836 275000999 /nfs/dbraw/zinc/00/09/99/275000999.db2.gz MVYGNEIQSCKAGO-UHFFFAOYSA-N 1 1 349.310 2.304 20 5 EEBDMO Cc1cc(Cc2noc(CCc3c[nH+]cn3C)n2)ccc1[N+](=O)[O-] ZINC000290129548 275182582 /nfs/dbraw/zinc/18/25/82/275182582.db2.gz PWGXYVAFDFDWHZ-UHFFFAOYSA-N 1 1 327.344 2.396 20 5 EEBDMO C[C@@H](O)C[NH+]1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 ZINC000186829128 533689869 /nfs/dbraw/zinc/68/98/69/533689869.db2.gz MRTAGMJGJWYMCV-CYBMUJFWSA-N 1 1 349.431 2.031 20 5 EEBDMO CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000344878583 277238346 /nfs/dbraw/zinc/23/83/46/277238346.db2.gz FNOUDSSXJBQEOL-GFCCVEGCSA-N 1 1 344.371 2.358 20 5 EEBDMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000419344883 288179355 /nfs/dbraw/zinc/17/93/55/288179355.db2.gz SMPRDBHBHUJTQU-NWDGAFQWSA-N 1 1 327.812 2.135 20 5 EEBDMO CCc1ccc([C@H]2CC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000293178472 293144603 /nfs/dbraw/zinc/14/46/03/293144603.db2.gz DKYHHRNUFAXCLN-WMZOPIPTSA-N 1 1 344.415 2.204 20 5 EEBDMO Cn1cc(C[N@H+]2CCC[C@@H](O)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000294163001 293385998 /nfs/dbraw/zinc/38/59/98/293385998.db2.gz WBFWFGPMSSKDDQ-MRXNPFEDSA-N 1 1 330.388 2.342 20 5 EEBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000332477407 312013434 /nfs/dbraw/zinc/01/34/34/312013434.db2.gz VMMZITMXXYIZSM-KBPBESRZSA-N 1 1 346.431 2.360 20 5 EEBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000332477407 312013435 /nfs/dbraw/zinc/01/34/35/312013435.db2.gz VMMZITMXXYIZSM-KBPBESRZSA-N 1 1 346.431 2.360 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@H]2CCCC[N@@H+]2C[C@H]1C ZINC000332488970 312014848 /nfs/dbraw/zinc/01/48/48/312014848.db2.gz ODHCXERDXVXJES-GDBMZVCRSA-N 1 1 346.431 2.400 20 5 EEBDMO Cc1ccc([C@H](C)NCCC[N@H+]2CCC[C@@H](C(N)=O)C2)cc1[N+](=O)[O-] ZINC000346058068 312271813 /nfs/dbraw/zinc/27/18/13/312271813.db2.gz APUSDRMRUOBGQT-GOEBONIOSA-N 1 1 348.447 2.141 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H](CCO)CC1 ZINC000421010129 314023985 /nfs/dbraw/zinc/02/39/85/314023985.db2.gz FUDPLUOSBYZQCB-CQSZACIVSA-N 1 1 335.404 2.326 20 5 EEBDMO COCC(C)(C)[NH+]1CCN(c2ccc([N+](=O)[O-])c(C(C)=O)c2)CC1 ZINC000425276428 314370720 /nfs/dbraw/zinc/37/07/20/314370720.db2.gz GRBNUIRPLXKJED-UHFFFAOYSA-N 1 1 335.404 2.344 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1CN1CC[NH+](CCOC(C)C)CC1 ZINC000430234709 314507381 /nfs/dbraw/zinc/50/73/81/314507381.db2.gz BNAVHRGQJWPSIX-UHFFFAOYSA-N 1 1 337.420 2.146 20 5 EEBDMO CNC(=O)OC[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1OC ZINC000496909190 316323199 /nfs/dbraw/zinc/32/31/99/316323199.db2.gz LTILEFGKRKHMBY-CQSZACIVSA-N 1 1 337.376 2.314 20 5 EEBDMO CNC(=O)OC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1OC ZINC000496909190 316323200 /nfs/dbraw/zinc/32/32/00/316323200.db2.gz LTILEFGKRKHMBY-CQSZACIVSA-N 1 1 337.376 2.314 20 5 EEBDMO COc1ccc(CC(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000547738968 318317492 /nfs/dbraw/zinc/31/74/92/318317492.db2.gz BANREOLNTYDITM-INIZCTEOSA-N 1 1 349.431 2.383 20 5 EEBDMO C[N@@H+](C[C@H](O)CNCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CC1 ZINC000566556507 319300192 /nfs/dbraw/zinc/30/01/92/319300192.db2.gz NXFGEMVIFNYZQW-CQSZACIVSA-N 1 1 347.337 2.158 20 5 EEBDMO Cc1cc(C[C@@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])n[nH]1 ZINC000577386586 320253160 /nfs/dbraw/zinc/25/31/60/320253160.db2.gz QIMPOLQEPWQBTM-LLVKDONJSA-N 1 1 331.376 2.176 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@@H](CNc2ncnc3ccc([N+](=O)[O-])cc32)C1 ZINC000611699353 449387113 /nfs/dbraw/zinc/38/71/13/449387113.db2.gz APPHAPSUCFXBGQ-AWEZNQCLSA-N 1 1 345.403 2.307 20 5 EEBDMO O=[N+]([O-])c1ccc(NCC[NH+]2CCC(O)CC2)c(Br)c1 ZINC000296178066 465105865 /nfs/dbraw/zinc/10/58/65/465105865.db2.gz ZWTDONVOCNVSNU-UHFFFAOYSA-N 1 1 344.209 2.226 20 5 EEBDMO CO[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(C)C ZINC000296264524 465135356 /nfs/dbraw/zinc/13/53/56/465135356.db2.gz YLYDTGXEIYGKOI-GOEBONIOSA-N 1 1 338.404 2.081 20 5 EEBDMO Cn1c(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000358767683 465310568 /nfs/dbraw/zinc/31/05/68/465310568.db2.gz ZGKHBVQCFBNTKT-HNNXBMFYSA-N 1 1 342.399 2.328 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c1 ZINC000062283475 462613279 /nfs/dbraw/zinc/61/32/79/462613279.db2.gz XDBBIMOHHFUBLB-STQMWFEESA-N 1 1 335.404 2.454 20 5 EEBDMO C[C@H]1CN(c2ncnc3ccc([N+](=O)[O-])cc32)CC[N@H+](C2CC2)C1 ZINC000590703699 468312774 /nfs/dbraw/zinc/31/27/74/468312774.db2.gz VUVGDGRXLLYWMW-GFCCVEGCSA-N 1 1 327.388 2.459 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@]4(CCOC4)C3)n2)c1 ZINC000153942190 462711741 /nfs/dbraw/zinc/71/17/41/462711741.db2.gz GAOKJHAXTWIKFX-MRXNPFEDSA-N 1 1 330.344 2.257 20 5 EEBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000091458928 462881108 /nfs/dbraw/zinc/88/11/08/462881108.db2.gz LTDMKSIKCSVVSV-FRRDWIJNSA-N 1 1 332.408 2.416 20 5 EEBDMO CCOC(=O)[C@H]1CCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000120581185 463014323 /nfs/dbraw/zinc/01/43/23/463014323.db2.gz ULDRZRCABNSPKR-OAHLLOKOSA-N 1 1 349.387 2.259 20 5 EEBDMO CCOC(=O)[C@H]1CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000120581185 463014329 /nfs/dbraw/zinc/01/43/29/463014329.db2.gz ULDRZRCABNSPKR-OAHLLOKOSA-N 1 1 349.387 2.259 20 5 EEBDMO O=C1NCCN1C1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000095940904 463110656 /nfs/dbraw/zinc/11/06/56/463110656.db2.gz KGCICIBMVWOEOE-UHFFFAOYSA-N 1 1 338.795 2.238 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCc1ccncc1 ZINC000121530098 463150964 /nfs/dbraw/zinc/15/09/64/463150964.db2.gz QLFOKYUSTYPMFB-CYBMUJFWSA-N 1 1 328.372 2.491 20 5 EEBDMO Cc1cccc(C(=O)N2CCC[C@@H](C[NH+]3CCOCC3)C2)c1[N+](=O)[O-] ZINC000069744087 463317345 /nfs/dbraw/zinc/31/73/45/463317345.db2.gz WVRQPKDSAQMNHB-HNNXBMFYSA-N 1 1 347.415 2.088 20 5 EEBDMO O=[N+]([O-])c1cc(C[N@H+](CCO)Cc2ccccc2)c2c(c1)COCO2 ZINC000070927393 463393716 /nfs/dbraw/zinc/39/37/16/463393716.db2.gz VUNNQZQVWRKWKM-UHFFFAOYSA-N 1 1 344.367 2.456 20 5 EEBDMO O=[N+]([O-])c1cc(C[N@@H+](CCO)Cc2ccccc2)c2c(c1)COCO2 ZINC000070927393 463393720 /nfs/dbraw/zinc/39/37/20/463393720.db2.gz VUNNQZQVWRKWKM-UHFFFAOYSA-N 1 1 344.367 2.456 20 5 EEBDMO CCOCC[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000162594511 463523219 /nfs/dbraw/zinc/52/32/19/463523219.db2.gz RMMCXKLTNYYHAA-UHFFFAOYSA-N 1 1 336.392 2.089 20 5 EEBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000125660029 463566985 /nfs/dbraw/zinc/56/69/85/463566985.db2.gz KVXCWKKQKRXRJB-GFCCVEGCSA-N 1 1 340.383 2.357 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000152381911 463682879 /nfs/dbraw/zinc/68/28/79/463682879.db2.gz YRHWBPSJCXHEFL-AWEZNQCLSA-N 1 1 334.420 2.115 20 5 EEBDMO CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283398815 463872398 /nfs/dbraw/zinc/87/23/98/463872398.db2.gz VABIMJDEQXZSDQ-CABCVRRESA-N 1 1 346.431 2.482 20 5 EEBDMO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283398815 463872405 /nfs/dbraw/zinc/87/24/05/463872405.db2.gz VABIMJDEQXZSDQ-CABCVRRESA-N 1 1 346.431 2.482 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283398815 463872412 /nfs/dbraw/zinc/87/24/12/463872412.db2.gz VABIMJDEQXZSDQ-CABCVRRESA-N 1 1 346.431 2.482 20 5 EEBDMO CCOC(=O)c1ccnc(N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)c1[N+](=O)[O-] ZINC000269113376 463879676 /nfs/dbraw/zinc/87/96/76/463879676.db2.gz YHFDGWLOKZOOTK-GXTWGEPZSA-N 1 1 348.403 2.087 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000171853040 463936973 /nfs/dbraw/zinc/93/69/73/463936973.db2.gz CVAPBJIPGKREJV-CQSZACIVSA-N 1 1 349.435 2.180 20 5 EEBDMO Cn1cc(C[N@H+]2CCC[C@@H](CO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000269340230 463958657 /nfs/dbraw/zinc/95/86/57/463958657.db2.gz FUVDFGOOGPELEO-CYBMUJFWSA-N 1 1 330.388 2.200 20 5 EEBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ncc(Cl)cc1[N+](=O)[O-] ZINC000278762935 463982097 /nfs/dbraw/zinc/98/20/97/463982097.db2.gz NTSQCJLUDCPATQ-LLVKDONJSA-N 1 1 340.811 2.333 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@H]([NH+]3CCCCC3)C2)c1[N+](=O)[O-] ZINC000269440174 463985720 /nfs/dbraw/zinc/98/57/20/463985720.db2.gz PFQMXVCEWUKRRQ-LBPRGKRZSA-N 1 1 335.408 2.142 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000269558898 464019354 /nfs/dbraw/zinc/01/93/54/464019354.db2.gz ZVADAQMVOYPKCF-GFCCVEGCSA-N 1 1 337.424 2.388 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N(C)CC[C@H]2CCCC[N@@H+]2C)c1[N+](=O)[O-] ZINC000269558898 464019361 /nfs/dbraw/zinc/01/93/61/464019361.db2.gz ZVADAQMVOYPKCF-GFCCVEGCSA-N 1 1 337.424 2.388 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000269558898 464019365 /nfs/dbraw/zinc/01/93/65/464019365.db2.gz ZVADAQMVOYPKCF-GFCCVEGCSA-N 1 1 337.424 2.388 20 5 EEBDMO CCCC(=O)NC[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000269643059 464044592 /nfs/dbraw/zinc/04/45/92/464044592.db2.gz JTPHYUHAOMIKIN-PBHICJAKSA-N 1 1 349.431 2.257 20 5 EEBDMO COC[C@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000591016553 468392788 /nfs/dbraw/zinc/39/27/88/468392788.db2.gz AOFYHFDCMBKYEN-CYBMUJFWSA-N 1 1 337.376 2.043 20 5 EEBDMO CCc1n[nH]c(C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000263697406 464157486 /nfs/dbraw/zinc/15/74/86/464157486.db2.gz SRAZHQUMXSYWHN-LBPRGKRZSA-N 1 1 337.424 2.265 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1 ZINC000284424881 464186658 /nfs/dbraw/zinc/18/66/58/464186658.db2.gz OXTRISZEABWKPL-VXGBXAGGSA-N 1 1 333.388 2.349 20 5 EEBDMO NC(=O)N[C@H]1CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000270577834 464261194 /nfs/dbraw/zinc/26/11/94/464261194.db2.gz CFFJLSZIAZMOSS-AWEZNQCLSA-N 1 1 337.379 2.189 20 5 EEBDMO CC[NH+](CC)CCSc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000180197409 464264264 /nfs/dbraw/zinc/26/42/64/464264264.db2.gz YRTMBFASUCDYQY-UHFFFAOYSA-N 1 1 338.476 2.494 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1 ZINC000180544675 464333505 /nfs/dbraw/zinc/33/35/05/464333505.db2.gz YHBQKGXSBORSDR-TXEJJXNPSA-N 1 1 349.435 2.058 20 5 EEBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000180697842 464372233 /nfs/dbraw/zinc/37/22/33/464372233.db2.gz WUKFCIZKMHPZTK-GFCCVEGCSA-N 1 1 334.420 2.417 20 5 EEBDMO COCC[N@H+]1CC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000264584505 464384586 /nfs/dbraw/zinc/38/45/86/464384586.db2.gz KGQNNKYIUOCUED-JTQLQIEISA-N 1 1 342.783 2.090 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](CO)CC2)cccc1[N+](=O)[O-] ZINC000293317201 464400628 /nfs/dbraw/zinc/40/06/28/464400628.db2.gz XKRXZUXWPMVWBZ-KBPBESRZSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)c1 ZINC000281484936 464474271 /nfs/dbraw/zinc/47/42/71/464474271.db2.gz HCMUEKRLVIVLCW-AWEZNQCLSA-N 1 1 347.415 2.439 20 5 EEBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000265358943 464530282 /nfs/dbraw/zinc/53/02/82/464530282.db2.gz ZFOHGBCLMJKHHP-CQSZACIVSA-N 1 1 335.404 2.164 20 5 EEBDMO CC[N@@H+](CCCO)Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000272322084 464564436 /nfs/dbraw/zinc/56/44/36/464564436.db2.gz UONBOTYBHHEHMU-UHFFFAOYSA-N 1 1 348.346 2.452 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000265508207 464584973 /nfs/dbraw/zinc/58/49/73/464584973.db2.gz QRVLRGZHCTYDQA-UONOGXRCSA-N 1 1 334.420 2.195 20 5 EEBDMO CC[C@H]1CCC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000182209154 464599735 /nfs/dbraw/zinc/59/97/35/464599735.db2.gz HXWDCPCNNBTQEN-ZDUSSCGKSA-N 1 1 326.418 2.491 20 5 EEBDMO CC[C@H]1CCC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000182209154 464599744 /nfs/dbraw/zinc/59/97/44/464599744.db2.gz HXWDCPCNNBTQEN-ZDUSSCGKSA-N 1 1 326.418 2.491 20 5 EEBDMO CC(C)c1ccc(C(=O)N2CCO[C@H]3CC[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000285613636 464627711 /nfs/dbraw/zinc/62/77/11/464627711.db2.gz DDJRDNFDZZNUSS-IRXDYDNUSA-N 1 1 347.415 2.263 20 5 EEBDMO CC[N@H+](CCOCCO)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000281914994 464632713 /nfs/dbraw/zinc/63/27/13/464632713.db2.gz CKXKHPBWPGSJHX-UHFFFAOYSA-N 1 1 335.360 2.081 20 5 EEBDMO CC[N@@H+](CCOCCO)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000281914994 464632718 /nfs/dbraw/zinc/63/27/18/464632718.db2.gz CKXKHPBWPGSJHX-UHFFFAOYSA-N 1 1 335.360 2.081 20 5 EEBDMO CC(C)OCCC[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000265884875 464721838 /nfs/dbraw/zinc/72/18/38/464721838.db2.gz PLYYNPFXJJUYMX-UHFFFAOYSA-N 1 1 335.404 2.231 20 5 EEBDMO CC(C)OCCC[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000265884875 464721843 /nfs/dbraw/zinc/72/18/43/464721843.db2.gz PLYYNPFXJJUYMX-UHFFFAOYSA-N 1 1 335.404 2.231 20 5 EEBDMO Cc1cc(OCC(=O)N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)ccc1[N+](=O)[O-] ZINC000286197617 464835550 /nfs/dbraw/zinc/83/55/50/464835550.db2.gz LYDQEXAHRMJPDH-YIONKMFJSA-N 1 1 347.415 2.366 20 5 EEBDMO Cc1c(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177128761 464937651 /nfs/dbraw/zinc/93/76/51/464937651.db2.gz UMRKFYMETWLOFH-GXSJLCMTSA-N 1 1 348.359 2.166 20 5 EEBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000554600012 468428468 /nfs/dbraw/zinc/42/84/68/468428468.db2.gz QZLFRTQHHPKKRE-LBPRGKRZSA-N 1 1 337.424 2.388 20 5 EEBDMO CCN(C[C@@H]1CCC[N@@H+]1CC)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000554600012 468428473 /nfs/dbraw/zinc/42/84/73/468428473.db2.gz QZLFRTQHHPKKRE-LBPRGKRZSA-N 1 1 337.424 2.388 20 5 EEBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000554600012 468428476 /nfs/dbraw/zinc/42/84/76/468428476.db2.gz QZLFRTQHHPKKRE-LBPRGKRZSA-N 1 1 337.424 2.388 20 5 EEBDMO CO[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1(C)C ZINC000295875947 464993997 /nfs/dbraw/zinc/99/39/97/464993997.db2.gz FXYNOJNKURMVBW-XJKSGUPXSA-N 1 1 338.404 2.081 20 5 EEBDMO COc1cccc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-] ZINC000192777792 464994253 /nfs/dbraw/zinc/99/42/53/464994253.db2.gz QLLQANQWYJGLTH-OCCSQVGLSA-N 1 1 333.388 2.160 20 5 EEBDMO CCc1ccc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC[NH2+]2)cc1 ZINC000337597245 465459753 /nfs/dbraw/zinc/45/97/53/465459753.db2.gz PNLJDPXCMSBVIH-OAHLLOKOSA-N 1 1 328.372 2.272 20 5 EEBDMO Cn1nccc1[C@@H]1OCC[C@H]1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000343579301 465529814 /nfs/dbraw/zinc/52/98/14/465529814.db2.gz KFZNTNJAJMZVSB-KBXCAEBGSA-N 1 1 342.399 2.464 20 5 EEBDMO CNc1c(C(=O)N2CCC3(CCC[N@H+]3C)CC2)cccc1[N+](=O)[O-] ZINC000360943865 465652221 /nfs/dbraw/zinc/65/22/21/465652221.db2.gz KDXFHIMOSUSJKR-UHFFFAOYSA-N 1 1 332.404 2.337 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000330606214 465728016 /nfs/dbraw/zinc/72/80/16/465728016.db2.gz ZTQYBSDSVHMJGL-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)N(C)C[C@@H]1C ZINC000330606214 465728022 /nfs/dbraw/zinc/72/80/22/465728022.db2.gz ZTQYBSDSVHMJGL-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)N(C)C[C@@H]1C ZINC000330606214 465728029 /nfs/dbraw/zinc/72/80/29/465728029.db2.gz ZTQYBSDSVHMJGL-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000330606217 465729133 /nfs/dbraw/zinc/72/91/33/465729133.db2.gz ZTQYBSDSVHMJGL-ZIAGYGMSSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)N(C)C[C@H]1C ZINC000330606217 465729141 /nfs/dbraw/zinc/72/91/41/465729141.db2.gz ZTQYBSDSVHMJGL-ZIAGYGMSSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)N(C)C[C@H]1C ZINC000330606217 465729147 /nfs/dbraw/zinc/72/91/47/465729147.db2.gz ZTQYBSDSVHMJGL-ZIAGYGMSSA-N 1 1 334.420 2.256 20 5 EEBDMO C[C@H]1[C@H](NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)CCC[N@H+]1C ZINC000338062125 465791496 /nfs/dbraw/zinc/79/14/96/465791496.db2.gz GEEPOXNVWICSNL-XJKSGUPXSA-N 1 1 334.420 2.261 20 5 EEBDMO CC[C@@H]1C[C@H](C)C[N@@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000330843276 465826112 /nfs/dbraw/zinc/82/61/12/465826112.db2.gz MVTYEOMWCHXXKY-QWHCGFSZSA-N 1 1 326.418 2.489 20 5 EEBDMO CC[C@@H]1C[C@H](C)C[N@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000330843276 465826117 /nfs/dbraw/zinc/82/61/17/465826117.db2.gz MVTYEOMWCHXXKY-QWHCGFSZSA-N 1 1 326.418 2.489 20 5 EEBDMO CC(C)[C@](C)(O)C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353513106 465944188 /nfs/dbraw/zinc/94/41/88/465944188.db2.gz FAKFHNOMQCDSKE-NVXWUHKLSA-N 1 1 332.404 2.414 20 5 EEBDMO CC(C)[C@@](C)(O)C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353513107 465944428 /nfs/dbraw/zinc/94/44/28/465944428.db2.gz FAKFHNOMQCDSKE-RDJZCZTQSA-N 1 1 332.404 2.414 20 5 EEBDMO COc1cccc(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000346258673 466035903 /nfs/dbraw/zinc/03/59/03/466035903.db2.gz IQOHHUKRDYWKMP-VNHYZAJKSA-N 1 1 347.415 2.406 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](CC1CCC1)[C@@H](C)CO ZINC000361497720 466048265 /nfs/dbraw/zinc/04/82/65/466048265.db2.gz QGNZDQDZBANZRE-ZDUSSCGKSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000346279196 466055077 /nfs/dbraw/zinc/05/50/77/466055077.db2.gz VENKWGRQLWVALA-LZWOXQAQSA-N 1 1 347.415 2.162 20 5 EEBDMO CCc1[nH]nc(C(=O)N(CC)CC[NH+]2CCCCCC2)c1[N+](=O)[O-] ZINC000346300384 466074879 /nfs/dbraw/zinc/07/48/79/466074879.db2.gz QDEZQFFVSLYWAJ-UHFFFAOYSA-N 1 1 337.424 2.218 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000363018359 466178712 /nfs/dbraw/zinc/17/87/12/466178712.db2.gz STFCMXDQNDUVFO-NWDGAFQWSA-N 1 1 334.376 2.352 20 5 EEBDMO Cc1ccc(C[N@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C(C)C)s1 ZINC000304340418 466286799 /nfs/dbraw/zinc/28/67/99/466286799.db2.gz PLHGYLNKHSRSJA-AWEZNQCLSA-N 1 1 338.433 2.433 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000372327767 466304838 /nfs/dbraw/zinc/30/48/38/466304838.db2.gz XYQMJRXIHUAPQO-OLZOCXBDSA-N 1 1 340.383 2.500 20 5 EEBDMO COC(=O)[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1C ZINC000347148186 466430437 /nfs/dbraw/zinc/43/04/37/466430437.db2.gz ZEZGOIUVIIRVOG-ZWNOBZJWSA-N 1 1 346.343 2.028 20 5 EEBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1C ZINC000347148186 466430448 /nfs/dbraw/zinc/43/04/48/466430448.db2.gz ZEZGOIUVIIRVOG-ZWNOBZJWSA-N 1 1 346.343 2.028 20 5 EEBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)[C@H](C)C[S@](C)=O ZINC000362073487 466531829 /nfs/dbraw/zinc/53/18/29/466531829.db2.gz XBGFILVXYLJPNG-MNDBLIDSSA-N 1 1 341.433 2.011 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH2+][C@@H]3CCO[C@H]3C3CC3)n2)c1 ZINC000372802646 466593919 /nfs/dbraw/zinc/59/39/19/466593919.db2.gz KKANWDNMGWRKMO-HIFRSBDPSA-N 1 1 330.344 2.302 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH2+][C@H]3CCO[C@@H]3C3CC3)n2)c1 ZINC000372802645 466593988 /nfs/dbraw/zinc/59/39/88/466593988.db2.gz KKANWDNMGWRKMO-DZGCQCFKSA-N 1 1 330.344 2.302 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCn1cc([N+](=O)[O-])cn1 ZINC000373140245 466705202 /nfs/dbraw/zinc/70/52/02/466705202.db2.gz MNUBPXHNQPEPED-MAUKXSAKSA-N 1 1 343.431 2.292 20 5 EEBDMO C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCn1cc([N+](=O)[O-])cn1 ZINC000373140245 466705205 /nfs/dbraw/zinc/70/52/05/466705205.db2.gz MNUBPXHNQPEPED-MAUKXSAKSA-N 1 1 343.431 2.292 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1c([N+](=O)[O-])ncn1C ZINC000373462112 466811615 /nfs/dbraw/zinc/81/16/15/466811615.db2.gz YGERPJFVBWNYPJ-GDBMZVCRSA-N 1 1 343.431 2.329 20 5 EEBDMO COc1ccc(OCC[N@@H+]2CCCc3c(cnn3C)C2)c([N+](=O)[O-])c1 ZINC000411841854 466915811 /nfs/dbraw/zinc/91/58/11/466915811.db2.gz IEXKUTHEASWVLV-UHFFFAOYSA-N 1 1 346.387 2.164 20 5 EEBDMO COc1ccc(OCC[N@H+]2CCCc3c(cnn3C)C2)c([N+](=O)[O-])c1 ZINC000411841854 466915814 /nfs/dbraw/zinc/91/58/14/466915814.db2.gz IEXKUTHEASWVLV-UHFFFAOYSA-N 1 1 346.387 2.164 20 5 EEBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C(C)(C)CN1CCOCC1 ZINC000412097941 467008017 /nfs/dbraw/zinc/00/80/17/467008017.db2.gz WBAACBLWDWZNNZ-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C(C)(C)CN1CCOCC1 ZINC000412097941 467008024 /nfs/dbraw/zinc/00/80/24/467008024.db2.gz WBAACBLWDWZNNZ-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO CN(Cc1ccc([N+](=O)[O-])cc1F)C(C)(C)C[NH+]1CCOCC1 ZINC000412097941 467008031 /nfs/dbraw/zinc/00/80/31/467008031.db2.gz WBAACBLWDWZNNZ-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO Cc1sc(S(=O)(=O)N(C)[C@@H]2CC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000452106265 467324828 /nfs/dbraw/zinc/32/48/28/467324828.db2.gz PQJACBSQODXMLY-LLVKDONJSA-N 1 1 347.462 2.068 20 5 EEBDMO Cc1sc(S(=O)(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000452106265 467324830 /nfs/dbraw/zinc/32/48/30/467324830.db2.gz PQJACBSQODXMLY-LLVKDONJSA-N 1 1 347.462 2.068 20 5 EEBDMO O=C(C[N@H+]1CC[C@H](CCCO)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000452128097 467333766 /nfs/dbraw/zinc/33/37/66/467333766.db2.gz LVOSSKFSZGFIQR-NSHDSACASA-N 1 1 341.795 2.281 20 5 EEBDMO O=C(C[N@@H+]1CC[C@H](CCCO)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000452128097 467333771 /nfs/dbraw/zinc/33/37/71/467333771.db2.gz LVOSSKFSZGFIQR-NSHDSACASA-N 1 1 341.795 2.281 20 5 EEBDMO C[NH2+]C[C@@H]1CCCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000430658295 467456559 /nfs/dbraw/zinc/45/65/59/467456559.db2.gz XECWILRKXIGHEO-AWEZNQCLSA-N 1 1 334.420 2.163 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)C[C@H](CO)C1 ZINC000420930115 467519166 /nfs/dbraw/zinc/51/91/66/467519166.db2.gz BUXGLCIPOYBMFM-JSGCOSHPSA-N 1 1 335.404 2.182 20 5 EEBDMO Cc1ccc([C@H](C)NC(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)cc1[N+](=O)[O-] ZINC000454600868 467603543 /nfs/dbraw/zinc/60/35/43/467603543.db2.gz HDWYXCBBSDBKHX-DUVNUKRYSA-N 1 1 332.404 2.310 20 5 EEBDMO CCN1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1=O ZINC000449519983 467656669 /nfs/dbraw/zinc/65/66/69/467656669.db2.gz RMDHQRFUFLBHMR-GFCCVEGCSA-N 1 1 346.412 2.429 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000457602122 467660540 /nfs/dbraw/zinc/66/05/40/467660540.db2.gz OHIXKDIRVXEHJF-OAHLLOKOSA-N 1 1 332.385 2.374 20 5 EEBDMO COc1ccc(C[N@@H+](CCO)C2CCSCC2)cc1[N+](=O)[O-] ZINC000449682076 467687812 /nfs/dbraw/zinc/68/78/12/467687812.db2.gz GPBUMIKECAZGOO-UHFFFAOYSA-N 1 1 326.418 2.293 20 5 EEBDMO O=[N+]([O-])c1c(NC[C@@H]2CCC[N@@H+]2CCCO)ccc2ncccc21 ZINC000450596212 467876580 /nfs/dbraw/zinc/87/65/80/467876580.db2.gz NGMNRIFUTREPHZ-ZDUSSCGKSA-N 1 1 330.388 2.402 20 5 EEBDMO O=[N+]([O-])c1ccc(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c(OC(F)F)c1 ZINC000450790852 467908453 /nfs/dbraw/zinc/90/84/53/467908453.db2.gz KZFLWYMTDYMHTR-TXEJJXNPSA-N 1 1 343.330 2.471 20 5 EEBDMO C[N@H+]1CCC[C@@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000515125303 467974291 /nfs/dbraw/zinc/97/42/91/467974291.db2.gz ZPSHJNUHUFAPRN-ZDUSSCGKSA-N 1 1 333.388 2.016 20 5 EEBDMO CCOc1cc(NC[C@H](C)[NH+]2CCN(CC)CC2)ccc1[N+](=O)[O-] ZINC000486929879 468013966 /nfs/dbraw/zinc/01/39/66/468013966.db2.gz PZEGRRRTWDPSIC-AWEZNQCLSA-N 1 1 336.436 2.431 20 5 EEBDMO C[N@H+]1CCC[C@@]2(CCN(c3ncnc4ccc([N+](=O)[O-])cc43)C2)C1 ZINC000590141941 468218584 /nfs/dbraw/zinc/21/85/84/468218584.db2.gz UFHBXWFJBITHOB-QGZVFWFLSA-N 1 1 327.388 2.460 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](c2nccn2C)C1 ZINC000533865452 468226422 /nfs/dbraw/zinc/22/64/22/468226422.db2.gz NSUJCNMBQLOQIS-QWHCGFSZSA-N 1 1 343.387 2.145 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](c2nccn2C)C1 ZINC000533865452 468226428 /nfs/dbraw/zinc/22/64/28/468226428.db2.gz NSUJCNMBQLOQIS-QWHCGFSZSA-N 1 1 343.387 2.145 20 5 EEBDMO Cc1ccc(C(=O)N2CCC([N@@H+]3CCOC[C@H]3C)CC2)cc1[N+](=O)[O-] ZINC000590390261 468244705 /nfs/dbraw/zinc/24/47/05/468244705.db2.gz WOKSADNHXHEPSV-CQSZACIVSA-N 1 1 347.415 2.229 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000597603524 468613524 /nfs/dbraw/zinc/61/35/24/468613524.db2.gz CYQHJCYJBDTVSS-CQSZACIVSA-N 1 1 335.404 2.225 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H]1CC[N@H+](C(C)(C)C)C1 ZINC000594801282 468691859 /nfs/dbraw/zinc/69/18/59/468691859.db2.gz MGUQFQVNEZVFEU-LBPRGKRZSA-N 1 1 341.433 2.054 20 5 EEBDMO CC(C)c1nnc(CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)n1C ZINC000601140455 468757874 /nfs/dbraw/zinc/75/78/74/468757874.db2.gz VRUSAOHUFHZZQP-UHFFFAOYSA-N 1 1 326.360 2.429 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000601221723 468787430 /nfs/dbraw/zinc/78/74/30/468787430.db2.gz QKEZRZMNECSDHU-HIFRSBDPSA-N 1 1 342.399 2.421 20 5 EEBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 ZINC000598195643 468792237 /nfs/dbraw/zinc/79/22/37/468792237.db2.gz QGEJROBKMOHBKC-HNNXBMFYSA-N 1 1 342.399 2.312 20 5 EEBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+](CCO)CCOCC(F)(F)F ZINC000595312827 468809010 /nfs/dbraw/zinc/80/90/10/468809010.db2.gz NGYIWEKOJURIGJ-UHFFFAOYSA-N 1 1 340.273 2.107 20 5 EEBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](CCO)CCOCC(F)(F)F ZINC000595312827 468809012 /nfs/dbraw/zinc/80/90/12/468809012.db2.gz NGYIWEKOJURIGJ-UHFFFAOYSA-N 1 1 340.273 2.107 20 5 EEBDMO CCO[C@H]1C[C@@H](O)C12CC[NH+](Cc1ccc(F)cc1[N+](=O)[O-])CC2 ZINC000595334831 468815646 /nfs/dbraw/zinc/81/56/46/468815646.db2.gz WISFPUWMUCHMGF-CVEARBPZSA-N 1 1 338.379 2.486 20 5 EEBDMO C[C@@H](CO)C1CC[NH+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000593084905 468864526 /nfs/dbraw/zinc/86/45/26/468864526.db2.gz RTEZLHUKDTVHKC-STQMWFEESA-N 1 1 335.404 2.262 20 5 EEBDMO C[C@H](CO)C1CC[NH+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000593084902 468865046 /nfs/dbraw/zinc/86/50/46/468865046.db2.gz RTEZLHUKDTVHKC-OLZOCXBDSA-N 1 1 335.404 2.262 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000595470374 468866567 /nfs/dbraw/zinc/86/65/67/468866567.db2.gz UQNYSJQBZZYEFE-AWEZNQCLSA-N 1 1 334.420 2.309 20 5 EEBDMO COc1ccc(CC(=O)N2[C@H](C)C[N@@H+](C)[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000593189257 468898971 /nfs/dbraw/zinc/89/89/71/468898971.db2.gz ZHNJKQOQJIACDH-FRRDWIJNSA-N 1 1 335.404 2.085 20 5 EEBDMO C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]1CCO ZINC000595701169 468960997 /nfs/dbraw/zinc/96/09/97/468960997.db2.gz QVLVPGBAMOHPJO-XJKSGUPXSA-N 1 1 335.404 2.406 20 5 EEBDMO Cc1[nH+]ccn1CCCN(C)C(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593545229 469027358 /nfs/dbraw/zinc/02/73/58/469027358.db2.gz ZOQWJDHLUWIVGU-UHFFFAOYSA-N 1 1 334.351 2.330 20 5 EEBDMO C[C@@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@]1(C)CO ZINC000595874520 469056969 /nfs/dbraw/zinc/05/69/69/469056969.db2.gz PGKGRMAXRVOLIH-BZNIZROVSA-N 1 1 332.360 2.095 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@]1(C)CO ZINC000595874520 469056973 /nfs/dbraw/zinc/05/69/73/469056973.db2.gz PGKGRMAXRVOLIH-BZNIZROVSA-N 1 1 332.360 2.095 20 5 EEBDMO CCCn1nccc1NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000602833695 469106239 /nfs/dbraw/zinc/10/62/39/469106239.db2.gz ZQWAJBBLFRPGQM-UHFFFAOYSA-N 1 1 345.403 2.314 20 5 EEBDMO CCCn1nccc1NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000602833695 469106245 /nfs/dbraw/zinc/10/62/45/469106245.db2.gz ZQWAJBBLFRPGQM-UHFFFAOYSA-N 1 1 345.403 2.314 20 5 EEBDMO Cc1nn(C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c(C)c1[N+](=O)[O-] ZINC000601957036 469112282 /nfs/dbraw/zinc/11/22/82/469112282.db2.gz SVSQACBCAHOFCZ-QGZVFWFLSA-N 1 1 330.388 2.045 20 5 EEBDMO CN1CC[N@@H+](C)C[C@H]1CNc1c(Br)cccc1[N+](=O)[O-] ZINC000596123111 469167177 /nfs/dbraw/zinc/16/71/77/469167177.db2.gz OHSSLGUAIFRZBR-SNVBAGLBSA-N 1 1 343.225 2.015 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000611185062 469187723 /nfs/dbraw/zinc/18/77/23/469187723.db2.gz GDJQFIIQRIYWCT-QGZVFWFLSA-N 1 1 343.383 2.220 20 5 EEBDMO C[C@H]1CC(F)(F)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000599624076 469313875 /nfs/dbraw/zinc/31/38/75/469313875.db2.gz QJOAZASQPONZBJ-WCQYABFASA-N 1 1 330.331 2.454 20 5 EEBDMO COCC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000612063855 469382818 /nfs/dbraw/zinc/38/28/18/469382818.db2.gz KDLUOGCHGMLVKR-HNNXBMFYSA-N 1 1 338.404 2.226 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000619439191 469605833 /nfs/dbraw/zinc/60/58/33/469605833.db2.gz SZRDERSUSQFYHG-OLZOCXBDSA-N 1 1 333.388 2.302 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1CN1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000619531127 469633463 /nfs/dbraw/zinc/63/34/63/469633463.db2.gz LZRJPBDVADBTGE-KRWDZBQOSA-N 1 1 349.431 2.290 20 5 EEBDMO CCC[N@@H+]1Cc2cccc(NC(=O)Cn3cc([N+](=O)[O-])cn3)c2C1 ZINC000171309311 528328936 /nfs/dbraw/zinc/32/89/36/528328936.db2.gz WXJQOYNDCMZRBQ-UHFFFAOYSA-N 1 1 329.360 2.156 20 5 EEBDMO CCC[N@H+]1Cc2cccc(NC(=O)Cn3cc([N+](=O)[O-])cn3)c2C1 ZINC000171309311 528328940 /nfs/dbraw/zinc/32/89/40/528328940.db2.gz WXJQOYNDCMZRBQ-UHFFFAOYSA-N 1 1 329.360 2.156 20 5 EEBDMO CCCC(=O)NC[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776580952 577463104 /nfs/dbraw/zinc/46/31/04/577463104.db2.gz APIUVJZKNZAGGD-RHSMWYFYSA-N 1 1 349.431 2.257 20 5 EEBDMO CCCC(=O)NC[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776580951 577463134 /nfs/dbraw/zinc/46/31/34/577463134.db2.gz APIUVJZKNZAGGD-PBHICJAKSA-N 1 1 349.431 2.257 20 5 EEBDMO Cc1nn(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000777552485 577481342 /nfs/dbraw/zinc/48/13/42/577481342.db2.gz QAYXTVBIMQHWBH-OAHLLOKOSA-N 1 1 345.403 2.496 20 5 EEBDMO Cc1nn(C[N@H+]2CCC[C@@H](OCC3CC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000777552485 577481343 /nfs/dbraw/zinc/48/13/43/577481343.db2.gz QAYXTVBIMQHWBH-OAHLLOKOSA-N 1 1 345.403 2.496 20 5 EEBDMO O=c1c([N+](=O)[O-])cn(Cc2cn3cc(Cl)ccc3[nH+]2)cc1[N+](=O)[O-] ZINC000768461726 577556210 /nfs/dbraw/zinc/55/62/10/577556210.db2.gz FZRPONDZQNKAFV-UHFFFAOYSA-N 1 1 349.690 2.014 20 5 EEBDMO CSc1ccc([N+](=O)[O-])c(C(=O)OCCC[NH+]2CCOCC2)c1 ZINC000748497151 577963119 /nfs/dbraw/zinc/96/31/19/577963119.db2.gz FRTTUTLJJSXLJG-UHFFFAOYSA-N 1 1 340.401 2.196 20 5 EEBDMO COc1c(O)ccc(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1[N+](=O)[O-] ZINC000892143521 676910931 /nfs/dbraw/zinc/91/09/31/676910931.db2.gz JCYRVDMJARPUKG-CQSZACIVSA-N 1 1 349.431 2.473 20 5 EEBDMO C[C@@H](C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])CN1CCN(C)CC1 ZINC000892930025 683205119 /nfs/dbraw/zinc/20/51/19/683205119.db2.gz ZWCYZMBBDDBKQY-ZDUSSCGKSA-N 1 1 340.855 2.221 20 5 EEBDMO Cc1ccoc1C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21 ZINC001025679775 683231922 /nfs/dbraw/zinc/23/19/22/683231922.db2.gz APQZRARVOOZWJB-FOLVSLTJSA-N 1 1 341.367 2.356 20 5 EEBDMO C[N@@H+]1CC[C@H]1CNC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000928551849 684104922 /nfs/dbraw/zinc/10/49/22/684104922.db2.gz FMKKFTOZQBWTPZ-LURJTMIESA-N 1 1 336.150 2.475 20 5 EEBDMO C[N@H+]1CC[C@H]1CNC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000928551849 684104924 /nfs/dbraw/zinc/10/49/24/684104924.db2.gz FMKKFTOZQBWTPZ-LURJTMIESA-N 1 1 336.150 2.475 20 5 EEBDMO CCc1cccc(C[NH+]2CCC(N(C)C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001005378139 1195331741 /nfs/dbraw/zinc/33/17/41/1195331741.db2.gz JPHXQWSIPSIJGC-QZTJIDSGSA-N 1 1 345.443 2.337 20 5 EEBDMO CCOC(=O)N1CC[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1 ZINC000865682114 1198330338 /nfs/dbraw/zinc/33/03/38/1198330338.db2.gz HRLQEGFKURQZRI-NSHDSACASA-N 1 1 330.344 2.208 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(C(C)(C)O)CC1 ZINC000879626688 1201178557 /nfs/dbraw/zinc/17/85/57/1201178557.db2.gz NILMRYPQPGCIRM-GFCCVEGCSA-N 1 1 335.404 2.405 20 5 EEBDMO C[N@@H+](CC(=O)NC1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CCC1 ZINC001095449544 1205769048 /nfs/dbraw/zinc/76/90/48/1205769048.db2.gz GNDOOCYMJCUMHR-UHFFFAOYSA-N 1 1 346.431 2.164 20 5 EEBDMO C[N@@H+]1CC[C@H]1CNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000928555979 1206399073 /nfs/dbraw/zinc/39/90/73/1206399073.db2.gz MDGFGWOISODZFD-ZDUSSCGKSA-N 1 1 326.356 2.091 20 5 EEBDMO C[N@H+]1CC[C@H]1CNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000928555979 1206399075 /nfs/dbraw/zinc/39/90/75/1206399075.db2.gz MDGFGWOISODZFD-ZDUSSCGKSA-N 1 1 326.356 2.091 20 5 EEBDMO C[C@@H]1CC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)[C@H]1C ZINC000246969450 1213458676 /nfs/dbraw/zinc/45/86/76/1213458676.db2.gz PXPYZCVCFKWIQL-PEBVRCNWSA-N 1 1 346.387 2.050 20 5 EEBDMO CC(C)CCC[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCCCC1 ZINC001115530514 1215185387 /nfs/dbraw/zinc/18/53/87/1215185387.db2.gz BBUTVMSBQDPECM-HUUCEWRRSA-N 1 1 325.453 2.497 20 5 EEBDMO CC[N@@H+](CC(=O)N1CCCCCC1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000796602972 1221611221 /nfs/dbraw/zinc/61/12/21/1221611221.db2.gz WZJJAMJKRBZAFA-KRWDZBQOSA-N 1 1 349.431 2.353 20 5 EEBDMO CC[N@H+](CC(=O)N1CCCCCC1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000796602972 1221611223 /nfs/dbraw/zinc/61/12/23/1221611223.db2.gz WZJJAMJKRBZAFA-KRWDZBQOSA-N 1 1 349.431 2.353 20 5 EEBDMO Cc1ccccc1C[NH+]1CCC(C)(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001045436997 1233745069 /nfs/dbraw/zinc/74/50/69/1233745069.db2.gz ZZMYJVJAEWYDGV-HZPDHXFCSA-N 1 1 331.416 2.131 20 5 EEBDMO CC(C)(C)C(=O)NCCC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC001096253548 1236686654 /nfs/dbraw/zinc/68/66/54/1236686654.db2.gz UDNGCKFRDPZPNR-UHFFFAOYSA-N 1 1 348.447 2.269 20 5 EEBDMO Cc1ccc(F)cc1C[NH+]1CCC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001001400400 1242197677 /nfs/dbraw/zinc/19/76/77/1242197677.db2.gz RDRMAWBPJNTROU-IAGOWNOFSA-N 1 1 349.406 2.128 20 5 EEBDMO CCCCOCC(=O)N1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001195411632 1283559628 /nfs/dbraw/zinc/55/96/28/1283559628.db2.gz 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PDUPKVYKLGXGAP-UHFFFAOYSA-N 1 1 349.840 2.258 20 5 EEBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC[NH+]1CCC(O)CC1 ZINC000294752529 464594990 /nfs/dbraw/zinc/59/49/90/464594990.db2.gz DIJIPSYPLXWRLN-UHFFFAOYSA-N 1 1 348.230 2.448 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H]1CCCC[C@@H]1O ZINC000272454080 464617514 /nfs/dbraw/zinc/61/75/14/464617514.db2.gz CNWFJEWRLKADFN-IOASZLSFSA-N 1 1 335.404 2.405 20 5 EEBDMO C[C@H](O)C[C@H](C)C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272517569 464640704 /nfs/dbraw/zinc/64/07/04/464640704.db2.gz KMEFBNLJFBTHRX-XEZPLFJOSA-N 1 1 332.404 2.414 20 5 EEBDMO C[C@@H]1C[C@H](N2CCOCC2)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000285775807 464692782 /nfs/dbraw/zinc/69/27/82/464692782.db2.gz DRIWNEWMMZZDCY-WBVHZDCISA-N 1 1 349.431 2.159 20 5 EEBDMO C[C@H]1CCC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1C ZINC000248462890 464755064 /nfs/dbraw/zinc/75/50/64/464755064.db2.gz QGCQZGUHYBWHHQ-STQMWFEESA-N 1 1 326.418 2.489 20 5 EEBDMO C[C@H]1CCC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1C ZINC000248462890 464755070 /nfs/dbraw/zinc/75/50/70/464755070.db2.gz QGCQZGUHYBWHHQ-STQMWFEESA-N 1 1 326.418 2.489 20 5 EEBDMO Cc1cc(NC(=O)[C@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)on1 ZINC000282555962 464863712 /nfs/dbraw/zinc/86/37/12/464863712.db2.gz XSIQYOPTXHQPNT-LBPRGKRZSA-N 1 1 332.360 2.393 20 5 EEBDMO Cc1cc(NC(=O)[C@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)on1 ZINC000282555962 464863716 /nfs/dbraw/zinc/86/37/16/464863716.db2.gz XSIQYOPTXHQPNT-LBPRGKRZSA-N 1 1 332.360 2.393 20 5 EEBDMO C[C@H]1C[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C(C)(C)C1 ZINC000266917872 464871265 /nfs/dbraw/zinc/87/12/65/464871265.db2.gz GRKUZOCGBUWVAK-SNVBAGLBSA-N 1 1 335.360 2.382 20 5 EEBDMO CNC(=O)CC[C@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000286348175 464886887 /nfs/dbraw/zinc/88/68/87/464886887.db2.gz GVURVVJDSPFRIC-CQSZACIVSA-N 1 1 335.404 2.354 20 5 EEBDMO CN(C)C(=O)O[C@@H]1CCC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000295669861 464923431 /nfs/dbraw/zinc/92/34/31/464923431.db2.gz RGVTVBDGAMJWDS-CYBMUJFWSA-N 1 1 337.376 2.136 20 5 EEBDMO CN(C)C(=O)O[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000295669861 464923432 /nfs/dbraw/zinc/92/34/32/464923432.db2.gz RGVTVBDGAMJWDS-CYBMUJFWSA-N 1 1 337.376 2.136 20 5 EEBDMO C[C@@H](CO)[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CCCC1 ZINC000276507141 464959888 /nfs/dbraw/zinc/95/98/88/464959888.db2.gz DIRPIHDQFUDRIL-ZDUSSCGKSA-N 1 1 347.415 2.109 20 5 EEBDMO Nc1ccc([N+](=O)[O-])c(NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c1 ZINC000192775477 464995209 /nfs/dbraw/zinc/99/52/09/464995209.db2.gz OPNLLUZSQDKJHI-MRXNPFEDSA-N 1 1 342.399 2.008 20 5 EEBDMO COc1cc(CNC[C@@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000554606506 468430158 /nfs/dbraw/zinc/43/01/58/468430158.db2.gz WLKVAIMXOZTJAQ-ZDUSSCGKSA-N 1 1 337.420 2.432 20 5 EEBDMO C[C@H](CO)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC1CCC1 ZINC000298545318 465428151 /nfs/dbraw/zinc/42/81/51/465428151.db2.gz NOAZCAIGMVTMPN-CYBMUJFWSA-N 1 1 335.404 2.406 20 5 EEBDMO CCc1ccc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])c[nH]3)CC[NH2+]2)cc1 ZINC000337607315 465467509 /nfs/dbraw/zinc/46/75/09/465467509.db2.gz VRZMSRBIFQSBMI-MRXNPFEDSA-N 1 1 328.372 2.272 20 5 EEBDMO CNC(=O)c1ccc(N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000299101585 465604389 /nfs/dbraw/zinc/60/43/89/465604389.db2.gz RYLPUHVSRNHMDA-STQMWFEESA-N 1 1 334.420 2.487 20 5 EEBDMO COC(=O)C[C@@]1([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCOC1 ZINC000362260974 465613166 /nfs/dbraw/zinc/61/31/66/465613166.db2.gz CNEMEBPSIHIDGE-AWEZNQCLSA-N 1 1 328.752 2.060 20 5 EEBDMO C[C@@H]1C[NH+](C[C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000299277737 465678922 /nfs/dbraw/zinc/67/89/22/465678922.db2.gz ARGKPVWMDHOVOP-CPUCHLNUSA-N 1 1 347.415 2.309 20 5 EEBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000299307189 465690548 /nfs/dbraw/zinc/69/05/48/465690548.db2.gz UKJMALMRLYYNPW-WBVHZDCISA-N 1 1 342.399 2.293 20 5 EEBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000371451942 465803279 /nfs/dbraw/zinc/80/32/79/465803279.db2.gz NPUPYJYNGGPGHP-GDBMZVCRSA-N 1 1 332.404 2.063 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000331012428 465897126 /nfs/dbraw/zinc/89/71/26/465897126.db2.gz WITUFMZAWQKUPA-HNNXBMFYSA-N 1 1 345.403 2.417 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000366825151 465956419 /nfs/dbraw/zinc/95/64/19/465956419.db2.gz UHUTVUFBVSLAIC-CABCVRRESA-N 1 1 347.415 2.415 20 5 EEBDMO CC[C@@H](CCO)C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353536023 465962766 /nfs/dbraw/zinc/96/27/66/465962766.db2.gz WZYOQYJLPLRZCG-XJKSGUPXSA-N 1 1 332.404 2.416 20 5 EEBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000346229214 466010507 /nfs/dbraw/zinc/01/05/07/466010507.db2.gz RROIBABDPILOCV-JJRVBVJISA-N 1 1 331.416 2.326 20 5 EEBDMO C[C@@H]1C[C@H]1[N@@H+]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000346239174 466019802 /nfs/dbraw/zinc/01/98/02/466019802.db2.gz OXWUVMUQCDIYAD-HWWQOWPSSA-N 1 1 333.388 2.103 20 5 EEBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000346239174 466019807 /nfs/dbraw/zinc/01/98/07/466019807.db2.gz OXWUVMUQCDIYAD-HWWQOWPSSA-N 1 1 333.388 2.103 20 5 EEBDMO CC[N@@H+]1CCCC[C@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301899454 466056758 /nfs/dbraw/zinc/05/67/58/466056758.db2.gz TVYJQVCMXKWJGO-LBPRGKRZSA-N 1 1 341.433 2.285 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301899454 466056763 /nfs/dbraw/zinc/05/67/63/466056763.db2.gz TVYJQVCMXKWJGO-LBPRGKRZSA-N 1 1 341.433 2.285 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]CC1(CO)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000353675747 466059781 /nfs/dbraw/zinc/05/97/81/466059781.db2.gz VOANQOVNGRBHLU-HNNXBMFYSA-N 1 1 330.388 2.170 20 5 EEBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2C[C@@H]3CC[C@H](O)[C@@H]3C2)c1 ZINC000346307270 466079575 /nfs/dbraw/zinc/07/95/75/466079575.db2.gz BMBJKIWUUTVWLA-BIMULSAOSA-N 1 1 328.315 2.399 20 5 EEBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2C[C@@H]3CC[C@H](O)[C@@H]3C2)c1 ZINC000346307270 466079582 /nfs/dbraw/zinc/07/95/82/466079582.db2.gz BMBJKIWUUTVWLA-BIMULSAOSA-N 1 1 328.315 2.399 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[NH2+][C@@H](CO)c2c(Cl)cccc2Cl)n1 ZINC000361541227 466087086 /nfs/dbraw/zinc/08/70/86/466087086.db2.gz NIEORQKTFYZQMS-NSHDSACASA-N 1 1 345.186 2.421 20 5 EEBDMO CN(C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cn1 ZINC000302461534 466143043 /nfs/dbraw/zinc/14/30/43/466143043.db2.gz ROMMZRSZJWKSAV-SFHVURJKSA-N 1 1 342.399 2.063 20 5 EEBDMO C[C@H](CC[NH+]1CCOCC1)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000357631789 466193406 /nfs/dbraw/zinc/19/34/06/466193406.db2.gz WITBTCPDIODNBK-LLVKDONJSA-N 1 1 341.795 2.089 20 5 EEBDMO C[N@H+]1CCCC[C@@H]1CCn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000340708340 466279612 /nfs/dbraw/zinc/27/96/12/466279612.db2.gz BBCYPHRKGNYFSO-CYBMUJFWSA-N 1 1 332.360 2.286 20 5 EEBDMO C[N@H+]1CCCC12CCN(C(=O)CNc1ccccc1[N+](=O)[O-])CC2 ZINC000361905180 466393765 /nfs/dbraw/zinc/39/37/65/466393765.db2.gz CRYWXOYHOKAHBA-UHFFFAOYSA-N 1 1 332.404 2.094 20 5 EEBDMO COc1cc(C[N@@H+]2C[C@@H](O)C[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000340909822 466427433 /nfs/dbraw/zinc/42/74/33/466427433.db2.gz NSJJVIBLAQLAGU-SCZZXKLOSA-N 1 1 332.303 2.160 20 5 EEBDMO COc1cc(C[N@H+]2C[C@@H](O)C[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000340909822 466427434 /nfs/dbraw/zinc/42/74/34/466427434.db2.gz NSJJVIBLAQLAGU-SCZZXKLOSA-N 1 1 332.303 2.160 20 5 EEBDMO CCC1(CO)CC[NH+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000305739963 466444196 /nfs/dbraw/zinc/44/41/96/466444196.db2.gz NBIOSGXMHHSULK-MRXNPFEDSA-N 1 1 347.415 2.185 20 5 EEBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@](C)(CO)[C@](C)(CO)C1 ZINC000600202191 468494067 /nfs/dbraw/zinc/49/40/67/468494067.db2.gz BBMKRVLBXXWANE-MAMYYWIDSA-N 1 1 334.416 2.311 20 5 EEBDMO CC(C)[N@@H+](C)CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000358127669 466479100 /nfs/dbraw/zinc/47/91/00/466479100.db2.gz RJCSKQRSYLYNNY-UHFFFAOYSA-N 1 1 325.384 2.468 20 5 EEBDMO COc1cc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cc([N+](=O)[O-])c1C ZINC000332301810 466498192 /nfs/dbraw/zinc/49/81/92/466498192.db2.gz KTOJTYRZHFAXLJ-ZIAGYGMSSA-N 1 1 333.388 2.268 20 5 EEBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])n2C)C1 ZINC000347312068 466554597 /nfs/dbraw/zinc/55/45/97/466554597.db2.gz PMUARBFIKFCLIT-HIFRSBDPSA-N 1 1 342.399 2.499 20 5 EEBDMO Nc1c(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)cc(F)cc1[N+](=O)[O-] ZINC000363688046 466558989 /nfs/dbraw/zinc/55/89/89/466558989.db2.gz BTMKFDSCNKRQSL-LLVKDONJSA-N 1 1 336.367 2.063 20 5 EEBDMO CCOC1CC([N@@H+](C)CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000347447138 466636400 /nfs/dbraw/zinc/63/64/00/466636400.db2.gz HTLGLVYHOYZHAQ-UHFFFAOYSA-N 1 1 349.387 2.392 20 5 EEBDMO Nc1ccc(-c2noc([C@@H]3CCn4c[nH+]cc4C3)n2)cc1[N+](=O)[O-] ZINC000364234954 466690309 /nfs/dbraw/zinc/69/03/09/466690309.db2.gz NOJYLHYHIKLZNF-SNVBAGLBSA-N 1 1 326.316 2.154 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCn1cc([N+](=O)[O-])cn1 ZINC000373140248 466705184 /nfs/dbraw/zinc/70/51/84/466705184.db2.gz MNUBPXHNQPEPED-YJBOKZPZSA-N 1 1 343.431 2.292 20 5 EEBDMO C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCn1cc([N+](=O)[O-])cn1 ZINC000373140248 466705188 /nfs/dbraw/zinc/70/51/88/466705188.db2.gz MNUBPXHNQPEPED-YJBOKZPZSA-N 1 1 343.431 2.292 20 5 EEBDMO COC(=O)[C@H](C)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000411223093 466786566 /nfs/dbraw/zinc/78/65/66/466786566.db2.gz XLBQULOWSIUREC-GFCCVEGCSA-N 1 1 349.387 2.197 20 5 EEBDMO COc1cc(C[N@H+]2C[C@H](O)C[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000412031279 466970730 /nfs/dbraw/zinc/97/07/30/466970730.db2.gz AVJSPFCLBSDVSB-GXSJLCMTSA-N 1 1 346.330 2.408 20 5 EEBDMO COc1cc(C[N@@H+]2C[C@H](O)C[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000412031279 466970739 /nfs/dbraw/zinc/97/07/39/466970739.db2.gz AVJSPFCLBSDVSB-GXSJLCMTSA-N 1 1 346.330 2.408 20 5 EEBDMO O=C1CCCCN1[C@@H]1CCC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000377661277 467109464 /nfs/dbraw/zinc/10/94/64/467109464.db2.gz DVFAGHNEGAPITG-MRXNPFEDSA-N 1 1 347.415 2.451 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3ncccc32)C[C@@H]1C ZINC000413124913 467174423 /nfs/dbraw/zinc/17/44/23/467174423.db2.gz DTRPMUFVYKJCBR-STQMWFEESA-N 1 1 330.388 2.034 20 5 EEBDMO CN(CCCN1CC[NH+](C)CC1)c1nccc2ccc([N+](=O)[O-])cc21 ZINC000413143810 467178323 /nfs/dbraw/zinc/17/83/23/467178323.db2.gz MAPXOQJCZYAYRQ-UHFFFAOYSA-N 1 1 343.431 2.217 20 5 EEBDMO O=C(C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)NC[C@@H]1CCCO1 ZINC000451580404 467261705 /nfs/dbraw/zinc/26/17/05/467261705.db2.gz ZXYOVMDJEACJOR-RDJZCZTQSA-N 1 1 347.415 2.069 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)NC[C@@H]1CCCO1 ZINC000451580404 467261710 /nfs/dbraw/zinc/26/17/10/467261710.db2.gz 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340.430 2.365 20 5 EEBDMO COc1ccc(C[C@H](C)[N@@H+]2CC[C@@H](N)[C@@H](F)CC2)c([N+](=O)[O-])c1 ZINC001246584322 1310349008 /nfs/dbraw/zinc/34/90/08/1310349008.db2.gz IYRRXTJXXKZBHV-TUKIKUTGSA-N 1 1 325.384 2.296 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](N)[C@@H](F)CC2)c([N+](=O)[O-])c1 ZINC001246584322 1310349016 /nfs/dbraw/zinc/34/90/16/1310349016.db2.gz IYRRXTJXXKZBHV-TUKIKUTGSA-N 1 1 325.384 2.296 20 5 EEBDMO O=[N+]([O-])c1cc(F)cnc1-c1noc([C@H]2CCc3[nH+]ccn3C2)n1 ZINC001247292565 1310570782 /nfs/dbraw/zinc/57/07/82/1310570782.db2.gz HRUPOYSQOCLIQW-QMMMGPOBSA-N 1 1 330.279 2.105 20 5 EEBDMO COc1ccnc(-c2noc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)n2)c1 ZINC001248208132 1310863425 /nfs/dbraw/zinc/86/34/25/1310863425.db2.gz JDHVMZSMAKBKRL-CYBMUJFWSA-N 1 1 341.327 2.291 20 5 EEBDMO COc1cncc(-c2noc([C@@H]([NH3+])Cc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC001248212521 1310864728 /nfs/dbraw/zinc/86/47/28/1310864728.db2.gz SNDLTOIRSKKNQY-AWEZNQCLSA-N 1 1 341.327 2.291 20 5 EEBDMO 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/nfs/dbraw/zinc/07/70/08/463077008.db2.gz BGPAKSJPOBXACK-QGZVFWFLSA-N 1 1 340.383 2.271 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-] ZINC000491291447 468342957 /nfs/dbraw/zinc/34/29/57/468342957.db2.gz PXBVGWGLQZNUEP-XQRVVYSFSA-N 1 1 332.335 2.459 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+](CCCCO)C3CC3)o2)cc1 ZINC000158090035 463204046 /nfs/dbraw/zinc/20/40/46/463204046.db2.gz RBMKRYWBDDNICS-UHFFFAOYSA-N 1 1 332.360 2.382 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+](CCCCO)C3CC3)o2)cc1 ZINC000158090035 463204052 /nfs/dbraw/zinc/20/40/52/463204052.db2.gz RBMKRYWBDDNICS-UHFFFAOYSA-N 1 1 332.360 2.382 20 5 EEBDMO COC(=O)C[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000121873432 463209047 /nfs/dbraw/zinc/20/90/47/463209047.db2.gz DXJOIMBLYGQWQV-UHFFFAOYSA-N 1 1 337.376 2.115 20 5 EEBDMO COC(=O)C[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000121873432 463209051 /nfs/dbraw/zinc/20/90/51/463209051.db2.gz DXJOIMBLYGQWQV-UHFFFAOYSA-N 1 1 337.376 2.115 20 5 EEBDMO COc1ccc(C(=O)NC[C@H](C)Cn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000054625326 463250381 /nfs/dbraw/zinc/25/03/81/463250381.db2.gz CUDVDOGXBKOWQG-NSHDSACASA-N 1 1 332.360 2.174 20 5 EEBDMO O=C(C[N@H+]1CCCC[C@@H]1CCO)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000070949858 463396915 /nfs/dbraw/zinc/39/69/15/463396915.db2.gz ZZPDCCHAMVHBKO-GFCCVEGCSA-N 1 1 341.795 2.424 20 5 EEBDMO O=C(C[N@@H+]1CCCC[C@@H]1CCO)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000070949858 463396919 /nfs/dbraw/zinc/39/69/19/463396919.db2.gz ZZPDCCHAMVHBKO-GFCCVEGCSA-N 1 1 341.795 2.424 20 5 EEBDMO CC(C)[N@@H+](C)CCCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000041927702 463521824 /nfs/dbraw/zinc/52/18/24/463521824.db2.gz VXDSLDMCQDJZHN-UHFFFAOYSA-N 1 1 345.403 2.241 20 5 EEBDMO CCn1cc(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cn1 ZINC000072983485 463570549 /nfs/dbraw/zinc/57/05/49/463570549.db2.gz SFPJORMWPAWPSB-UHFFFAOYSA-N 1 1 331.376 2.272 20 5 EEBDMO C[C@H](NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1 ZINC000126565004 463648351 /nfs/dbraw/zinc/64/83/51/463648351.db2.gz HYKYJZNCCNEEEI-BLLLJJGKSA-N 1 1 349.431 2.341 20 5 EEBDMO C[C@H](NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1 ZINC000126565004 463648352 /nfs/dbraw/zinc/64/83/52/463648352.db2.gz HYKYJZNCCNEEEI-BLLLJJGKSA-N 1 1 349.431 2.341 20 5 EEBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126673597 463655836 /nfs/dbraw/zinc/65/58/36/463655836.db2.gz UFISXTSKYFGXDG-CYBMUJFWSA-N 1 1 345.403 2.278 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](CCO)c1ccco1 ZINC000185089203 463750071 /nfs/dbraw/zinc/75/00/71/463750071.db2.gz VEMKPFZKWLEYPL-CYBMUJFWSA-N 1 1 333.344 2.148 20 5 EEBDMO COC(=O)[C@H]1C[C@H](C)CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283242647 463817140 /nfs/dbraw/zinc/81/71/40/463817140.db2.gz JKVGUDPGRWQQDC-IUODEOHRSA-N 1 1 349.387 2.197 20 5 EEBDMO COC(=O)[C@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283242647 463817147 /nfs/dbraw/zinc/81/71/47/463817147.db2.gz JKVGUDPGRWQQDC-IUODEOHRSA-N 1 1 349.387 2.197 20 5 EEBDMO O=C([C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1)N1CCCC1 ZINC000287372480 463882936 /nfs/dbraw/zinc/88/29/36/463882936.db2.gz MLNPSLRVBXALPF-GFCCVEGCSA-N 1 1 344.371 2.180 20 5 EEBDMO CCC[C@H]1CN(C(=O)c2csc([N+](=O)[O-])c2)CC[N@@H+]1CCOC ZINC000179317061 464104688 /nfs/dbraw/zinc/10/46/88/464104688.db2.gz FKAJFTTUIWOLIP-ZDUSSCGKSA-N 1 1 341.433 2.229 20 5 EEBDMO CCC[C@H]1CN(C(=O)c2csc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000179317061 464104692 /nfs/dbraw/zinc/10/46/92/464104692.db2.gz FKAJFTTUIWOLIP-ZDUSSCGKSA-N 1 1 341.433 2.229 20 5 EEBDMO Cc1ccc(NCCC[N@@H+]2CCC[C@H]2C(=O)N(C)C)c([N+](=O)[O-])c1 ZINC000269964004 464142268 /nfs/dbraw/zinc/14/22/68/464142268.db2.gz VWSNIHPNYJIVTG-HNNXBMFYSA-N 1 1 334.420 2.258 20 5 EEBDMO CSC[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000292276717 464182398 /nfs/dbraw/zinc/18/23/98/464182398.db2.gz BLODZKXLVMTDFR-UKRRQHHQSA-N 1 1 340.445 2.410 20 5 EEBDMO CN(CC[C@H]1CCCC[N@H+]1C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000173665064 464305858 /nfs/dbraw/zinc/30/58/58/464305858.db2.gz SYSIXELXANWAAW-CYBMUJFWSA-N 1 1 341.433 2.090 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@H](C)[C@H]1C ZINC000298644167 465458643 /nfs/dbraw/zinc/45/86/43/465458643.db2.gz PWQSHGJYJUPPHE-VXGBXAGGSA-N 1 1 337.376 2.041 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCCN1S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000281145695 464350305 /nfs/dbraw/zinc/35/03/05/464350305.db2.gz KGKNBAHNMJTOHP-ZDUSSCGKSA-N 1 1 341.433 2.008 20 5 EEBDMO COc1cc(C(=O)NC[C@@H](C)Cn2cc[nH+]c2C)cc([N+](=O)[O-])c1C ZINC000189065995 464426246 /nfs/dbraw/zinc/42/62/46/464426246.db2.gz AGQAVHZJZBUBSO-LLVKDONJSA-N 1 1 346.387 2.483 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@H+](Cc2ccccc2)C[C@H]2CCCO2)c1 ZINC000174832370 464455905 /nfs/dbraw/zinc/45/59/05/464455905.db2.gz AAMBNQOCBALKNU-QGZVFWFLSA-N 1 1 330.388 2.473 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C)C[C@H]1C(C)C ZINC000181330109 464473413 /nfs/dbraw/zinc/47/34/13/464473413.db2.gz FKOMZXONVWUVLC-AWEZNQCLSA-N 1 1 336.392 2.407 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c1 ZINC000281507902 464483291 /nfs/dbraw/zinc/48/32/91/464483291.db2.gz IJHACHSIFNPLNE-UONOGXRCSA-N 1 1 347.415 2.414 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)[C@H](C)C1 ZINC000182145071 464583239 /nfs/dbraw/zinc/58/32/39/464583239.db2.gz KLFBWCJFGXGUAE-YPMHNXCESA-N 1 1 349.387 2.126 20 5 EEBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000272426757 464603777 /nfs/dbraw/zinc/60/37/77/464603777.db2.gz CEJVJLJNCUHNBB-WBVHZDCISA-N 1 1 346.431 2.263 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)n1 ZINC000176216082 464722731 /nfs/dbraw/zinc/72/27/31/464722731.db2.gz QCMUCVBKUDWHSS-INIZCTEOSA-N 1 1 330.388 2.473 20 5 EEBDMO CSC[C@@H]1CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248448312 464752969 /nfs/dbraw/zinc/75/29/69/464752969.db2.gz HQTNIOKAUASWRK-QWHCGFSZSA-N 1 1 326.418 2.162 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)n1 ZINC000286053369 464788493 /nfs/dbraw/zinc/78/84/93/464788493.db2.gz HXUKNFDJUFLWES-NEPJUHHUSA-N 1 1 336.392 2.309 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CC[C@H](C)O ZINC000266727418 464801252 /nfs/dbraw/zinc/80/12/52/464801252.db2.gz JSUWWRUVXAFPSO-VHSXEESVSA-N 1 1 329.784 2.278 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CC[C@H](C)O ZINC000266727418 464801258 /nfs/dbraw/zinc/80/12/58/464801258.db2.gz JSUWWRUVXAFPSO-VHSXEESVSA-N 1 1 329.784 2.278 20 5 EEBDMO CC[C@@]1(CO)CCC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000249554553 464889481 /nfs/dbraw/zinc/88/94/81/464889481.db2.gz JGLCIWPKVIAKAP-CXAGYDPISA-N 1 1 335.404 2.406 20 5 EEBDMO CC[C@@]1(CO)CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000249554553 464889484 /nfs/dbraw/zinc/88/94/84/464889484.db2.gz JGLCIWPKVIAKAP-CXAGYDPISA-N 1 1 335.404 2.406 20 5 EEBDMO CC[N@H+]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000286430978 464915562 /nfs/dbraw/zinc/91/55/62/464915562.db2.gz IUCXQAYHBJNVBD-GFCCVEGCSA-N 1 1 331.376 2.171 20 5 EEBDMO CCC[N@@H+](CCc1cccs1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000184508195 464987151 /nfs/dbraw/zinc/98/71/51/464987151.db2.gz ODDCEAOMABVMKS-AWEZNQCLSA-N 1 1 338.433 2.168 20 5 EEBDMO Cc1cc(NC(=O)N[C@H](C)CCN2CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC000184610889 465007589 /nfs/dbraw/zinc/00/75/89/465007589.db2.gz AMEFXWNFOBVYHN-CQSZACIVSA-N 1 1 349.435 2.051 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2/C=C\c2ccccc2)c1 ZINC000356344275 465325862 /nfs/dbraw/zinc/32/58/62/465325862.db2.gz LKUYQDBXTHJYDP-LQJOWZLYSA-N 1 1 342.399 2.330 20 5 EEBDMO COCC(C)(C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000298423025 465390952 /nfs/dbraw/zinc/39/09/52/465390952.db2.gz PQIBOFLZNVUPMJ-UHFFFAOYSA-N 1 1 339.392 2.289 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342930787 465396511 /nfs/dbraw/zinc/39/65/11/465396511.db2.gz VKXBZCIAWQRORL-RYUDHWBXSA-N 1 1 328.372 2.433 20 5 EEBDMO CCn1c(C)nc([N+](=O)[O-])c1NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000360880031 465621062 /nfs/dbraw/zinc/62/10/62/465621062.db2.gz PJTQPXVLNZSNQF-VXGBXAGGSA-N 1 1 339.440 2.419 20 5 EEBDMO COc1ccc(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000299325270 465698068 /nfs/dbraw/zinc/69/80/68/465698068.db2.gz ANEIEEFUTGENRR-CYBMUJFWSA-N 1 1 335.404 2.454 20 5 EEBDMO Cc1c(NC(=O)CCN2C[C@H](C)[N@H+](C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000330597783 465723665 /nfs/dbraw/zinc/72/36/65/465723665.db2.gz SNOIAUKCNWGAGI-QWHCGFSZSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)N(C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000330597783 465723669 /nfs/dbraw/zinc/72/36/69/465723669.db2.gz SNOIAUKCNWGAGI-QWHCGFSZSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)N(C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000330597783 465723676 /nfs/dbraw/zinc/72/36/76/465723676.db2.gz SNOIAUKCNWGAGI-QWHCGFSZSA-N 1 1 334.420 2.256 20 5 EEBDMO CC[N@@H+](CCC1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1)CC1CC1 ZINC000554873901 468449000 /nfs/dbraw/zinc/44/90/00/468449000.db2.gz DXWNTBJQXHBGOO-UHFFFAOYSA-N 1 1 349.435 2.292 20 5 EEBDMO CC[C@@H]1C[C@@H](C)C[N@@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000330843274 465827234 /nfs/dbraw/zinc/82/72/34/465827234.db2.gz MVTYEOMWCHXXKY-CHWSQXEVSA-N 1 1 326.418 2.489 20 5 EEBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000330843274 465827241 /nfs/dbraw/zinc/82/72/41/465827241.db2.gz MVTYEOMWCHXXKY-CHWSQXEVSA-N 1 1 326.418 2.489 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOC[C@@H]1C1CC1 ZINC000299728042 465873133 /nfs/dbraw/zinc/87/31/33/465873133.db2.gz VPWVCXBDIPXATA-OAHLLOKOSA-N 1 1 349.387 2.043 20 5 EEBDMO CC1(C)CN(c2ncc([N+](=O)[O-])c(N)n2)CC[N@H+]1Cc1ccccc1 ZINC000301151225 465909880 /nfs/dbraw/zinc/90/98/80/465909880.db2.gz AIVATGQNVOZVBH-UHFFFAOYSA-N 1 1 342.403 2.068 20 5 EEBDMO C[C@@H](CC[NH+]1CCOCC1)NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000340275704 465946208 /nfs/dbraw/zinc/94/62/08/465946208.db2.gz IVXMEEAKGDOKHR-AWEZNQCLSA-N 1 1 349.431 2.099 20 5 EEBDMO C[C@@H]1C[C@@H](N[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000353523865 465950925 /nfs/dbraw/zinc/95/09/25/465950925.db2.gz CIDQFVBLCCZPNH-UKPHBRMFSA-N 1 1 343.431 2.490 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000366953983 466037639 /nfs/dbraw/zinc/03/76/39/466037639.db2.gz IJRCKLLMACWJJC-QGZVFWFLSA-N 1 1 349.431 2.289 20 5 EEBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)Nc1ncc([N+](=O)[O-])c(N)n1 ZINC000301817187 466038850 /nfs/dbraw/zinc/03/88/50/466038850.db2.gz KAZROTMJUTVZHD-UHFFFAOYSA-N 1 1 330.392 2.290 20 5 EEBDMO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC[C@H]1N1CCN(C)CC1 ZINC000367026826 466080624 /nfs/dbraw/zinc/08/06/24/466080624.db2.gz DDCPDWHIKUAGFS-VQIMIIECSA-N 1 1 346.475 2.095 20 5 EEBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC[C@H]1N1CCN(C)CC1 ZINC000367026826 466080631 /nfs/dbraw/zinc/08/06/31/466080631.db2.gz DDCPDWHIKUAGFS-VQIMIIECSA-N 1 1 346.475 2.095 20 5 EEBDMO C[NH+]1CCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CC1 ZINC000302148244 466106643 /nfs/dbraw/zinc/10/66/43/466106643.db2.gz ACPNHLOLJPBHDY-UHFFFAOYSA-N 1 1 328.372 2.321 20 5 EEBDMO Cc1c(C(=O)N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000371994926 466108568 /nfs/dbraw/zinc/10/85/68/466108568.db2.gz LZTIBJAERUAPJB-RDJZCZTQSA-N 1 1 347.415 2.276 20 5 EEBDMO CCc1[nH]nc(-c2nc(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)no2)c1[N+](=O)[O-] ZINC000591453947 468472334 /nfs/dbraw/zinc/47/23/34/468472334.db2.gz VXEPODDXRQTBTG-PBINXNQUSA-N 1 1 332.364 2.271 20 5 EEBDMO CCN(CC)C(=O)C[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000363018584 466178666 /nfs/dbraw/zinc/17/86/66/466178666.db2.gz YXFZVKJVVCSVIL-UHFFFAOYSA-N 1 1 348.447 2.284 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000372156314 466193234 /nfs/dbraw/zinc/19/32/34/466193234.db2.gz NWSREJFDMLNXSJ-MGPQQGTHSA-N 1 1 333.388 2.280 20 5 EEBDMO Cn1nccc1[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000372170805 466202608 /nfs/dbraw/zinc/20/26/08/466202608.db2.gz WGDLJERTFYRKJP-PBHICJAKSA-N 1 1 330.388 2.241 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H](O)COCc1ccco1)CC2 ZINC000304972189 466323271 /nfs/dbraw/zinc/32/32/71/466323271.db2.gz XBZIRGSZEHWQMC-MRXNPFEDSA-N 1 1 332.356 2.124 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H](O)COCc1ccco1)CC2 ZINC000304972189 466323275 /nfs/dbraw/zinc/32/32/75/466323275.db2.gz XBZIRGSZEHWQMC-MRXNPFEDSA-N 1 1 332.356 2.124 20 5 EEBDMO C[N@H+]1CC[C@@](O)(CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000358060514 466423077 /nfs/dbraw/zinc/42/30/77/466423077.db2.gz UEHCYHYVUQWNQX-HXUWFJFHSA-N 1 1 335.407 2.184 20 5 EEBDMO C[C@H]1CCC[C@H](CO)[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000305839132 466479454 /nfs/dbraw/zinc/47/94/54/466479454.db2.gz GMRYSTZVRNINJZ-GXTWGEPZSA-N 1 1 349.387 2.128 20 5 EEBDMO C[N@@H+]1CC[C@@](O)(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000358143023 466491373 /nfs/dbraw/zinc/49/13/73/466491373.db2.gz SHKLJKGXALVZMN-QGZVFWFLSA-N 1 1 347.440 2.480 20 5 EEBDMO C[N@H+]1CC[C@@](O)(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000358143023 466491383 /nfs/dbraw/zinc/49/13/83/466491383.db2.gz SHKLJKGXALVZMN-QGZVFWFLSA-N 1 1 347.440 2.480 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000354354856 466500842 /nfs/dbraw/zinc/50/08/42/466500842.db2.gz RNPGPXVJUJACQE-JSGCOSHPSA-N 1 1 334.420 2.263 20 5 EEBDMO C[N@H+]1CC[C@@](O)(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000358174200 466513710 /nfs/dbraw/zinc/51/37/10/466513710.db2.gz XXJNHPWOQOZMJR-QGZVFWFLSA-N 1 1 331.372 2.011 20 5 EEBDMO C[C@@H]1[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])CCC12CCOCC2 ZINC000363794129 466620746 /nfs/dbraw/zinc/62/07/46/466620746.db2.gz KNKYGQNDRZLSPZ-ZDUSSCGKSA-N 1 1 333.388 2.424 20 5 EEBDMO CCN1CCC([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000411302099 466803810 /nfs/dbraw/zinc/80/38/10/466803810.db2.gz FFXGYBTWPASUAQ-UHFFFAOYSA-N 1 1 334.420 2.340 20 5 EEBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411614712 466855806 /nfs/dbraw/zinc/85/58/06/466855806.db2.gz LDLMOTZXPOWZOB-IOASZLSFSA-N 1 1 335.404 2.405 20 5 EEBDMO C[C@@H]1CC[C@@H]([N@@H+](CCO)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000411654486 466867254 /nfs/dbraw/zinc/86/72/54/466867254.db2.gz XVWHFNFJCGFRCH-CZUORRHYSA-N 1 1 335.404 2.406 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000412176176 467032268 /nfs/dbraw/zinc/03/22/68/467032268.db2.gz PTETZZNUEJOYRF-WGGXSYPISA-N 1 1 329.400 2.440 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425554929 467110391 /nfs/dbraw/zinc/11/03/91/467110391.db2.gz PKZMHFZSDKUIET-KRWDZBQOSA-N 1 1 347.415 2.038 20 5 EEBDMO Cc1cc(OCC(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000432390182 467237027 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334.420 2.434 20 5 EEBDMO CCOc1cc(NC[C@@H](C)[NH+]2CCN(CC)CC2)ccc1[N+](=O)[O-] ZINC000486929880 468013703 /nfs/dbraw/zinc/01/37/03/468013703.db2.gz PZEGRRRTWDPSIC-CQSZACIVSA-N 1 1 336.436 2.431 20 5 EEBDMO COCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CCC[C@H]1C ZINC000488036516 468068392 /nfs/dbraw/zinc/06/83/92/468068392.db2.gz RPBNPIIPGMOKHK-DOMZBBRYSA-N 1 1 335.404 2.331 20 5 EEBDMO C[C@@H](C(=O)NCCCC[N@H+]1CCC[C@H]1CO)c1cccc([N+](=O)[O-])c1 ZINC000519517394 468163710 /nfs/dbraw/zinc/16/37/10/468163710.db2.gz DFIFTXXKEQEMPY-PBHICJAKSA-N 1 1 349.431 2.051 20 5 EEBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000569809266 468545965 /nfs/dbraw/zinc/54/59/65/468545965.db2.gz YZRFFGNEJXBHIP-SNVBAGLBSA-N 1 1 343.330 2.362 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000569809266 468545967 /nfs/dbraw/zinc/54/59/67/468545967.db2.gz YZRFFGNEJXBHIP-SNVBAGLBSA-N 1 1 343.330 2.362 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000597855071 468694623 /nfs/dbraw/zinc/69/46/23/468694623.db2.gz QOKRDXNDUMDROO-CYBMUJFWSA-N 1 1 335.404 2.210 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CCCCS1(=O)=O ZINC000595032264 468746141 /nfs/dbraw/zinc/74/61/41/468746141.db2.gz LVRAJXSXLDSQEH-WCQYABFASA-N 1 1 342.417 2.221 20 5 EEBDMO CS(=O)(=O)C1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000601130075 468754482 /nfs/dbraw/zinc/75/44/82/468754482.db2.gz OYOQQWCCCBLZNM-UHFFFAOYSA-N 1 1 335.385 2.156 20 5 EEBDMO Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])c[nH]3)C2)c1 ZINC000601240987 468794734 /nfs/dbraw/zinc/79/47/34/468794734.db2.gz UAHYRFZIFORQAX-CQSZACIVSA-N 1 1 328.372 2.236 20 5 EEBDMO Cc1noc(C[NH+]2CCC(CN3CCCCC3=O)CC2)c1[N+](=O)[O-] ZINC000595370224 468828880 /nfs/dbraw/zinc/82/88/80/468828880.db2.gz FDGBBHRIKUOTOF-UHFFFAOYSA-N 1 1 336.392 2.116 20 5 EEBDMO Cc1cncc(CC[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000592999719 468835040 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343.383 2.069 20 5 EEBDMO CC(C)c1ccc2c(c1)C[N@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)CC2 ZINC000595657028 468942738 /nfs/dbraw/zinc/94/27/38/468942738.db2.gz HOTYEAYUKZGOAY-GOSISDBHSA-N 1 1 344.415 2.334 20 5 EEBDMO COc1ccc(OCC[N@H+]2CCC[C@@H](C)[C@H]2CCO)c([N+](=O)[O-])c1 ZINC000595695852 468958529 /nfs/dbraw/zinc/95/85/29/468958529.db2.gz IHMHTMINKWPRLJ-UKRRQHHQSA-N 1 1 338.404 2.465 20 5 EEBDMO C[C@H]1CCNC(=O)[C@@H]1[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602658729 468993852 /nfs/dbraw/zinc/99/38/52/468993852.db2.gz WZZYRIMDIHGVBN-IMTBSYHQSA-N 1 1 348.222 2.033 20 5 EEBDMO Cc1cc(N2CCC(Nc3cccnc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000610541907 468998527 /nfs/dbraw/zinc/99/85/27/468998527.db2.gz LPXMQTJEONDNMH-UHFFFAOYSA-N 1 1 328.376 2.478 20 5 EEBDMO CC(C)c1[nH+]c(CNCCn2cc([N+](=O)[O-])cn2)c2ccccn21 ZINC000593605508 469055903 /nfs/dbraw/zinc/05/59/03/469055903.db2.gz HVBFZWDECXSEMQ-UHFFFAOYSA-N 1 1 328.376 2.352 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@H+](CCn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)C1 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CC(C)(C)CCC[NH2+]C1CC2(CC(NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC001121087879 1371858848 /nfs/dbraw/zinc/85/88/48/1371858848.db2.gz YQUJKBLEPBKDKR-BSGOTLCWSA-N 1 1 337.464 2.495 20 5 EEBDMO C[C@]([NH3+])(C(=O)N1CCc2ccsc2C1)c1cccc([N+](=O)[O-])c1 ZINC001122105890 1371946452 /nfs/dbraw/zinc/94/64/52/1371946452.db2.gz ZDXKUVYDAKIIKD-MRXNPFEDSA-N 1 1 331.397 2.415 20 5 EEBDMO CC[N@H+]1CCC[C@H](CNc2cc(C)c([N+](=O)[O-])c(-c3nn[nH]n3)c2)C1 ZINC001590734125 1403891361 /nfs/dbraw/zinc/89/13/61/1403891361.db2.gz YWMTTYUCPOPSFR-GFCCVEGCSA-N 1 1 345.407 2.227 20 5 EEBDMO C[N@H+]1CCO[C@H]2CN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)C[C@H]21 ZINC000301866687 719478588 /nfs/dbraw/zinc/47/85/88/719478588.db2.gz NKKBVQUROHIIPU-CVEARBPZSA-N 1 1 340.383 2.176 20 5 EEBDMO O=[N+]([O-])c1cnc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c(F)c1 ZINC001164782228 721403939 /nfs/dbraw/zinc/40/39/39/721403939.db2.gz FPARFTWTZZLYEI-QWRGUYRKSA-N 1 1 349.391 2.154 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N(C)CCCNc1cccc(F)c1[N+](=O)[O-] 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335.404 2.306 20 5 EEBDMO CN1C(=O)NCC12CC[NH+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC2 ZINC000822529811 787237338 /nfs/dbraw/zinc/23/73/38/787237338.db2.gz JQCIGIZXYVJKKN-UHFFFAOYSA-N 1 1 338.795 2.238 20 5 EEBDMO C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000913532323 788973340 /nfs/dbraw/zinc/97/33/40/788973340.db2.gz FSBANSTZMJWHEA-AOOOYVTPSA-N 1 1 327.743 2.306 20 5 EEBDMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000913532323 788973345 /nfs/dbraw/zinc/97/33/45/788973345.db2.gz FSBANSTZMJWHEA-AOOOYVTPSA-N 1 1 327.743 2.306 20 5 EEBDMO COc1cc[nH+]c(N2CCN(Cc3cc(F)ccc3[N+](=O)[O-])CC2)c1 ZINC000171612184 791419838 /nfs/dbraw/zinc/41/98/38/791419838.db2.gz ZINRNNSZHQJADP-UHFFFAOYSA-N 1 1 346.362 2.460 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)N1CCN(c2cc(C)ccc2[N+](=O)[O-])CC1 ZINC001093166555 794799288 /nfs/dbraw/zinc/79/92/88/794799288.db2.gz LGVYRSZSJISDLU-UHFFFAOYSA-N 1 1 348.447 2.284 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N1CCC(C)(Nc2ncccc2[N+](=O)[O-])CC1 ZINC001112353796 795297777 /nfs/dbraw/zinc/29/77/77/795297777.db2.gz BUZQVBRSCVPXPK-UHFFFAOYSA-N 1 1 349.435 2.125 20 5 EEBDMO Cc1cc(NCCNC(=O)Cn2cc[nH+]c2C(C)C)ccc1[N+](=O)[O-] ZINC001094157678 795971072 /nfs/dbraw/zinc/97/10/72/795971072.db2.gz KRIKRUDXLLFZPD-UHFFFAOYSA-N 1 1 345.403 2.451 20 5 EEBDMO O=C(NCC1=CC[N@@H+](CC2CCCCCC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001000674522 796128541 /nfs/dbraw/zinc/12/85/41/796128541.db2.gz PNDBBGJAJCAHOR-IAGOWNOFSA-N 1 1 335.448 2.370 20 5 EEBDMO O=C(NCC1=CC[N@H+](CC2CCCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000674522 796128547 /nfs/dbraw/zinc/12/85/47/796128547.db2.gz PNDBBGJAJCAHOR-IAGOWNOFSA-N 1 1 335.448 2.370 20 5 EEBDMO O=C(NCC1=CC[N@@H+](CC2CCCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000674522 796128554 /nfs/dbraw/zinc/12/85/54/796128554.db2.gz PNDBBGJAJCAHOR-IAGOWNOFSA-N 1 1 335.448 2.370 20 5 EEBDMO C[C@H](OC(=O)C[NH+]1[C@H](C)CC[C@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000785727385 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O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@H]3[C@H]3CCCO3)n2)cc1 ZINC000789506438 808031532 /nfs/dbraw/zinc/03/15/32/808031532.db2.gz MQNDCTOZXXFQMI-JKSUJKDBSA-N 1 1 343.387 2.454 20 5 EEBDMO CCOC(=O)[C@H]1CC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170345023 809916285 /nfs/dbraw/zinc/91/62/85/809916285.db2.gz GLNDUYMURQXPLI-JSGCOSHPSA-N 1 1 336.388 2.419 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[N@@H+](C[C@@H](C)O)[C@@H](C)C1 ZINC000179619878 233237823 /nfs/dbraw/zinc/23/78/23/233237823.db2.gz XNSQTNIBQNFAJA-UONOGXRCSA-N 1 1 349.431 2.047 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[N@H+](C[C@@H](C)O)[C@@H](C)C1 ZINC000179619878 233237826 /nfs/dbraw/zinc/23/78/26/233237826.db2.gz XNSQTNIBQNFAJA-UONOGXRCSA-N 1 1 349.431 2.047 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1O ZINC000426202601 241235485 /nfs/dbraw/zinc/23/54/85/241235485.db2.gz VXWGKZJGOLSKLJ-TZMCWYRMSA-N 1 1 341.795 2.422 20 5 EEBDMO 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GCQKTGCRRXHMGM-HNNXBMFYSA-N 1 1 335.404 2.447 20 5 EEBDMO C[N@@H+](CCOC(C)(C)C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000610859655 469093931 /nfs/dbraw/zinc/09/39/31/469093931.db2.gz GCQKTGCRRXHMGM-HNNXBMFYSA-N 1 1 335.404 2.447 20 5 EEBDMO C[N@H+]1CCCC[C@H](CNC(=O)NCCNc2ccccc2[N+](=O)[O-])C1 ZINC000599157552 469141174 /nfs/dbraw/zinc/14/11/74/469141174.db2.gz YANBAYJRIFRZAJ-CQSZACIVSA-N 1 1 349.435 2.038 20 5 EEBDMO O=[N+]([O-])c1cncc(Cl)c1N1CCC[N@H+](C[C@H]2CCCO2)CC1 ZINC000596074442 469141983 /nfs/dbraw/zinc/14/19/83/469141983.db2.gz GGNVECFGJIIRQG-GFCCVEGCSA-N 1 1 340.811 2.334 20 5 EEBDMO O=[N+]([O-])c1cncc(Cl)c1N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000596074442 469141984 /nfs/dbraw/zinc/14/19/84/469141984.db2.gz GGNVECFGJIIRQG-GFCCVEGCSA-N 1 1 340.811 2.334 20 5 EEBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(c2ncc([N+](=O)[O-])cn2)C1 ZINC000596467833 469277040 /nfs/dbraw/zinc/27/70/40/469277040.db2.gz VHFRCDIVCXELEN-OAHLLOKOSA-N 1 1 327.388 2.138 20 5 EEBDMO 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ZINC000081362922 159151876 /nfs/dbraw/zinc/15/18/76/159151876.db2.gz YCTRDVFVPPLWOM-CYBMUJFWSA-N 1 1 335.404 2.407 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+](CCCCO)C3CC3)n2)c1 ZINC000118844309 159368319 /nfs/dbraw/zinc/36/83/19/159368319.db2.gz NFIJLNFMRIYLHG-UHFFFAOYSA-N 1 1 332.360 2.382 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+](CCCCO)C3CC3)n2)c1 ZINC000118844309 159368322 /nfs/dbraw/zinc/36/83/22/159368322.db2.gz NFIJLNFMRIYLHG-UHFFFAOYSA-N 1 1 332.360 2.382 20 5 EEBDMO COc1ccc(OCC[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000246430541 160278740 /nfs/dbraw/zinc/27/87/40/160278740.db2.gz AYTHYULRWZLPCM-BBRMVZONSA-N 1 1 336.388 2.483 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@]3(CCOC3)C2)cccc1[N+](=O)[O-] ZINC000247308506 160319052 /nfs/dbraw/zinc/31/90/52/160319052.db2.gz LUFRRACMFUMSSS-CXAGYDPISA-N 1 1 333.388 2.343 20 5 EEBDMO CC[C@@H](NC(=O)[C@@H]1CC[NH2+]CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000342664180 161081648 /nfs/dbraw/zinc/08/16/48/161081648.db2.gz 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C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)[C@@H](C)C[N@H+]1C ZINC000352638740 162223433 /nfs/dbraw/zinc/22/34/33/162223433.db2.gz VCSSUSRYXMIHDL-ZJUUUORDSA-N 1 1 343.330 2.361 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000360819647 164385355 /nfs/dbraw/zinc/38/53/55/164385355.db2.gz SXBZUXSTAAXMIK-BLLLJJGKSA-N 1 1 328.372 2.173 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3C[C@H](O)C4(CC4)C3)o2)c1 ZINC000364317698 165092588 /nfs/dbraw/zinc/09/25/88/165092588.db2.gz OTISFLUMUZPPLM-HNNXBMFYSA-N 1 1 329.356 2.249 20 5 EEBDMO COc1cc(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc([N+](=O)[O-])c1C ZINC000364478912 165151744 /nfs/dbraw/zinc/15/17/44/165151744.db2.gz OWCHPOWXWMPPFN-KBPBESRZSA-N 1 1 333.388 2.268 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@@H]3CCO[C@@H]3C3CC3)n2)cc1 ZINC000368897301 166148787 /nfs/dbraw/zinc/14/87/87/166148787.db2.gz QTFDZSKSOKMKCN-UKRRQHHQSA-N 1 1 330.344 2.302 20 5 EEBDMO Cc1c(CC(=O)NCc2c[nH+]c3n2CCCC3)cccc1[N+](=O)[O-] 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BHSUPMXHYATXTE-CYBMUJFWSA-N 1 1 347.350 2.206 20 5 EEBDMO CCOc1cc(C[N@@H+]2CCC(F)(F)[C@@H](CO)C2)ccc1[N+](=O)[O-] ZINC000291866526 275347921 /nfs/dbraw/zinc/34/79/21/275347921.db2.gz POJWYFZUEAXZNY-GFCCVEGCSA-N 1 1 330.331 2.443 20 5 EEBDMO CCOc1cc(C[N@H+]2CCC(F)(F)[C@@H](CO)C2)ccc1[N+](=O)[O-] ZINC000291866526 275347922 /nfs/dbraw/zinc/34/79/22/275347922.db2.gz POJWYFZUEAXZNY-GFCCVEGCSA-N 1 1 330.331 2.443 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(c3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)C1 ZINC000488713371 277161211 /nfs/dbraw/zinc/16/12/11/277161211.db2.gz COWWWWXOJLQSAS-MRXNPFEDSA-N 1 1 329.360 2.177 20 5 EEBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)[C@@H](C)C[S@](C)=O ZINC000362073489 279247117 /nfs/dbraw/zinc/24/71/17/279247117.db2.gz XBGFILVXYLJPNG-WCBZVUCDSA-N 1 1 341.433 2.011 20 5 EEBDMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@H+]1CCCOCC1 ZINC000189478382 280159101 /nfs/dbraw/zinc/15/91/01/280159101.db2.gz FQIJYOWGFUSRKE-INIZCTEOSA-N 1 1 349.431 2.002 20 5 EEBDMO CC(C)[C@H](CNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)[NH+]1CCOCC1 ZINC000490607456 280238656 /nfs/dbraw/zinc/23/86/56/280238656.db2.gz SNAWOTNITGRDLB-AFCDSYGPSA-N 1 1 347.415 2.081 20 5 EEBDMO O=C(NCCCCC[NH+]1CCCC1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000294008016 293348992 /nfs/dbraw/zinc/34/89/92/293348992.db2.gz URDRCZIPLXKIBA-UHFFFAOYSA-N 1 1 345.403 2.467 20 5 EEBDMO COc1cccc(C(=O)NCC[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000194126330 295287870 /nfs/dbraw/zinc/28/78/70/295287870.db2.gz PWMJQGALIUSLAL-UHFFFAOYSA-N 1 1 343.383 2.465 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CCO)CC1 ZINC000421025298 314029179 /nfs/dbraw/zinc/02/91/79/314029179.db2.gz YJHSHZXMXRFSTP-KBPBESRZSA-N 1 1 335.404 2.406 20 5 EEBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000421703684 314144869 /nfs/dbraw/zinc/14/48/69/314144869.db2.gz MTKZJEZXJDWJTJ-HNNXBMFYSA-N 1 1 346.431 2.361 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@@H](CC[NH3+])C2)cccc1[N+](=O)[O-] ZINC000443056938 315226081 /nfs/dbraw/zinc/22/60/81/315226081.db2.gz DULRFSJRENJZSP-KBPBESRZSA-N 1 1 334.420 2.291 20 5 EEBDMO CC[N@@H+]1CCc2nc(NC(=O)c3ccc(N)c([N+](=O)[O-])c3)sc2C1 ZINC000041975151 441690511 /nfs/dbraw/zinc/69/05/11/441690511.db2.gz YMKWZQFBZCFPOQ-UHFFFAOYSA-N 1 1 347.400 2.264 20 5 EEBDMO CC[N@H+]1CCc2nc(NC(=O)c3ccc(N)c([N+](=O)[O-])c3)sc2C1 ZINC000041975151 441690515 /nfs/dbraw/zinc/69/05/15/441690515.db2.gz YMKWZQFBZCFPOQ-UHFFFAOYSA-N 1 1 347.400 2.264 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)C[C@H]1C ZINC000524879225 317033077 /nfs/dbraw/zinc/03/30/77/317033077.db2.gz HHECXOVEYORPNU-UKRRQHHQSA-N 1 1 349.431 2.477 20 5 EEBDMO C[C@H](C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])CN1CCN(C)CC1 ZINC000576172416 320147796 /nfs/dbraw/zinc/14/77/96/320147796.db2.gz LTYZJWRSQNWXLM-PBHICJAKSA-N 1 1 332.448 2.055 20 5 EEBDMO CN(C(=O)C[N@@H+]1CCC[C@H]1[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000284671997 464287760 /nfs/dbraw/zinc/28/77/60/464287760.db2.gz 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Cc1nn(CN2CC[N@H+](C)C[C@H]2C(C)C)c2ccc([N+](=O)[O-])cc12 ZINC000765013414 577492865 /nfs/dbraw/zinc/49/28/65/577492865.db2.gz HFECBTCTJVPQEN-KRWDZBQOSA-N 1 1 331.420 2.482 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768773183 577562124 /nfs/dbraw/zinc/56/21/24/577562124.db2.gz SZXIHOYRWNRAEX-WDEREUQCSA-N 1 1 340.811 2.211 20 5 EEBDMO O=C1CN(C[N@H+]2CC[C@H](C3CC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000763332414 577719243 /nfs/dbraw/zinc/71/92/43/577719243.db2.gz LPORZAZVVHJHDI-ZDUSSCGKSA-N 1 1 344.371 2.053 20 5 EEBDMO Cc1nn(C[N@H+]2CC[C@@H](C3CCOCC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000754779533 577812826 /nfs/dbraw/zinc/81/28/26/577812826.db2.gz XDKNDNXMNIVEQW-CQSZACIVSA-N 1 1 345.403 2.354 20 5 EEBDMO O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CCC(O[C@@H]3CCOC3)CC2)c1 ZINC000748268662 577958545 /nfs/dbraw/zinc/95/85/45/577958545.db2.gz UXRGCEFWVTYTOT-MRXNPFEDSA-N 1 1 346.387 2.172 20 5 EEBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(-c3nn[nH]n3)ccc2F)cc1 ZINC000823634436 599457751 /nfs/dbraw/zinc/45/77/51/599457751.db2.gz FKJSOSQUGWYFSU-UHFFFAOYSA-N 1 1 328.307 2.204 20 5 EEBDMO COc1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)cc1-c1nn[nH]n1 ZINC000826203142 607569607 /nfs/dbraw/zinc/56/96/07/607569607.db2.gz ZVTSTUKUKOXDDE-UHFFFAOYSA-N 1 1 346.372 2.135 20 5 EEBDMO CCCc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC001022064186 676629426 /nfs/dbraw/zinc/62/94/26/676629426.db2.gz ZTRHWGWIOVEQLE-YYIAUSFCSA-N 1 1 331.416 2.041 20 5 EEBDMO Cn1c2ccccc2c(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1=O ZINC000891847327 676862441 /nfs/dbraw/zinc/86/24/41/676862441.db2.gz WZNANINQTRAKBD-HIFRSBDPSA-N 1 1 342.399 2.485 20 5 EEBDMO CCOCC[NH+]1CCN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])CC1 ZINC000892355989 679242566 /nfs/dbraw/zinc/24/25/66/679242566.db2.gz YZSZTFHCDDFDAH-UHFFFAOYSA-N 1 1 348.378 2.441 20 5 EEBDMO C[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC000180397533 681995705 /nfs/dbraw/zinc/99/57/05/681995705.db2.gz ZITDJEJFTDCWOY-SNVBAGLBSA-N 1 1 344.327 2.453 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1c1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000894464191 682907981 /nfs/dbraw/zinc/90/79/81/682907981.db2.gz IIPQLKFVIREDKF-CYBMUJFWSA-N 1 1 344.415 2.367 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C[C@H]1CCCCS1(=O)=O ZINC000893516074 692878790 /nfs/dbraw/zinc/87/87/90/692878790.db2.gz YYAOVUFGFXJKBV-GFCCVEGCSA-N 1 1 332.809 2.305 20 5 EEBDMO COC(=O)[C@@]1(C)C[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C[C@@H]1C ZINC000872634716 1198294062 /nfs/dbraw/zinc/29/40/62/1198294062.db2.gz ZLQMMNPWBSNIRT-ZBEGNZNMSA-N 1 1 332.360 2.033 20 5 EEBDMO Cc1[nH+]ccn1CCOC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000814484425 1199533225 /nfs/dbraw/zinc/53/32/25/1199533225.db2.gz YRGZEJDFXKICEU-UHFFFAOYSA-N 1 1 336.323 2.162 20 5 EEBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])[C@H](C)C1 ZINC000825874013 1199617083 /nfs/dbraw/zinc/61/70/83/1199617083.db2.gz SKFVEXSQGIUAJI-HUUCEWRRSA-N 1 1 343.468 2.075 20 5 EEBDMO C[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 ZINC000870124971 1200487814 /nfs/dbraw/zinc/48/78/14/1200487814.db2.gz BXQJEZAKDRVRPA-CYBMUJFWSA-N 1 1 328.372 2.442 20 5 EEBDMO CC(C)[C@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCS1 ZINC000870894666 1200937712 /nfs/dbraw/zinc/93/77/12/1200937712.db2.gz BTLBENXYNAOJOK-GDBMZVCRSA-N 1 1 337.445 2.369 20 5 EEBDMO C[C@]([NH3+])(C(=O)N1CCC[C@H](OCC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870926777 1200960803 /nfs/dbraw/zinc/96/08/03/1200960803.db2.gz MUBTUYQWQRNKIA-FUHWJXTLSA-N 1 1 347.415 2.186 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(C(C)(C)O)CC1 ZINC000879626689 1201179066 /nfs/dbraw/zinc/17/90/66/1201179066.db2.gz NILMRYPQPGCIRM-LBPRGKRZSA-N 1 1 335.404 2.405 20 5 EEBDMO COc1cc2c(cc1OC)[C@H](C)[N@H+](CCn1cc([N+](=O)[O-])cn1)CC2 ZINC000880091144 1201383310 /nfs/dbraw/zinc/38/33/10/1201383310.db2.gz ZZIZQAWKJZEAHX-LBPRGKRZSA-N 1 1 346.387 2.428 20 5 EEBDMO COc1cc2c(cc1OC)[C@H](C)[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC2 ZINC000880091144 1201383314 /nfs/dbraw/zinc/38/33/14/1201383314.db2.gz ZZIZQAWKJZEAHX-LBPRGKRZSA-N 1 1 346.387 2.428 20 5 EEBDMO COCC[N@@H+]1[C@H](C)CN(Cc2cc([N+](=O)[O-])ccc2OC)C[C@@H]1C ZINC000129181835 1201742645 /nfs/dbraw/zinc/74/26/45/1201742645.db2.gz WBKCLRVNZCOOIS-OKILXGFUSA-N 1 1 337.420 2.144 20 5 EEBDMO CCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000882628471 1201909186 /nfs/dbraw/zinc/90/91/86/1201909186.db2.gz PUIXMASHLIUTMV-CYBMUJFWSA-N 1 1 332.404 2.383 20 5 EEBDMO CN(C)C(=O)C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1 ZINC000886109586 1202473448 /nfs/dbraw/zinc/47/34/48/1202473448.db2.gz OGBPWFBTONYVOX-HNNXBMFYSA-N 1 1 328.372 2.299 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001095427493 1205736977 /nfs/dbraw/zinc/73/69/77/1205736977.db2.gz DLWGIBUAPYKUOO-UHFFFAOYSA-N 1 1 334.420 2.022 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](N(C)C)[C@H]1C ZINC000931047440 1206602714 /nfs/dbraw/zinc/60/27/14/1206602714.db2.gz YRDDZTWBJWLWEP-CJNGLKHVSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](N(C)C)[C@H]1C ZINC000931047440 1206602715 /nfs/dbraw/zinc/60/27/15/1206602715.db2.gz YRDDZTWBJWLWEP-CJNGLKHVSA-N 1 1 334.420 2.256 20 5 EEBDMO CC(C)(C)NC(=O)[C@@H]1CCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000932440959 1207607196 /nfs/dbraw/zinc/60/71/96/1207607196.db2.gz XCGPBGMMCLITGH-HNNXBMFYSA-N 1 1 335.404 2.353 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000778289045 1208070156 /nfs/dbraw/zinc/07/01/56/1208070156.db2.gz JPPNEPCNYFPVAN-JQWIXIFHSA-N 1 1 327.331 2.286 20 5 EEBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000195161347 1211330091 /nfs/dbraw/zinc/33/00/91/1211330091.db2.gz DKQKHQGJFOOQLS-ZDUSSCGKSA-N 1 1 334.420 2.419 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@H]1C ZINC000801909442 1236401884 /nfs/dbraw/zinc/40/18/84/1236401884.db2.gz BWSWWDCWCCTWPW-GHMZBOCLSA-N 1 1 338.383 2.261 20 5 EEBDMO CCCCC(=O)NCCC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC001096246447 1236618056 /nfs/dbraw/zinc/61/80/56/1236618056.db2.gz UQNYKRXSGQAHFE-UHFFFAOYSA-N 1 1 348.447 2.413 20 5 EEBDMO O=C(NCC1=CC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1)c1cnco1 ZINC001001000234 1241415647 /nfs/dbraw/zinc/41/56/47/1241415647.db2.gz DXNPBDMQHBBDBP-UHFFFAOYSA-N 1 1 342.355 2.145 20 5 EEBDMO O=C(NCC1=CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1)c1cnco1 ZINC001001000234 1241415655 /nfs/dbraw/zinc/41/56/55/1241415655.db2.gz DXNPBDMQHBBDBP-UHFFFAOYSA-N 1 1 342.355 2.145 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)N[C@H]1C[C@H](Nc2nccc(C)c2[N+](=O)[O-])C1 ZINC001097050167 1243625236 /nfs/dbraw/zinc/62/52/36/1243625236.db2.gz FJBCFZJQIMOZEN-HDJSIYSDSA-N 1 1 349.435 2.089 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](N3CCOCC3)CC2)cc1F ZINC000852008030 1291950809 /nfs/dbraw/zinc/95/08/09/1291950809.db2.gz DJDYJBUNRQBTET-OAHLLOKOSA-N 1 1 337.395 2.421 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](N3CCOCC3)CC2)cc1F ZINC000852008030 1291950812 /nfs/dbraw/zinc/95/08/12/1291950812.db2.gz DJDYJBUNRQBTET-OAHLLOKOSA-N 1 1 337.395 2.421 20 5 EEBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000856479519 1293540392 /nfs/dbraw/zinc/54/03/92/1293540392.db2.gz MFVALRLZOVOPJA-ZDUSSCGKSA-N 1 1 332.404 2.029 20 5 EEBDMO COCC[N@H+]1CCC[C@H]1COC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000861036985 1295226621 /nfs/dbraw/zinc/22/66/21/1295226621.db2.gz VNYAJRHRKHUVAX-HNNXBMFYSA-N 1 1 336.388 2.100 20 5 EEBDMO [NH3+][C@H](Cc1c[nH]cn1)C(=O)Nc1cc2cccnc2c2ncccc12 ZINC001218979036 1297888940 /nfs/dbraw/zinc/88/89/40/1297888940.db2.gz GZWAWKVOKAECPV-CQSZACIVSA-N 1 1 332.367 2.015 20 5 EEBDMO O=c1cc[nH]c(O[C@H]2CCN3Cc4ccccc4[NH+]=C23)c1[N+](=O)[O-] ZINC001225663316 1301115391 /nfs/dbraw/zinc/11/53/91/1301115391.db2.gz CUKKKHSITGMLNV-ZDUSSCGKSA-N 1 1 326.312 2.392 20 5 EEBDMO COC(=O)c1ccc(OC2CC[NH+](CCF)CC2)c([N+](=O)[O-])c1 ZINC001227296022 1301769329 /nfs/dbraw/zinc/76/93/29/1301769329.db2.gz TWLLGXDEFXHWIT-UHFFFAOYSA-N 1 1 326.324 2.194 20 5 EEBDMO CC[N@H+]1CC[C@@H](Oc2c([N+](=O)[O-])cc(C)c(OC)c2[N+](=O)[O-])C1 ZINC001229867585 1302970330 /nfs/dbraw/zinc/97/03/30/1302970330.db2.gz AHJLCHMCCXROLH-SNVBAGLBSA-N 1 1 325.321 2.293 20 5 EEBDMO CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000836949481 1315044354 /nfs/dbraw/zinc/04/43/54/1315044354.db2.gz ZLMPAJILVRZVCL-SNVBAGLBSA-N 1 1 327.331 2.429 20 5 EEBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000836949481 1315044356 /nfs/dbraw/zinc/04/43/56/1315044356.db2.gz ZLMPAJILVRZVCL-SNVBAGLBSA-N 1 1 327.331 2.429 20 5 EEBDMO CC(C)[N@H+]1CCCC[C@@H]1COC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000838284649 1315149160 /nfs/dbraw/zinc/14/91/60/1315149160.db2.gz LLHMKRYWGUSMBK-CVEARBPZSA-N 1 1 336.388 2.434 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](N(C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000840151969 1315310607 /nfs/dbraw/zinc/31/06/07/1315310607.db2.gz KSPJSDFNDJKYNK-INIZCTEOSA-N 1 1 344.419 2.225 20 5 EEBDMO O=C1CC[NH2+]C[C@@H]1c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001249187433 1317020509 /nfs/dbraw/zinc/02/05/09/1317020509.db2.gz MBJLHVHWSRVTLU-ZDUSSCGKSA-N 1 1 345.362 2.479 20 5 EEBDMO COC(=O)c1cccc2[nH+]cc(Nc3cc([N+](=O)[O-])cnc3C)n21 ZINC001249546708 1317113941 /nfs/dbraw/zinc/11/39/41/1317113941.db2.gz QMYNDTWXXITGDC-UHFFFAOYSA-N 1 1 327.300 2.476 20 5 EEBDMO Cn1ncc2c1C[N@@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2 ZINC001254478585 1318084964 /nfs/dbraw/zinc/08/49/64/1318084964.db2.gz HBXHSBGUOJLDHA-UHFFFAOYSA-N 1 1 327.388 2.313 20 5 EEBDMO Cn1ncc2c1C[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2 ZINC001254478585 1318084972 /nfs/dbraw/zinc/08/49/72/1318084972.db2.gz HBXHSBGUOJLDHA-UHFFFAOYSA-N 1 1 327.388 2.313 20 5 EEBDMO CCNC(=O)CO[C@@H]1CCC[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254560124 1318121503 /nfs/dbraw/zinc/12/15/03/1318121503.db2.gz PJDLTKWJUZTLIY-GOEBONIOSA-N 1 1 349.431 2.143 20 5 EEBDMO Cc1cc(N2CC[N@H+]3CC[C@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001158430302 1319235014 /nfs/dbraw/zinc/23/50/14/1319235014.db2.gz CWMPZAYHXINKFA-HNNXBMFYSA-N 1 1 325.372 2.255 20 5 EEBDMO [NH3+]Cc1ccc(S(=O)(=O)Nc2cc3cc[nH]c3c([N+](=O)[O-])c2)cc1 ZINC001161752292 1320612118 /nfs/dbraw/zinc/61/21/18/1320612118.db2.gz SJWPBRXMINRWJR-UHFFFAOYSA-N 1 1 346.368 2.336 20 5 EEBDMO Cc1nc(Cl)nc(NCC[C@@H]2CC[NH2+]CC2(F)F)c1[N+](=O)[O-] ZINC001162807884 1320964377 /nfs/dbraw/zinc/96/43/77/1320964377.db2.gz KXDYZGPQHUPKGO-QMMMGPOBSA-N 1 1 335.742 2.393 20 5 EEBDMO [NH3+][C@@H]1CN(C(F)(F)c2cnc(Cl)c([N+](=O)[O-])c2)CCC1(F)F ZINC001164316767 1321349404 /nfs/dbraw/zinc/34/94/04/1321349404.db2.gz HDYONLSWRCMJNY-MRVPVSSYSA-N 1 1 342.680 2.361 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(C(F)(F)c3ccc([N+](=O)[O-])c(Cl)n3)C[C@H]2C1 ZINC001165145967 1321465080 /nfs/dbraw/zinc/46/50/80/1321465080.db2.gz AINQJUIZPHRINL-DTORHVGOSA-N 1 1 332.738 2.186 20 5 EEBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[N@H+]1CCCC[C@H]1C ZINC001609165091 1351872209 /nfs/dbraw/zinc/87/22/09/1351872209.db2.gz DALREVFHDVRJBR-NEPJUHHUSA-N 1 1 345.407 2.450 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@@H+](C3CCCC3)[C@@H](C)C2)n1 ZINC001336727692 1336586620 /nfs/dbraw/zinc/58/66/20/1336586620.db2.gz ZVSKMZBGQDBKHH-LBPRGKRZSA-N 1 1 348.403 2.230 20 5 EEBDMO O=C(OCC[NH+]1CCSCC1)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001344726227 1337411586 /nfs/dbraw/zinc/41/15/86/1337411586.db2.gz QMQUHNYAWLWDTO-LSDHHAIUSA-N 1 1 336.413 2.290 20 5 EEBDMO Cc1cc(N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)c2cccc([N+](=O)[O-])c2n1 ZINC001354266263 1338475930 /nfs/dbraw/zinc/47/59/30/1338475930.db2.gz JEEUNPSJGFFSHW-CXAGYDPISA-N 1 1 343.431 2.498 20 5 EEBDMO Cc1cc(N[C@H](C)[C@H]2CN(C)CC[N@@H+]2C)c2cccc([N+](=O)[O-])c2n1 ZINC001354266263 1338475933 /nfs/dbraw/zinc/47/59/33/1338475933.db2.gz JEEUNPSJGFFSHW-CXAGYDPISA-N 1 1 343.431 2.498 20 5 EEBDMO Cc1cc(N[C@H](C)[C@H]2CN(C)CC[N@H+]2C)c2cccc([N+](=O)[O-])c2n1 ZINC001354266263 1338475937 /nfs/dbraw/zinc/47/59/37/1338475937.db2.gz JEEUNPSJGFFSHW-CXAGYDPISA-N 1 1 343.431 2.498 20 5 EEBDMO Cc1nn(C)c(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)c1Cl ZINC001579891171 1344428336 /nfs/dbraw/zinc/42/83/36/1344428336.db2.gz DSTTWJYLYANHOD-AWEZNQCLSA-N 1 1 337.767 2.103 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] ZINC001589137385 1348964088 /nfs/dbraw/zinc/96/40/88/1348964088.db2.gz ZQXKISPSZBKEEU-LLVKDONJSA-N 1 1 331.380 2.060 20 5 EEBDMO C[N@@H+](CCCCNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-])C1CC1 ZINC001591065409 1349438120 /nfs/dbraw/zinc/43/81/20/1349438120.db2.gz NAYWOELSTHHREN-UHFFFAOYSA-N 1 1 337.409 2.123 20 5 EEBDMO O=[N+]([O-])c1sc(-c2nn[nH]n2)cc1N[C@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC001607088493 1351413265 /nfs/dbraw/zinc/41/32/65/1351413265.db2.gz PUTBZGYEJNJOOR-ONGXEEELSA-N 1 1 349.420 2.265 20 5 EEBDMO O=[N+]([O-])c1sc(-c2nn[nH]n2)cc1N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC001607088493 1351413267 /nfs/dbraw/zinc/41/32/67/1351413267.db2.gz PUTBZGYEJNJOOR-ONGXEEELSA-N 1 1 349.420 2.265 20 5 EEBDMO Nc1ccc(NC(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000823921505 1368096090 /nfs/dbraw/zinc/09/60/90/1368096090.db2.gz VSRYVVLXBOCGDO-UONOGXRCSA-N 1 1 333.392 2.315 20 5 EEBDMO C[C@]1(O)CCC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)CC1 ZINC000853510166 1369343465 /nfs/dbraw/zinc/34/34/65/1369343465.db2.gz IEIVEIXZXMLUQD-INIZCTEOSA-N 1 1 331.376 2.048 20 5 EEBDMO C[C@]1(O)CCC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)CC1 ZINC000853510166 1369343469 /nfs/dbraw/zinc/34/34/69/1369343469.db2.gz IEIVEIXZXMLUQD-INIZCTEOSA-N 1 1 331.376 2.048 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCCC2(CC[NH2+]CC2)C1 ZINC001118198528 1371778436 /nfs/dbraw/zinc/77/84/36/1371778436.db2.gz OMBNHVGLHVLMQK-CQSZACIVSA-N 1 1 346.431 2.387 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCCC2(CC[NH2+]CC2)C1 ZINC001118197872 1371778883 /nfs/dbraw/zinc/77/88/83/1371778883.db2.gz FSWNVGYDGWWBJA-UHFFFAOYSA-N 1 1 346.431 2.307 20 5 EEBDMO CCC/C=C/CC[NH2+]C1CC2(CC(NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC001121087883 1371858900 /nfs/dbraw/zinc/85/89/00/1371858900.db2.gz YWGRKGFQCTWEQY-JNOJRODYSA-N 1 1 335.448 2.415 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CCOCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000839544268 1372909648 /nfs/dbraw/zinc/90/96/48/1372909648.db2.gz QTRGKCGUCCKSKQ-GFCCVEGCSA-N 1 1 337.376 2.043 20 5 EEBDMO Cc1ccoc1CC(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001753063945 1406657462 /nfs/dbraw/zinc/65/74/62/1406657462.db2.gz IWFVFQKKLRDFEW-UHFFFAOYSA-N 1 1 331.372 2.287 20 5 EEBDMO Cc1ccoc1CC(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001753063945 1406657470 /nfs/dbraw/zinc/65/74/70/1406657470.db2.gz IWFVFQKKLRDFEW-UHFFFAOYSA-N 1 1 331.372 2.287 20 5 EEBDMO Cc1cc(N2CC[N@H+](C)C(C)(C)CC2)cc(-c2nn[nH]n2)c1[N+](=O)[O-] ZINC001592007654 1403982085 /nfs/dbraw/zinc/98/20/85/1403982085.db2.gz BUXFSZCUKOBENT-UHFFFAOYSA-N 1 1 345.407 2.004 20 5 EEBDMO CC(C)(C)c1ccc(C[NH+]2CC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC001031662217 770728147 /nfs/dbraw/zinc/72/81/47/770728147.db2.gz XMQINUFIZCAKFB-IAGOWNOFSA-N 1 1 345.443 2.197 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](Cc2cc3ccccc3o2)CC1 ZINC000981137120 776583584 /nfs/dbraw/zinc/58/35/84/776583584.db2.gz NNHXMNHXABAGIE-HZPDHXFCSA-N 1 1 343.383 2.132 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CC3(Br)CC3)C2)nc1 ZINC000846827411 790608209 /nfs/dbraw/zinc/60/82/09/790608209.db2.gz USXKQUFKWXGORS-SNVBAGLBSA-N 1 1 341.209 2.404 20 5 EEBDMO C[N@H+]1CC[C@H](Oc2ccc([N+](=O)[O-])c(I)c2)C1 ZINC001227993933 783449614 /nfs/dbraw/zinc/44/96/14/783449614.db2.gz IRYWMZGXTGQXNS-VIFPVBQESA-N 1 1 348.140 2.282 20 5 EEBDMO CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)C[N@@H+](C)C1CC1 ZINC000809955260 783559405 /nfs/dbraw/zinc/55/94/05/783559405.db2.gz FSVMJHLUAQZKNX-AWEZNQCLSA-N 1 1 327.812 2.135 20 5 EEBDMO COCC[N@H+]1[C@H](C)CN(C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000844024209 788789897 /nfs/dbraw/zinc/78/98/97/788789897.db2.gz KHHLPKREAAHCEI-ZNMIVQPWSA-N 1 1 349.431 2.266 20 5 EEBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000844024209 788789903 /nfs/dbraw/zinc/78/99/03/788789903.db2.gz KHHLPKREAAHCEI-ZNMIVQPWSA-N 1 1 349.431 2.266 20 5 EEBDMO Cc1nn(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c(C)c1[N+](=O)[O-] ZINC000158017988 790116080 /nfs/dbraw/zinc/11/60/80/790116080.db2.gz PURXPRQMKWLMFV-GDBMZVCRSA-N 1 1 333.436 2.314 20 5 EEBDMO C[C@@H](NC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000914160698 795033138 /nfs/dbraw/zinc/03/31/38/795033138.db2.gz IYQDAHHHBJVIIN-OLZOCXBDSA-N 1 1 332.404 2.439 20 5 EEBDMO Cc1[nH+]ccn1CCCC(=O)NCCCNc1ccccc1[N+](=O)[O-] ZINC001094489034 796280000 /nfs/dbraw/zinc/28/00/00/796280000.db2.gz KZYHSTNBZGKRPI-UHFFFAOYSA-N 1 1 345.403 2.498 20 5 EEBDMO COC(=O)[C@@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCCO1 ZINC001172913691 797148489 /nfs/dbraw/zinc/14/84/89/797148489.db2.gz UFOSTDDFKTWZQL-WBVHZDCISA-N 1 1 348.399 2.106 20 5 EEBDMO CC1(C)CCC(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1 ZINC001086363225 802829666 /nfs/dbraw/zinc/82/96/66/802829666.db2.gz IHDSWHGIVOHEGD-KLHDSHLOSA-N 1 1 337.464 2.352 20 5 EEBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[N@@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]2C1 ZINC001169012235 803571434 /nfs/dbraw/zinc/57/14/34/803571434.db2.gz OTLDCOYEKPFVFO-KBXIAJHMSA-N 1 1 339.436 2.231 20 5 EEBDMO CC(C)(C)OC(=O)NCC12CC(C1)C[N@H+]2[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169014052 803571849 /nfs/dbraw/zinc/57/18/49/803571849.db2.gz YNKKAHLUKYIYIG-XCCIUEIHSA-N 1 1 339.436 2.421 20 5 EEBDMO CC(C)(C)OC(=O)NC[C@H]1CC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169034964 803579714 /nfs/dbraw/zinc/57/97/14/803579714.db2.gz IXDYJUXEFPXDQQ-MCIONIFRSA-N 1 1 327.425 2.278 20 5 EEBDMO COC[C@@H]1C[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nn(CC3CC3)cc21 ZINC001169023997 803590158 /nfs/dbraw/zinc/59/01/58/803590158.db2.gz WPKFNSFIRJEMJI-OWCLPIDISA-N 1 1 348.447 2.284 20 5 EEBDMO COC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nn(CC3CC3)cc21 ZINC001169023997 803590162 /nfs/dbraw/zinc/59/01/62/803590162.db2.gz WPKFNSFIRJEMJI-OWCLPIDISA-N 1 1 348.447 2.284 20 5 EEBDMO COC(=O)[C@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C[C@@H]1c1ccccc1 ZINC001169057882 803598339 /nfs/dbraw/zinc/59/83/39/803598339.db2.gz YNQKHLSZLPKPLN-XBVQOTNRSA-N 1 1 332.400 2.320 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@H]3[C@H]3CCCO3)n2)c1 ZINC000789509910 808033439 /nfs/dbraw/zinc/03/34/39/808033439.db2.gz WGLANSZYSMDUCW-JKSUJKDBSA-N 1 1 343.387 2.454 20 5 EEBDMO COc1cc(C(=O)OCC[NH+]2CCSCC2)cc([N+](=O)[O-])c1C ZINC000791689650 809367742 /nfs/dbraw/zinc/36/77/42/809367742.db2.gz VBGPERKNPKEHHB-UHFFFAOYSA-N 1 1 340.401 2.117 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC(=O)N3CCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC001170355498 809902790 /nfs/dbraw/zinc/90/27/90/809902790.db2.gz HGKDQGGJVWIOLG-HIFRSBDPSA-N 1 1 347.415 2.231 20 5 EEBDMO COc1cccc(NC[C@H](C(C)C)N2CC[NH+](C)CC2)c1[N+](=O)[O-] ZINC000181212662 201032693 /nfs/dbraw/zinc/03/26/93/201032693.db2.gz FKZIGKZZAYDEKQ-OAHLLOKOSA-N 1 1 336.436 2.287 20 5 EEBDMO CCCNC(=O)NC(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350387 201053095 /nfs/dbraw/zinc/05/30/95/201053095.db2.gz VQMFLBIPVJFRFN-UHFFFAOYSA-N 1 1 336.392 2.041 20 5 EEBDMO CCCNC(=O)NC(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350387 201053097 /nfs/dbraw/zinc/05/30/97/201053097.db2.gz VQMFLBIPVJFRFN-UHFFFAOYSA-N 1 1 336.392 2.041 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](C3OCCO3)C2)c([N+](=O)[O-])c1 ZINC000193863397 240339817 /nfs/dbraw/zinc/33/98/17/240339817.db2.gz OQDRMXOSKLWIHK-LBPRGKRZSA-N 1 1 337.332 2.088 20 5 EEBDMO CC(C)[N@H+](C)CCNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000236651892 242306677 /nfs/dbraw/zinc/30/66/77/242306677.db2.gz XWRAZWGQSZDRSD-UHFFFAOYSA-N 1 1 331.420 2.425 20 5 EEBDMO CC(C)[N@@H+](C)CCNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000236651892 242306681 /nfs/dbraw/zinc/30/66/81/242306681.db2.gz XWRAZWGQSZDRSD-UHFFFAOYSA-N 1 1 331.420 2.425 20 5 EEBDMO COC(=O)c1cnc(NC[C@@H]2[N@@H+](C)CCCC2(C)C)c([N+](=O)[O-])c1 ZINC000447815833 242320447 /nfs/dbraw/zinc/32/04/47/242320447.db2.gz HXGYISWOBYSBJK-ZDUSSCGKSA-N 1 1 336.392 2.309 20 5 EEBDMO CCNC(=O)NC(=O)[C@@H](C)[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544028 243151574 /nfs/dbraw/zinc/15/15/74/243151574.db2.gz DATNHIPBHWHQJK-OCCSQVGLSA-N 1 1 348.403 2.008 20 5 EEBDMO CCNC(=O)NC(=O)[C@@H](C)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544028 243151579 /nfs/dbraw/zinc/15/15/79/243151579.db2.gz DATNHIPBHWHQJK-OCCSQVGLSA-N 1 1 348.403 2.008 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H]2C[C@H](O)CC[C@@H]2C1 ZINC000451700926 243212955 /nfs/dbraw/zinc/21/29/55/243212955.db2.gz 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NC(=O)c1ccc(C[N@H+]2CCC[C@@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC000125390847 205007056 /nfs/dbraw/zinc/00/70/56/205007056.db2.gz TYKZMFXHAWUORM-OAHLLOKOSA-N 1 1 326.356 2.426 20 5 EEBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](CN3CCOCC3)C2)cc1 ZINC000129547787 205200076 /nfs/dbraw/zinc/20/00/76/205200076.db2.gz ANWCAYKBYXZMPC-MRXNPFEDSA-N 1 1 349.431 2.018 20 5 EEBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000157490683 206138385 /nfs/dbraw/zinc/13/83/85/206138385.db2.gz ACOKNOXGKJRYKL-AWEZNQCLSA-N 1 1 334.420 2.372 20 5 EEBDMO O=C1CCCN1C[C@H]1CCCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000362136757 296320140 /nfs/dbraw/zinc/32/01/40/296320140.db2.gz MSOSEJZDYDKQMA-IAGOWNOFSA-N 1 1 347.415 2.105 20 5 EEBDMO COCCOC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000177082548 207291792 /nfs/dbraw/zinc/29/17/92/207291792.db2.gz RUFWZKWUFYMVBC-UHFFFAOYSA-N 1 1 335.360 2.363 20 5 EEBDMO COCC[N@@H+]1CCN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)C[C@@H]1C ZINC000179585165 532958028 /nfs/dbraw/zinc/95/80/28/532958028.db2.gz DORZVTFZIRHVKD-AWEZNQCLSA-N 1 1 349.431 2.313 20 5 EEBDMO COCC[N@H+]1CCN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)C[C@@H]1C ZINC000179585165 532958034 /nfs/dbraw/zinc/95/80/34/532958034.db2.gz DORZVTFZIRHVKD-AWEZNQCLSA-N 1 1 349.431 2.313 20 5 EEBDMO COc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000181381932 207923869 /nfs/dbraw/zinc/92/38/69/207923869.db2.gz DZYNEZCEIBNOPM-NSHDSACASA-N 1 1 330.344 2.288 20 5 EEBDMO CN(C)c1cc(NC(=O)CCNc2ccccc2[N+](=O)[O-])cc[nH+]1 ZINC000267285846 256045247 /nfs/dbraw/zinc/04/52/47/256045247.db2.gz XHSTUAQUEPBTDA-UHFFFAOYSA-N 1 1 329.360 2.497 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000271283052 256228741 /nfs/dbraw/zinc/22/87/41/256228741.db2.gz CJRYJVXVRWEZBF-SKDRFNHKSA-N 1 1 349.416 2.012 20 5 EEBDMO C[C@H](CN1CCN(C)CC1)[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000154907197 224324989 /nfs/dbraw/zinc/32/49/89/224324989.db2.gz OXCHGWZGYXBXBZ-QAPCUYQASA-N 1 1 346.475 2.141 20 5 EEBDMO COC(=O)C[C@@H]1CCC[N@@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184267455 533631267 /nfs/dbraw/zinc/63/12/67/533631267.db2.gz ISBRPDXLGYHVGW-NSHDSACASA-N 1 1 326.324 2.270 20 5 EEBDMO COC(=O)C[C@@H]1CCC[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184267455 533631276 /nfs/dbraw/zinc/63/12/76/533631276.db2.gz ISBRPDXLGYHVGW-NSHDSACASA-N 1 1 326.324 2.270 20 5 EEBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000077639435 292189492 /nfs/dbraw/zinc/18/94/92/292189492.db2.gz ISCAMKGYYVUHOO-CQSZACIVSA-N 1 1 335.404 2.212 20 5 EEBDMO Cc1c(C[N@H+](CCC(F)(F)F)C[C@H](O)CO)cccc1[N+](=O)[O-] ZINC000122190970 292270757 /nfs/dbraw/zinc/27/07/57/292270757.db2.gz ZIIXSQAJIQQKLA-LBPRGKRZSA-N 1 1 336.310 2.011 20 5 EEBDMO Cc1c(C[N@@H+](CCC(F)(F)F)C[C@H](O)CO)cccc1[N+](=O)[O-] ZINC000122190970 292270759 /nfs/dbraw/zinc/27/07/59/292270759.db2.gz ZIIXSQAJIQQKLA-LBPRGKRZSA-N 1 1 336.310 2.011 20 5 EEBDMO COc1cc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000252695996 160393186 /nfs/dbraw/zinc/39/31/86/160393186.db2.gz BAKPXEMOPWMBFA-UONOGXRCSA-N 1 1 333.388 2.160 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000072672444 159042788 /nfs/dbraw/zinc/04/27/88/159042788.db2.gz ZUAOXJSWWMDONC-OAHLLOKOSA-N 1 1 336.392 2.073 20 5 EEBDMO CCOC[C@@H]1CCC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000072977470 159048678 /nfs/dbraw/zinc/04/86/78/159048678.db2.gz ROIAKSZMAZOQER-CQSZACIVSA-N 1 1 347.415 2.232 20 5 EEBDMO CCOC[C@@H]1CCC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000072977470 159048681 /nfs/dbraw/zinc/04/86/81/159048681.db2.gz ROIAKSZMAZOQER-CQSZACIVSA-N 1 1 347.415 2.232 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000074123977 159060552 /nfs/dbraw/zinc/06/05/52/159060552.db2.gz OYVXGJCGTNQYRO-MRXNPFEDSA-N 1 1 334.420 2.387 20 5 EEBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CCCSCC2)c([N+](=O)[O-])c1 ZINC000089985869 159191035 /nfs/dbraw/zinc/19/10/35/159191035.db2.gz ZUUIFXQEFRQILB-NSHDSACASA-N 1 1 339.417 2.369 20 5 EEBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CCCSCC2)c([N+](=O)[O-])c1 ZINC000089985869 159191036 /nfs/dbraw/zinc/19/10/36/159191036.db2.gz ZUUIFXQEFRQILB-NSHDSACASA-N 1 1 339.417 2.369 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(CCn2ccc([N+](=O)[O-])n2)C1 ZINC000246155467 160265105 /nfs/dbraw/zinc/26/51/05/160265105.db2.gz HRZQRCFRBCAGCO-CVEARBPZSA-N 1 1 335.452 2.378 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000342154082 161044000 /nfs/dbraw/zinc/04/40/00/161044000.db2.gz UMOPNJAZJHWQPB-PXAZEXFGSA-N 1 1 344.415 2.145 20 5 EEBDMO C[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)CC[C@H]1CCCO1 ZINC000342568250 161074739 /nfs/dbraw/zinc/07/47/39/161074739.db2.gz LASBAPHPCHSXLG-CQSZACIVSA-N 1 1 349.387 2.394 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000342851086 161095649 /nfs/dbraw/zinc/09/56/49/161095649.db2.gz IGONZARNHCXYQG-IUODEOHRSA-N 1 1 331.416 2.471 20 5 EEBDMO COc1cc(CN2CCC([N@H+]3CCO[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC000351977696 162011626 /nfs/dbraw/zinc/01/16/26/162011626.db2.gz JNCGPBNBOOVFME-AWEZNQCLSA-N 1 1 349.431 2.289 20 5 EEBDMO COc1cc(C[NH+]2CCC(N3CCO[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC000351977696 162011630 /nfs/dbraw/zinc/01/16/30/162011630.db2.gz JNCGPBNBOOVFME-AWEZNQCLSA-N 1 1 349.431 2.289 20 5 EEBDMO CN(C)c1cc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cc[nH+]1 ZINC000352455148 162140754 /nfs/dbraw/zinc/14/07/54/162140754.db2.gz FRUAISZUEDBFRK-UHFFFAOYSA-N 1 1 330.300 2.037 20 5 EEBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)COCc1ccco1 ZINC000352543397 162181033 /nfs/dbraw/zinc/18/10/33/162181033.db2.gz DXZCWXIJCLGTBY-HNNXBMFYSA-N 1 1 334.372 2.240 20 5 EEBDMO CCC[N@@H+](CC)C[C@H](C)NS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000352574333 162195066 /nfs/dbraw/zinc/19/50/66/162195066.db2.gz GDRXZFLBOZQXFS-ZDUSSCGKSA-N 1 1 343.449 2.302 20 5 EEBDMO C[NH+](C)[C@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000355377544 163167989 /nfs/dbraw/zinc/16/79/89/163167989.db2.gz CLMHTXHRHNAJEY-INIZCTEOSA-N 1 1 343.383 2.203 20 5 EEBDMO COc1cc(C[N@H+]2C[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000356276894 163390134 /nfs/dbraw/zinc/39/01/34/163390134.db2.gz HLQCUVSYRMSEHP-CABZTGNLSA-N 1 1 346.330 2.060 20 5 EEBDMO COc1cc(C[N@@H+]2C[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000356276894 163390137 /nfs/dbraw/zinc/39/01/37/163390137.db2.gz HLQCUVSYRMSEHP-CABZTGNLSA-N 1 1 346.330 2.060 20 5 EEBDMO Cc1c(CN2CCN([C@@H]3CCC[N@H+](C)C3)CC2)cccc1[N+](=O)[O-] ZINC000364547612 165179243 /nfs/dbraw/zinc/17/92/43/165179243.db2.gz RTLLHYXKCAQMDG-QGZVFWFLSA-N 1 1 332.448 2.115 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000365073185 165369793 /nfs/dbraw/zinc/36/97/93/165369793.db2.gz QUVQYLKCELLONL-UONOGXRCSA-N 1 1 348.403 2.196 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(n2cccn2)CC1 ZINC000365159660 165394193 /nfs/dbraw/zinc/39/41/93/165394193.db2.gz KIYRSBFRNHLZMF-ZDUSSCGKSA-N 1 1 343.387 2.455 20 5 EEBDMO O=C(c1ccc[nH]1)N1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000368876530 166144881 /nfs/dbraw/zinc/14/48/81/166144881.db2.gz QMYROQJBNIHKGG-UHFFFAOYSA-N 1 1 328.372 2.271 20 5 EEBDMO O=C(c1ccc[nH]1)N1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000368876530 166144885 /nfs/dbraw/zinc/14/48/85/166144885.db2.gz QMYROQJBNIHKGG-UHFFFAOYSA-N 1 1 328.372 2.271 20 5 EEBDMO COc1ccc(C[NH+]2CCC([C@@H](O)c3ncc[nH]3)CC2)cc1[N+](=O)[O-] ZINC000369140426 166197741 /nfs/dbraw/zinc/19/77/41/166197741.db2.gz SBZUABIBAJAOMZ-MRXNPFEDSA-N 1 1 346.387 2.272 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2c[nH+]c3n2CCCC3)c1 ZINC000375539436 167155588 /nfs/dbraw/zinc/15/55/88/167155588.db2.gz CLKKPHJQDPXSQH-UHFFFAOYSA-N 1 1 344.371 2.456 20 5 EEBDMO CCC[N@H+](CC(=O)NC)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000123001693 222197400 /nfs/dbraw/zinc/19/74/00/222197400.db2.gz MLTJZLHMVNTDFS-UHFFFAOYSA-N 1 1 344.209 2.315 20 5 EEBDMO CCC[N@@H+](CC(=O)NC)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000123001693 222197402 /nfs/dbraw/zinc/19/74/02/222197402.db2.gz MLTJZLHMVNTDFS-UHFFFAOYSA-N 1 1 344.209 2.315 20 5 EEBDMO C[NH+](C)CCCC1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 ZINC000272670805 269006676 /nfs/dbraw/zinc/00/66/76/269006676.db2.gz KREMQZJVCRULOI-UHFFFAOYSA-N 1 1 335.404 2.494 20 5 EEBDMO CCC[N@H+]1CC[C@@H](CNC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000272800952 269021767 /nfs/dbraw/zinc/02/17/67/269021767.db2.gz HNPYZTATTDBPFB-LBPRGKRZSA-N 1 1 336.392 2.457 20 5 EEBDMO CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000289661414 275136836 /nfs/dbraw/zinc/13/68/36/275136836.db2.gz FKGDRKJNPLJXHZ-AWEZNQCLSA-N 1 1 335.404 2.473 20 5 EEBDMO C[C@H]1C[C@@H](N2CCOCC2)C[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000289966386 275166124 /nfs/dbraw/zinc/16/61/24/275166124.db2.gz ZGXYIIRRDLMVGH-BWTRYIQHSA-N 1 1 331.416 2.403 20 5 EEBDMO Cc1cnn([C@@H]2CC[N@@H+]([C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000289988894 275168271 /nfs/dbraw/zinc/16/82/71/275168271.db2.gz SFWQVJDVSVCGKY-XJKSGUPXSA-N 1 1 343.387 2.374 20 5 EEBDMO Cc1cnn([C@@H]2CC[N@H+]([C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000289988894 275168272 /nfs/dbraw/zinc/16/82/72/275168272.db2.gz SFWQVJDVSVCGKY-XJKSGUPXSA-N 1 1 343.387 2.374 20 5 EEBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000291051540 275264972 /nfs/dbraw/zinc/26/49/72/275264972.db2.gz XHRZQGGGYJFPKG-LLVKDONJSA-N 1 1 338.364 2.353 20 5 EEBDMO COc1cc(C[N@@H+]2CC[C@@H](n3cccn3)C2)c([N+](=O)[O-])cc1OC ZINC000291294966 275291313 /nfs/dbraw/zinc/29/13/13/275291313.db2.gz PZBWWGXBGFMVJR-CYBMUJFWSA-N 1 1 332.360 2.256 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@@H](n3cccn3)C2)c([N+](=O)[O-])cc1OC ZINC000291294966 275291315 /nfs/dbraw/zinc/29/13/15/275291315.db2.gz PZBWWGXBGFMVJR-CYBMUJFWSA-N 1 1 332.360 2.256 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](n2cccn2)C1 ZINC000291696303 275330945 /nfs/dbraw/zinc/33/09/45/275330945.db2.gz HSNIKLLKMAPWIB-DOMZBBRYSA-N 1 1 329.360 2.065 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](n2cccn2)C1 ZINC000291696303 275330946 /nfs/dbraw/zinc/33/09/46/275330946.db2.gz HSNIKLLKMAPWIB-DOMZBBRYSA-N 1 1 329.360 2.065 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(c3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)C2)C1 ZINC000292150500 275384777 /nfs/dbraw/zinc/38/47/77/275384777.db2.gz CFYIACCFYZSVCP-QGZVFWFLSA-N 1 1 330.388 2.012 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N(C)CC[N@@H+](C)C1CCN(C)CC1 ZINC000194703783 281256898 /nfs/dbraw/zinc/25/68/98/281256898.db2.gz QJZKLJCHMXVUHU-UHFFFAOYSA-N 1 1 348.447 2.001 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N(C)CCN(C)C1CC[NH+](C)CC1 ZINC000194703783 281256902 /nfs/dbraw/zinc/25/69/02/281256902.db2.gz QJZKLJCHMXVUHU-UHFFFAOYSA-N 1 1 348.447 2.001 20 5 EEBDMO C[C@@H](CCO)CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000295158639 293631477 /nfs/dbraw/zinc/63/14/77/293631477.db2.gz RYIWESSYXFJATH-CZUORRHYSA-N 1 1 332.404 2.416 20 5 EEBDMO 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CC(=O)c1cc([N+](=O)[O-])ccc1N1CC[N@@H+](CC(C)(C)O)[C@H](C)C1 ZINC000286618123 464979572 /nfs/dbraw/zinc/97/95/72/464979572.db2.gz JKKYGECKNIWIHL-GFCCVEGCSA-N 1 1 335.404 2.079 20 5 EEBDMO O=c1[nH]c(NC[C@@H]2CCCC[N@H+]2C2CC2)nc2ccc([N+](=O)[O-])cc21 ZINC000343050175 465471806 /nfs/dbraw/zinc/47/18/06/465471806.db2.gz CBISVEXXADBLIG-ZDUSSCGKSA-N 1 1 343.387 2.672 20 5 EEBDMO CC(C)[N@H+](C)C[C@H](C)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000356757221 465523117 /nfs/dbraw/zinc/52/31/17/465523117.db2.gz CBBGIVSQSASWRT-LBPRGKRZSA-N 1 1 332.404 2.464 20 5 EEBDMO COc1ccc(CNC(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000339860006 465554818 /nfs/dbraw/zinc/55/48/18/465554818.db2.gz QYMAXUWFFUGDIB-UONOGXRCSA-N 1 1 348.403 2.029 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000348523878 465652090 /nfs/dbraw/zinc/65/20/90/465652090.db2.gz BKONITWUIYKXNI-CYBMUJFWSA-N 1 1 343.387 2.444 20 5 EEBDMO C[N@H+]1C[C@@H](NC(=O)c2csc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000371275992 465682913 /nfs/dbraw/zinc/68/29/13/465682913.db2.gz RKOCCRDZRAEDDO-ZIAGYGMSSA-N 1 1 331.397 2.484 20 5 EEBDMO C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCCN2CCc1ccc([N+](=O)[O-])cc1 ZINC000371295405 465696604 /nfs/dbraw/zinc/69/66/04/465696604.db2.gz RDHINXIRHSGJCS-KURKYZTESA-N 1 1 333.432 2.321 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000330606216 465728485 /nfs/dbraw/zinc/72/84/85/465728485.db2.gz ZTQYBSDSVHMJGL-UONOGXRCSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)N(C)C[C@H]1C ZINC000330606216 465728492 /nfs/dbraw/zinc/72/84/92/465728492.db2.gz ZTQYBSDSVHMJGL-UONOGXRCSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)N(C)C[C@H]1C ZINC000330606216 465728496 /nfs/dbraw/zinc/72/84/96/465728496.db2.gz ZTQYBSDSVHMJGL-UONOGXRCSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000338071407 465797811 /nfs/dbraw/zinc/79/78/11/465797811.db2.gz BZMFKCXRVKZXNQ-UHFFFAOYSA-N 1 1 331.376 2.298 20 5 EEBDMO COc1c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cccc1[N+](=O)[O-] ZINC000357141645 465806856 /nfs/dbraw/zinc/80/68/56/465806856.db2.gz IGIOMFUJJGWUIM-CYBMUJFWSA-N 1 1 333.388 2.350 20 5 EEBDMO COc1cc(C[N@H+](C)C2CC(O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000353501457 465936134 /nfs/dbraw/zinc/93/61/34/465936134.db2.gz ZIWUDQSEBWOJRX-UHFFFAOYSA-N 1 1 332.303 2.160 20 5 EEBDMO COc1cc(C[N@@H+](C)C2CC(O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000353501457 465936140 /nfs/dbraw/zinc/93/61/40/465936140.db2.gz ZIWUDQSEBWOJRX-UHFFFAOYSA-N 1 1 332.303 2.160 20 5 EEBDMO COc1ccc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc1 ZINC000338286413 465985610 /nfs/dbraw/zinc/98/56/10/465985610.db2.gz PNEDHCGOBKBHBP-CYBMUJFWSA-N 1 1 329.360 2.080 20 5 EEBDMO COc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc1 ZINC000338286413 465985618 /nfs/dbraw/zinc/98/56/18/465985618.db2.gz PNEDHCGOBKBHBP-CYBMUJFWSA-N 1 1 329.360 2.080 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@H](CNc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000301746604 466022649 /nfs/dbraw/zinc/02/26/49/466022649.db2.gz QADMZXPFYOZOKU-GFCCVEGCSA-N 1 1 328.800 2.412 20 5 EEBDMO C[C@@H](CO)[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CC1CCC1 ZINC000361496183 466046317 /nfs/dbraw/zinc/04/63/17/466046317.db2.gz JPYUMPBYKREKJX-ZDUSSCGKSA-N 1 1 335.404 2.041 20 5 EEBDMO O=C([C@H]1CCC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1)N1CCCC1 ZINC000331374780 466054294 /nfs/dbraw/zinc/05/42/94/466054294.db2.gz KIAABOKMNMZPAD-HNNXBMFYSA-N 1 1 347.415 2.308 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]CC1(CO)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000353674578 466057528 /nfs/dbraw/zinc/05/75/28/466057528.db2.gz RRBKROUKSCWJTH-OAHLLOKOSA-N 1 1 330.388 2.170 20 5 EEBDMO Cn1cc(C[N@H+]2C[C@@H]3CC[C@H](O)[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000346336023 466085897 /nfs/dbraw/zinc/08/58/97/466085897.db2.gz PKEZPCMUBWTZAM-XKQJLSEDSA-N 1 1 342.399 2.198 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@](F)(CO)C3)o2)c1 ZINC000338590180 466241822 /nfs/dbraw/zinc/24/18/22/466241822.db2.gz DMMCCDZBZRAVNR-MRXNPFEDSA-N 1 1 335.335 2.199 20 5 EEBDMO CC[C@@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000304287226 466275964 /nfs/dbraw/zinc/27/59/64/466275964.db2.gz BCFFCHQPGMGCGK-JKSUJKDBSA-N 1 1 335.404 2.467 20 5 EEBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000304287226 466275968 /nfs/dbraw/zinc/27/59/68/466275968.db2.gz BCFFCHQPGMGCGK-JKSUJKDBSA-N 1 1 335.404 2.467 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N2C[C@@H]3CCCC[N@@H+]3C[C@@H]2C)c1[N+](=O)[O-] ZINC000331913289 466302907 /nfs/dbraw/zinc/30/29/07/466302907.db2.gz BDAMELAZVFARSV-RYUDHWBXSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N2C[C@@H]3CCCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-] ZINC000331913289 466302914 /nfs/dbraw/zinc/30/29/14/466302914.db2.gz BDAMELAZVFARSV-RYUDHWBXSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2C[C@@H]3CCCC[N@@H+]3C[C@@H]2C)c1[N+](=O)[O-] ZINC000331913289 466302926 /nfs/dbraw/zinc/30/29/26/466302926.db2.gz BDAMELAZVFARSV-RYUDHWBXSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2C[C@@H]3CCCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-] ZINC000331913289 466302934 /nfs/dbraw/zinc/30/29/34/466302934.db2.gz BDAMELAZVFARSV-RYUDHWBXSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)(C)[N@H+](Cc1ccccc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000305032228 466326678 /nfs/dbraw/zinc/32/66/78/466326678.db2.gz ASPZLLKVFILPJC-MRXNPFEDSA-N 1 1 332.404 2.453 20 5 EEBDMO COc1ccc(-c2ccc(C[NH2+]CC(=O)NC3CC3)o2)c([N+](=O)[O-])c1 ZINC000338713883 466329440 /nfs/dbraw/zinc/32/94/40/466329440.db2.gz PPGLEHFAORTORU-UHFFFAOYSA-N 1 1 345.355 2.232 20 5 EEBDMO CCOC(=O)CC[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000338782195 466375311 /nfs/dbraw/zinc/37/53/11/466375311.db2.gz JWANXLJIVZCZGE-UHFFFAOYSA-N 1 1 334.332 2.030 20 5 EEBDMO CCOC(=O)CC[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000338782195 466375317 /nfs/dbraw/zinc/37/53/17/466375317.db2.gz JWANXLJIVZCZGE-UHFFFAOYSA-N 1 1 334.332 2.030 20 5 EEBDMO C[C@@H](O)C[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000305205377 466379102 /nfs/dbraw/zinc/37/91/02/466379102.db2.gz CJXGTBOWNXLAJM-PWSUYJOCSA-N 1 1 341.795 2.422 20 5 EEBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000305205377 466379113 /nfs/dbraw/zinc/37/91/13/466379113.db2.gz CJXGTBOWNXLAJM-PWSUYJOCSA-N 1 1 341.795 2.422 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](C)[C@H]1CO ZINC000305455946 466410503 /nfs/dbraw/zinc/41/05/03/466410503.db2.gz TVVACTIQJMHLRA-MLGOLLRUSA-N 1 1 335.404 2.325 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1C ZINC000332188832 466435424 /nfs/dbraw/zinc/43/54/24/466435424.db2.gz BVRTWTZZASBNQV-CHWSQXEVSA-N 1 1 335.404 2.376 20 5 EEBDMO CC(C)(C[NH+]1CCOCC1)Nc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000308668038 466499276 /nfs/dbraw/zinc/49/92/76/466499276.db2.gz OBFWBYFDCPUIJZ-UHFFFAOYSA-N 1 1 331.376 2.061 20 5 EEBDMO Cc1c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000363935977 466660736 /nfs/dbraw/zinc/66/07/36/466660736.db2.gz CXXZXYYDHZILSG-NEPJUHHUSA-N 1 1 348.359 2.168 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412186949 467034674 /nfs/dbraw/zinc/03/46/74/467034674.db2.gz TWMZBRMYOGDVBN-BEMMVCDISA-N 1 1 329.400 2.297 20 5 EEBDMO O=C(CC[N@H+]1CC[C@H]([C@@H]2CCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000370990036 467065712 /nfs/dbraw/zinc/06/57/12/467065712.db2.gz BIOSROJRLFSFII-UONOGXRCSA-N 1 1 333.388 2.282 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+](C2CC2)C[C@@H](C)C1 ZINC000451080273 467241918 /nfs/dbraw/zinc/24/19/18/467241918.db2.gz BNFNLKVTDGKDKQ-KBPBESRZSA-N 1 1 346.431 2.338 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420343725 467370405 /nfs/dbraw/zinc/37/04/05/467370405.db2.gz RCHZBNUWXZKYCX-CABCVRRESA-N 1 1 346.431 2.163 20 5 EEBDMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1 ZINC000452973708 467449187 /nfs/dbraw/zinc/44/91/87/467449187.db2.gz KLRURWQPCHIQLF-YQQAZPJKSA-N 1 1 331.416 2.326 20 5 EEBDMO C[C@@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1C[NH3+] ZINC000415126294 467495820 /nfs/dbraw/zinc/49/58/20/467495820.db2.gz LXYAQPYPQCOVSY-UKRRQHHQSA-N 1 1 343.431 2.412 20 5 EEBDMO C[C@@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1C[NH3+] ZINC000415126294 467495824 /nfs/dbraw/zinc/49/58/24/467495824.db2.gz LXYAQPYPQCOVSY-UKRRQHHQSA-N 1 1 343.431 2.412 20 5 EEBDMO COC(=O)Cc1ccc(NCC[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000450259963 467811008 /nfs/dbraw/zinc/81/10/08/467811008.db2.gz YWJLZKLSRKHBPY-ZDUSSCGKSA-N 1 1 335.404 2.454 20 5 EEBDMO C/C(=C\c1ccccc1)C[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000494293605 468042608 /nfs/dbraw/zinc/04/26/08/468042608.db2.gz QSURMQISDSBHPZ-LEHPZIBWSA-N 1 1 330.388 2.188 20 5 EEBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H](C)C[NH+]1CCOCC1 ZINC000600839900 468668975 /nfs/dbraw/zinc/66/89/75/468668975.db2.gz WDRJQZNVYPOJPZ-HNNXBMFYSA-N 1 1 349.431 2.300 20 5 EEBDMO COC(=O)Cc1ccc(NC[C@@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000583481122 468703373 /nfs/dbraw/zinc/70/33/73/468703373.db2.gz OQEJYBUDZFZXIM-AWEZNQCLSA-N 1 1 335.404 2.453 20 5 EEBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000595298247 468805180 /nfs/dbraw/zinc/80/51/80/468805180.db2.gz PIMGDAPWNRBANT-WCQYABFASA-N 1 1 338.408 2.408 20 5 EEBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000595298247 468805185 /nfs/dbraw/zinc/80/51/85/468805185.db2.gz PIMGDAPWNRBANT-WCQYABFASA-N 1 1 338.408 2.408 20 5 EEBDMO CC(C)O[C@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000593053204 468852244 /nfs/dbraw/zinc/85/22/44/468852244.db2.gz QENYCUQXQWEFGN-RDJZCZTQSA-N 1 1 338.404 2.224 20 5 EEBDMO Cc1noc(C[N@H+]2CC[C@@H](C(=O)N(C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000595476561 468869298 /nfs/dbraw/zinc/86/92/98/468869298.db2.gz RNAMQRXTVIOBQO-CYBMUJFWSA-N 1 1 344.371 2.376 20 5 EEBDMO Cc1noc(C[N@@H+]2CC[C@@H](C(=O)N(C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000595476561 468869304 /nfs/dbraw/zinc/86/93/04/468869304.db2.gz RNAMQRXTVIOBQO-CYBMUJFWSA-N 1 1 344.371 2.376 20 5 EEBDMO CC[N@H+]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000601439686 468875041 /nfs/dbraw/zinc/87/50/41/468875041.db2.gz IRNMNKPXDPEYHR-CYBMUJFWSA-N 1 1 341.433 2.008 20 5 EEBDMO CC(C)[N@@H+](C)C[C@H](O)CN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000595521861 468887468 /nfs/dbraw/zinc/88/74/68/468887468.db2.gz FXDSCXQLLXMSFW-AEFFLSMTSA-N 1 1 335.448 2.475 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000595637605 468933838 /nfs/dbraw/zinc/93/38/38/468933838.db2.gz SCEUOZQXFWTEDQ-JFILPPLUSA-N 1 1 333.388 2.015 20 5 EEBDMO Cn1cc(C[N@@H+]2CCc3n[nH]cc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598939271 469058311 /nfs/dbraw/zinc/05/83/11/469058311.db2.gz HTWDUUZAKPSVTC-UHFFFAOYSA-N 1 1 338.371 2.277 20 5 EEBDMO Cn1cc(C[N@H+]2CCc3n[nH]cc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598939271 469058320 /nfs/dbraw/zinc/05/83/20/469058320.db2.gz HTWDUUZAKPSVTC-UHFFFAOYSA-N 1 1 338.371 2.277 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000602797654 469082074 /nfs/dbraw/zinc/08/20/74/469082074.db2.gz NPEUSLGDMKTSKT-GDBMZVCRSA-N 1 1 333.436 2.048 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000602845960 469113367 /nfs/dbraw/zinc/11/33/67/469113367.db2.gz NWAJMRZQFJVWKW-MRXNPFEDSA-N 1 1 334.420 2.381 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC[C@@H](N(C)c2ccccc2)C1 ZINC000602902721 469153828 /nfs/dbraw/zinc/15/38/28/469153828.db2.gz LKWPOSGNBOEHQA-MRXNPFEDSA-N 1 1 329.404 2.310 20 5 EEBDMO Nc1ccc(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)nc1[N+](=O)[O-] ZINC000596100926 469154616 /nfs/dbraw/zinc/15/46/16/469154616.db2.gz DPEAGYBMYIPSDK-GFCCVEGCSA-N 1 1 347.444 2.958 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21 ZINC000602997484 469213354 /nfs/dbraw/zinc/21/33/54/469213354.db2.gz LHAURXHQJQGHHF-LZWOXQAQSA-N 1 1 347.415 2.467 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21 ZINC000602997484 469213362 /nfs/dbraw/zinc/21/33/62/469213362.db2.gz LHAURXHQJQGHHF-LZWOXQAQSA-N 1 1 347.415 2.467 20 5 EEBDMO O=[N+]([O-])c1c2cccnc2ccc1N1CCC[C@@H]([NH+]2CCOCC2)C1 ZINC000596247562 469220536 /nfs/dbraw/zinc/22/05/36/469220536.db2.gz QURIFWDETZXLLM-CQSZACIVSA-N 1 1 342.399 2.444 20 5 EEBDMO C[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@H](C)[NH+]1CCOCC1 ZINC000611706313 469306633 /nfs/dbraw/zinc/30/66/33/469306633.db2.gz IWCZIQBLLLQVRR-NEPJUHHUSA-N 1 1 331.376 2.059 20 5 EEBDMO CCC(O)(CC)C[N@@H+](C)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000599672616 469332895 /nfs/dbraw/zinc/33/28/95/469332895.db2.gz HFSXGPGCDJKVMD-UHFFFAOYSA-N 1 1 339.392 2.025 20 5 EEBDMO O=[N+]([O-])c1ccccc1OCCN1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000603848402 469436500 /nfs/dbraw/zinc/43/65/00/469436500.db2.gz SADVLJOQYZKQOD-INIZCTEOSA-N 1 1 349.431 2.160 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000604533311 469487737 /nfs/dbraw/zinc/48/77/37/469487737.db2.gz RVXWDVLSYJTZPF-CQSZACIVSA-N 1 1 334.420 2.243 20 5 EEBDMO CCn1ccc(C[N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000616786417 469502093 /nfs/dbraw/zinc/50/20/93/469502093.db2.gz YNVZAKUVRFTWFR-OAHLLOKOSA-N 1 1 333.388 2.288 20 5 EEBDMO CC[C@@H]1[C@H](C)CC[N@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000774626280 577407322 /nfs/dbraw/zinc/40/73/22/577407322.db2.gz SYCVMTBWQRWMOB-IUODEOHRSA-N 1 1 346.387 2.441 20 5 EEBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@@H]1COc2ccccc2O1 ZINC000776275733 577456392 /nfs/dbraw/zinc/45/63/92/577456392.db2.gz KWMMUIQPLIBEIE-CVEARBPZSA-N 1 1 344.367 2.400 20 5 EEBDMO CC1(C)CCC[N@H+](CCNS(=O)(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000767637817 577541740 /nfs/dbraw/zinc/54/17/40/577541740.db2.gz NUFDMIPNQPDPOA-UHFFFAOYSA-N 1 1 347.462 2.057 20 5 EEBDMO CC1(C)CCC[N@@H+](CCNS(=O)(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000767637817 577541741 /nfs/dbraw/zinc/54/17/41/577541741.db2.gz NUFDMIPNQPDPOA-UHFFFAOYSA-N 1 1 347.462 2.057 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000743639567 577888282 /nfs/dbraw/zinc/88/82/82/577888282.db2.gz WGVBSLCZIZECLI-JOYOIKCWSA-N 1 1 336.348 2.024 20 5 EEBDMO CC(C)[C@@H](C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000741014853 578111122 /nfs/dbraw/zinc/11/11/22/578111122.db2.gz QQHMMAZXACWREH-INIZCTEOSA-N 1 1 349.387 2.197 20 5 EEBDMO Cn1ncc([N+](=O)[O-])c1NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000892324698 678809712 /nfs/dbraw/zinc/80/97/12/678809712.db2.gz BVWXJQFYVKQUOP-HNNXBMFYSA-N 1 1 329.404 2.305 20 5 EEBDMO C[C@@H]1CO[C@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000893052348 683649775 /nfs/dbraw/zinc/64/97/75/683649775.db2.gz BJIXNUAIYKUJDQ-RCBQFDQVSA-N 1 1 334.372 2.137 20 5 EEBDMO C[C@@H]1CO[C@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000893052348 683649781 /nfs/dbraw/zinc/64/97/81/683649781.db2.gz BJIXNUAIYKUJDQ-RCBQFDQVSA-N 1 1 334.372 2.137 20 5 EEBDMO O=C(NCc1ccc(C[NH2+]Cc2ccsc2)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001034816476 1196771945 /nfs/dbraw/zinc/77/19/45/1196771945.db2.gz PDRVJTKVJLEOHH-HZPDHXFCSA-N 1 1 345.424 2.319 20 5 EEBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c3nonc32)CC[N@H+](C2CCC2)C1 ZINC000813630289 1199110159 /nfs/dbraw/zinc/11/01/59/1199110159.db2.gz JYLKOZFZNJQHTD-NSHDSACASA-N 1 1 331.376 2.442 20 5 EEBDMO C[C@H]1CC(F)(F)CCN1C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000877044612 1199853307 /nfs/dbraw/zinc/85/33/07/1199853307.db2.gz YQUVOHLDJGDONL-IINYFYTJSA-N 1 1 327.331 2.415 20 5 EEBDMO C[C@@H]1CN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)[N@@H+]1C ZINC000878654851 1200601750 /nfs/dbraw/zinc/60/17/50/1200601750.db2.gz YLMVBBWNCBNHDS-TXEJJXNPSA-N 1 1 331.376 2.169 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@@H](CF)C1 ZINC000880293971 1201449054 /nfs/dbraw/zinc/44/90/54/1201449054.db2.gz GKVFFYGZHQYGDH-MNOVXSKESA-N 1 1 325.340 2.222 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@@H](CF)C1 ZINC000880293971 1201449056 /nfs/dbraw/zinc/44/90/56/1201449056.db2.gz GKVFFYGZHQYGDH-MNOVXSKESA-N 1 1 325.340 2.222 20 5 EEBDMO CC(C)CO[C@H]1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1 ZINC000867927623 1201707704 /nfs/dbraw/zinc/70/77/04/1201707704.db2.gz KJWFUPIDBFHGKV-RDJZCZTQSA-N 1 1 335.404 2.042 20 5 EEBDMO C[N@H+]1CCCN(Cc2cc([N+](=O)[O-])ccc2Br)CC1 ZINC000929218236 1206457069 /nfs/dbraw/zinc/45/70/69/1206457069.db2.gz QPYVMLZYKKETEJ-UHFFFAOYSA-N 1 1 328.210 2.495 20 5 EEBDMO Cc1nc(N2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n[nH]1 ZINC000931628754 1207428777 /nfs/dbraw/zinc/42/87/77/1207428777.db2.gz QNSRDNFPNSLRNO-GFCCVEGCSA-N 1 1 330.392 2.213 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1)C(C)C 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EEBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cc(C)ccc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001225683284 1301122414 /nfs/dbraw/zinc/12/24/14/1301122414.db2.gz QVHZZDGOBARROW-LBEHMCEESA-N 1 1 334.372 2.449 20 5 EEBDMO Cc1nc(O[C@H]2CCC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229376068 1302752499 /nfs/dbraw/zinc/75/24/99/1302752499.db2.gz PIBLPJGAVCUFNP-AWEZNQCLSA-N 1 1 344.371 2.442 20 5 EEBDMO Cc1nc(O[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229376068 1302752508 /nfs/dbraw/zinc/75/25/08/1302752508.db2.gz PIBLPJGAVCUFNP-AWEZNQCLSA-N 1 1 344.371 2.442 20 5 EEBDMO C[C@@]1(CO)C[N@@H+](Cc2ccc3ccc4cccnc4c3n2)CC[C@@H]1O ZINC001232219496 1304041383 /nfs/dbraw/zinc/04/13/83/1304041383.db2.gz UTWUFQOKLKXBGE-PXNSSMCTSA-N 1 1 337.423 2.348 20 5 EEBDMO CC[N@H+]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1C ZINC000782523426 1304079050 /nfs/dbraw/zinc/07/90/50/1304079050.db2.gz VUAFRJOVJNRQPN-GFCCVEGCSA-N 1 1 338.383 2.089 20 5 EEBDMO CCN1CC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1C ZINC000782523426 1304079053 /nfs/dbraw/zinc/07/90/53/1304079053.db2.gz VUAFRJOVJNRQPN-GFCCVEGCSA-N 1 1 338.383 2.089 20 5 EEBDMO CCN1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1C ZINC000782523426 1304079059 /nfs/dbraw/zinc/07/90/59/1304079059.db2.gz VUAFRJOVJNRQPN-GFCCVEGCSA-N 1 1 338.383 2.089 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c1F ZINC000831555401 1314598218 /nfs/dbraw/zinc/59/82/18/1314598218.db2.gz ODOJFDOJSDPOAW-ZJUUUORDSA-N 1 1 327.331 2.346 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c1F ZINC000831555401 1314598220 /nfs/dbraw/zinc/59/82/20/1314598220.db2.gz ODOJFDOJSDPOAW-ZJUUUORDSA-N 1 1 327.331 2.346 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000840184281 1315320852 /nfs/dbraw/zinc/32/08/52/1315320852.db2.gz KFZRVIMKOLUTHZ-MRXNPFEDSA-N 1 1 332.360 2.177 20 5 EEBDMO C[C@@H]([NH2+]Cc1ccccc1S(C)(=O)=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000840864459 1315423690 /nfs/dbraw/zinc/42/36/90/1315423690.db2.gz CGSHZEIYUIGXKS-LLVKDONJSA-N 1 1 349.412 2.431 20 5 EEBDMO Cc1nn(C[N@H+]2CC[C@H](c3cccnc3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000842629906 1315739026 /nfs/dbraw/zinc/73/90/26/1315739026.db2.gz YYZRKZSCGYRYEX-AWEZNQCLSA-N 1 1 338.371 2.490 20 5 EEBDMO COc1cc(Cc2noc([C@H]([NH3+])CC(F)F)n2)ccc1[N+](=O)[O-] ZINC000843191360 1315863371 /nfs/dbraw/zinc/86/33/71/1315863371.db2.gz FOZLOVFWHWRNQF-MRVPVSSYSA-N 1 1 328.275 2.232 20 5 EEBDMO CC(=O)N[C@H]1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254478394 1318084304 /nfs/dbraw/zinc/08/43/04/1318084304.db2.gz AZHOHOHMDSWPCW-HNNXBMFYSA-N 1 1 346.431 2.164 20 5 EEBDMO O=C(N[C@@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)C1CCC1 ZINC001254610344 1318144281 /nfs/dbraw/zinc/14/42/81/1318144281.db2.gz JWPMHEYNKANFHE-AEFFLSMTSA-N 1 1 343.427 2.443 20 5 EEBDMO 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NANNISJBUABXIG-FZMZJTMJSA-N 1 1 334.376 2.161 20 5 EEBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000106542557 159316205 /nfs/dbraw/zinc/31/62/05/159316205.db2.gz JMVPPMVILMEKOT-OAHLLOKOSA-N 1 1 346.431 2.453 20 5 EEBDMO CCOc1cc(N[C@@H](C)CCN2CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC000184827388 160018755 /nfs/dbraw/zinc/01/87/55/160018755.db2.gz KKQBKDIQRGAHCQ-AWEZNQCLSA-N 1 1 336.436 2.431 20 5 EEBDMO O=C(CC[N@H+]1CC[C@H]2OCCC[C@H]2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000246969938 160303052 /nfs/dbraw/zinc/30/30/52/160303052.db2.gz XUCZUSAYRPPPSE-XJKSGUPXSA-N 1 1 333.388 2.424 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000341933827 161025448 /nfs/dbraw/zinc/02/54/48/161025448.db2.gz DRDZLPPPOIOUBY-ZDUSSCGKSA-N 1 1 343.449 2.302 20 5 EEBDMO COc1cncc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000343860084 161175325 /nfs/dbraw/zinc/17/53/25/161175325.db2.gz LHZOAWBUQWQCHW-CYBMUJFWSA-N 1 1 329.360 2.080 20 5 EEBDMO COc1cncc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000343860084 161175326 /nfs/dbraw/zinc/17/53/26/161175326.db2.gz LHZOAWBUQWQCHW-CYBMUJFWSA-N 1 1 329.360 2.080 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3C[C@@H]4CC[C@@H](O)[C@@H]4C3)o2)c1 ZINC000344036287 161192161 /nfs/dbraw/zinc/19/21/61/161192161.db2.gz SMACOWBLKUHRJY-NUEKZKHPSA-N 1 1 343.383 2.495 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](CO)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000344130957 161200740 /nfs/dbraw/zinc/20/07/40/161200740.db2.gz IUPSHBVRBYGIRL-JSGCOSHPSA-N 1 1 335.404 2.325 20 5 EEBDMO CCC[C@]1(CO)CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000344132126 161200764 /nfs/dbraw/zinc/20/07/64/161200764.db2.gz OVZALBRDIKRSSA-WMZOPIPTSA-N 1 1 347.415 2.185 20 5 EEBDMO C[C@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC000344357502 161219883 /nfs/dbraw/zinc/21/98/83/161219883.db2.gz VSXJHMFLUFDSSC-UONOGXRCSA-N 1 1 334.420 2.243 20 5 EEBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nnnn1CC1CC1 ZINC000344834955 161249603 /nfs/dbraw/zinc/24/96/03/161249603.db2.gz QIIRASPNZFUUCL-KPKJPENVSA-N 1 1 328.376 2.184 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000344845198 161250462 /nfs/dbraw/zinc/25/04/62/161250462.db2.gz ZOCVYHHWCCFHOG-KBPBESRZSA-N 1 1 335.404 2.271 20 5 EEBDMO C[C@@H]1[C@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C ZINC000345327105 161292269 /nfs/dbraw/zinc/29/22/69/161292269.db2.gz SUKJSKWEYCJFRY-CZUORRHYSA-N 1 1 334.420 2.386 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000351955703 162000161 /nfs/dbraw/zinc/00/01/61/162000161.db2.gz KTRJNFVLXLYMGG-UWVGGRQHSA-N 1 1 343.330 2.409 20 5 EEBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NC(C1CC1)C1CC1 ZINC000352550515 162183217 /nfs/dbraw/zinc/18/32/17/162183217.db2.gz OGSNYFDXIKZIHI-UHFFFAOYSA-N 1 1 331.416 2.374 20 5 EEBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NC(C1CC1)C1CC1 ZINC000352550515 162183219 /nfs/dbraw/zinc/18/32/19/162183219.db2.gz OGSNYFDXIKZIHI-UHFFFAOYSA-N 1 1 331.416 2.374 20 5 EEBDMO COc1c(O)cccc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000352608886 162210344 /nfs/dbraw/zinc/21/03/44/162210344.db2.gz PJTGGDLIFLPTNB-ZDUSSCGKSA-N 1 1 344.371 2.390 20 5 EEBDMO COc1c(O)cccc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000352608886 162210347 /nfs/dbraw/zinc/21/03/47/162210347.db2.gz PJTGGDLIFLPTNB-ZDUSSCGKSA-N 1 1 344.371 2.390 20 5 EEBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)N1CCc3ccc([N+](=O)[O-])cc3C1)C2 ZINC000355058102 163066888 /nfs/dbraw/zinc/06/68/88/163066888.db2.gz GHRXPGIBEUFNAF-AWEZNQCLSA-N 1 1 340.383 2.247 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N(CC[NH+](C)C)C2CCCC2)c1[N+](=O)[O-] ZINC000355334123 163149785 /nfs/dbraw/zinc/14/97/85/163149785.db2.gz BNUJQCZWYOTITP-UHFFFAOYSA-N 1 1 337.424 2.388 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2OC)C1 ZINC000356222836 163371209 /nfs/dbraw/zinc/37/12/09/163371209.db2.gz PIBSMLXJCPFHNL-CYBMUJFWSA-N 1 1 335.404 2.407 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000360295967 164277264 /nfs/dbraw/zinc/27/72/64/164277264.db2.gz KOQKGLAMUIGLJQ-UKRRQHHQSA-N 1 1 342.399 2.184 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@H](c3ccco3)C2)c1 ZINC000374004082 167001593 /nfs/dbraw/zinc/00/15/93/167001593.db2.gz UXXDMOZFQPBCFB-HIFRSBDPSA-N 1 1 332.356 2.417 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)[C@@H]2C1 ZINC000272702716 269011318 /nfs/dbraw/zinc/01/13/18/269011318.db2.gz ZAKMHQMCZLYDGZ-BDJLRTHQSA-N 1 1 328.372 2.242 20 5 EEBDMO Cc1c(C(=O)N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000278905272 269249771 /nfs/dbraw/zinc/24/97/71/269249771.db2.gz SEVCFLGXHOITPW-ZDUSSCGKSA-N 1 1 347.415 2.229 20 5 EEBDMO COc1ccc(NC(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000272795976 274182814 /nfs/dbraw/zinc/18/28/14/274182814.db2.gz GYNFRDBNVNSGMK-CHWSQXEVSA-N 1 1 334.376 2.352 20 5 EEBDMO Cc1ccc(C(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000277493992 274298891 /nfs/dbraw/zinc/29/88/91/274298891.db2.gz JOSAFJSMIWKJIR-AWEZNQCLSA-N 1 1 335.404 2.134 20 5 EEBDMO O=C1[C@H]([N@H+]2CC[C@H]([C@H]3CCOC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000374412643 275029973 /nfs/dbraw/zinc/02/99/73/275029973.db2.gz VFHUZHVSAMDVQM-GRDNDAEWSA-N 1 1 345.399 2.059 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2nccc(C(N)=O)c2[N+](=O)[O-])C1 ZINC000290574038 275219443 /nfs/dbraw/zinc/21/94/43/275219443.db2.gz UPKLKKSKGKCDRK-BETUJISGSA-N 1 1 349.435 2.259 20 5 EEBDMO CC(C)[N@@H+](C)C[C@@H](C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000290679116 275228976 /nfs/dbraw/zinc/22/89/76/275228976.db2.gz LGYVLHWODGLGHY-SECBINFHSA-N 1 1 335.451 2.200 20 5 EEBDMO C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)c2ccccc2C1 ZINC000366970224 277096811 /nfs/dbraw/zinc/09/68/11/277096811.db2.gz QRUSWHNBHLVDAE-UHFFFAOYSA-N 1 1 344.346 2.408 20 5 EEBDMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)c2ccccc2C1 ZINC000366970224 277096812 /nfs/dbraw/zinc/09/68/12/277096812.db2.gz QRUSWHNBHLVDAE-UHFFFAOYSA-N 1 1 344.346 2.408 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@]1(C)CCOC1)c1ccc([N+](=O)[O-])cc1 ZINC000353534852 279376033 /nfs/dbraw/zinc/37/60/33/279376033.db2.gz ZTDZEQSTUUQVFI-DOTOQJQBSA-N 1 1 330.388 2.434 20 5 EEBDMO C[C@H](NC(=O)CCCC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000295256991 293663253 /nfs/dbraw/zinc/66/32/53/293663253.db2.gz FUQMGXFKOCTAIV-AWEZNQCLSA-N 1 1 335.404 2.275 20 5 EEBDMO C[C@H]1CN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+](C2CC2)C1 ZINC000297309100 294208617 /nfs/dbraw/zinc/20/86/17/294208617.db2.gz IGCSVEMUOCBWRC-CQSZACIVSA-N 1 1 346.431 2.263 20 5 EEBDMO CCOC1(C)CC[NH+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000298383489 294485806 /nfs/dbraw/zinc/48/58/06/294485806.db2.gz VREDOTKMAATEPN-UHFFFAOYSA-N 1 1 347.415 2.375 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCCN1S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000439217457 315070116 /nfs/dbraw/zinc/07/01/16/315070116.db2.gz RSVXEZHIKQDVDC-ZDUSSCGKSA-N 1 1 341.433 2.008 20 5 EEBDMO COc1ccc(OCC[N@H+]2CC[C@H](C)C[C@H]2[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000443342604 315243201 /nfs/dbraw/zinc/24/32/01/315243201.db2.gz FFAXWRMWUKVJAS-GUTXKFCHSA-N 1 1 338.404 2.464 20 5 EEBDMO CC1(C)CCC[N@@H+](CCNC(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000444609688 315311050 /nfs/dbraw/zinc/31/10/50/315311050.db2.gz BTYIYIXHLLOWSD-UHFFFAOYSA-N 1 1 334.420 2.245 20 5 EEBDMO CCN1CCN(C[C@@H](C)C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449130805 315420907 /nfs/dbraw/zinc/42/09/07/315420907.db2.gz HWXNUVGUOSDLDU-IRXDYDNUSA-N 1 1 348.491 2.389 20 5 EEBDMO CCOc1cc(C[N@H+]2CC[C@H](CN3CCOC3=O)C2)ccc1[N+](=O)[O-] ZINC000496685372 316228494 /nfs/dbraw/zinc/22/84/94/316228494.db2.gz VIJCDOVUJMRRGK-AWEZNQCLSA-N 1 1 349.387 2.268 20 5 EEBDMO CC(C)([NH2+]CC(=O)NC(=O)NC1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000568943054 319530779 /nfs/dbraw/zinc/53/07/79/319530779.db2.gz DKVIEKUCIFYJSF-UHFFFAOYSA-N 1 1 348.403 2.188 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000574513799 320032278 /nfs/dbraw/zinc/03/22/78/320032278.db2.gz CWKLVTJKMYIZTL-GFCCVEGCSA-N 1 1 340.811 2.213 20 5 EEBDMO O=C(C[N@H+]1CCC[C@H]1[C@@H]1CCCOC1)Nc1ccccc1[N+](=O)[O-] ZINC000574873213 320064905 /nfs/dbraw/zinc/06/49/05/320064905.db2.gz GNBKJVROQARBPM-HIFRSBDPSA-N 1 1 333.388 2.424 20 5 EEBDMO C[C@H]1COCC[N@@H+]1C1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000576574477 320183864 /nfs/dbraw/zinc/18/38/64/320183864.db2.gz OZQDQISWIICNSR-HNNXBMFYSA-N 1 1 333.432 2.322 20 5 EEBDMO C[C@H]1COCC[N@H+]1C1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000576574477 320183866 /nfs/dbraw/zinc/18/38/66/320183866.db2.gz OZQDQISWIICNSR-HNNXBMFYSA-N 1 1 333.432 2.322 20 5 EEBDMO CNc1ccc(C(=O)N2CC[N@H+](C3CC3)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000581530215 324271200 /nfs/dbraw/zinc/27/12/00/324271200.db2.gz CYVRHBNQGNRJBX-LBPRGKRZSA-N 1 1 332.404 2.193 20 5 EEBDMO CNc1nccc(C(=O)N(C)CC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000520834504 448935502 /nfs/dbraw/zinc/93/55/02/448935502.db2.gz 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/nfs/dbraw/zinc/16/61/24/466166124.db2.gz GGJMBRDERLPKMC-RDJZCZTQSA-N 1 1 333.388 2.201 20 5 EEBDMO CCOc1cc(N2CC[C@@H]([NH+]3CCOCC3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000357605235 466171407 /nfs/dbraw/zinc/17/14/07/466171407.db2.gz WDJVJCYPOOMEQO-UKRRQHHQSA-N 1 1 335.404 2.293 20 5 EEBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@](O)(C(=O)N2CCCC2)C1 ZINC000331709528 466210017 /nfs/dbraw/zinc/21/00/17/466210017.db2.gz FCHWZSCSONILAA-RDTXWAMCSA-N 1 1 347.415 2.105 20 5 EEBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000372297482 466286734 /nfs/dbraw/zinc/28/67/34/466286734.db2.gz INMKJIYDKNKUML-HNNXBMFYSA-N 1 1 326.356 2.292 20 5 EEBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)n1 ZINC000331911017 466302668 /nfs/dbraw/zinc/30/26/68/466302668.db2.gz YHQIKKQDLWDHHU-HZSPNIEDSA-N 1 1 349.435 2.289 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](n2cccn2)C1 ZINC000338722562 466336155 /nfs/dbraw/zinc/33/61/55/466336155.db2.gz CUNTUZJEIDFLRY-CJNGLKHVSA-N 1 1 343.387 2.455 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](n2cccn2)C1 ZINC000338722562 466336159 /nfs/dbraw/zinc/33/61/59/466336159.db2.gz CUNTUZJEIDFLRY-CJNGLKHVSA-N 1 1 343.387 2.455 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](C)[C@@H]1CO ZINC000305455947 466410519 /nfs/dbraw/zinc/41/05/19/466410519.db2.gz TVVACTIQJMHLRA-WBMJQRKESA-N 1 1 335.404 2.325 20 5 EEBDMO COC(=O)[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1C ZINC000347148166 466429677 /nfs/dbraw/zinc/42/96/77/466429677.db2.gz ZEZGOIUVIIRVOG-MFKMUULPSA-N 1 1 346.343 2.028 20 5 EEBDMO COC(=O)[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1C ZINC000347148166 466429682 /nfs/dbraw/zinc/42/96/82/466429682.db2.gz ZEZGOIUVIIRVOG-MFKMUULPSA-N 1 1 346.343 2.028 20 5 EEBDMO CC(C)(O)[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000305738835 466444149 /nfs/dbraw/zinc/44/41/49/466444149.db2.gz MUGLGRLDDNERQC-ZDUSSCGKSA-N 1 1 341.795 2.422 20 5 EEBDMO CC(C)(O)[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000305738835 466444156 /nfs/dbraw/zinc/44/41/56/466444156.db2.gz MUGLGRLDDNERQC-ZDUSSCGKSA-N 1 1 341.795 2.422 20 5 EEBDMO COc1c(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)cccc1[N+](=O)[O-] ZINC000332229940 466457887 /nfs/dbraw/zinc/45/78/87/466457887.db2.gz PSSYHEOBRIUVQJ-GXTWGEPZSA-N 1 1 333.388 2.160 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccc(CO)cc3)C2)nc1 ZINC000305851059 466481811 /nfs/dbraw/zinc/48/18/11/466481811.db2.gz UWVKFMNIDLBGGN-OAHLLOKOSA-N 1 1 328.372 2.169 20 5 EEBDMO COc1cc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cc([N+](=O)[O-])c1C ZINC000332301626 466497995 /nfs/dbraw/zinc/49/79/95/466497995.db2.gz KTOJTYRZHFAXLJ-KBPBESRZSA-N 1 1 333.388 2.268 20 5 EEBDMO CN(c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000367737563 466525372 /nfs/dbraw/zinc/52/53/72/466525372.db2.gz NBDDRRLWRGEKKY-QYJAPNMZSA-N 1 1 343.387 2.305 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C(=O)N2CCCC2)C1 ZINC000367858463 466547267 /nfs/dbraw/zinc/54/72/67/466547267.db2.gz SBIJYGJTACRDAC-AWEZNQCLSA-N 1 1 333.388 2.048 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000354463870 466587474 /nfs/dbraw/zinc/58/74/74/466587474.db2.gz PYVQJQVFIBLTIA-JTQLQIEISA-N 1 1 349.840 2.257 20 5 EEBDMO C[C@@H](C[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](C)CO)c1ccccc1 ZINC000347363036 466591589 /nfs/dbraw/zinc/59/15/89/466591589.db2.gz JKDOWXXIDMRHOG-GJZGRUSLSA-N 1 1 332.404 2.278 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000363938020 466662109 /nfs/dbraw/zinc/66/21/09/466662109.db2.gz NCHGCHPTDKWVNS-OLZOCXBDSA-N 1 1 348.359 2.168 20 5 EEBDMO C[C@H](c1cnn(C)c1)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411505134 466836592 /nfs/dbraw/zinc/83/65/92/466836592.db2.gz WTSQMNQCEOOSMN-GFCCVEGCSA-N 1 1 331.376 2.350 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@H](O)C[C@@H]3CO)s2)cc1 ZINC000370398398 466862041 /nfs/dbraw/zinc/86/20/41/466862041.db2.gz HRQMVTBBWPXIQV-ZIAGYGMSSA-N 1 1 334.397 2.251 20 5 EEBDMO O=C(CC[N@@H+]1CC[C@H](O)C12CCCC2)Nc1ccc([N+](=O)[O-])cc1 ZINC000411757468 466894658 /nfs/dbraw/zinc/89/46/58/466894658.db2.gz MKKKUBJXYHCKRF-HNNXBMFYSA-N 1 1 333.388 2.303 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@](O)(C3CC3)C2)cccc1[N+](=O)[O-] ZINC000370658271 466957002 /nfs/dbraw/zinc/95/70/02/466957002.db2.gz UIYFLYCBJNUIIF-KRWDZBQOSA-N 1 1 333.388 2.079 20 5 EEBDMO O=C1CCc2cc([N+](=O)[O-])c(N3CCC[N@H+]4CCC[C@@H]4C3)cc2N1 ZINC000377318954 467053222 /nfs/dbraw/zinc/05/32/22/467053222.db2.gz BKYFBXARNWVVJM-CYBMUJFWSA-N 1 1 330.388 2.154 20 5 EEBDMO C[N@H+]1CCO[C@@H]2CCN(c3ccc([N+](=O)[O-])c4ncccc43)C[C@@H]21 ZINC000413286964 467208009 /nfs/dbraw/zinc/20/80/09/467208009.db2.gz FBQMJQGUXWEMHS-JKSUJKDBSA-N 1 1 328.372 2.052 20 5 EEBDMO C[C@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000432180895 467222614 /nfs/dbraw/zinc/22/26/14/467222614.db2.gz XWTMDWLOQXRVIB-ZDUSSCGKSA-N 1 1 344.415 2.424 20 5 EEBDMO CC[N@@H+]1CCO[C@@H](C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000452851714 467431415 /nfs/dbraw/zinc/43/14/15/467431415.db2.gz MYKDCOALCAESJF-DOTOQJQBSA-N 1 1 347.415 2.022 20 5 EEBDMO CC[N@H+]1CCO[C@@H](C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000452851714 467431417 /nfs/dbraw/zinc/43/14/17/467431417.db2.gz MYKDCOALCAESJF-DOTOQJQBSA-N 1 1 347.415 2.022 20 5 EEBDMO C[C@@H](CCO)CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000449360577 467633368 /nfs/dbraw/zinc/63/33/68/467633368.db2.gz VANYKJUXVFMGAP-CZUORRHYSA-N 1 1 332.404 2.416 20 5 EEBDMO Cc1ncc2c(n1)CC[N@@H+](Cc1cc([N+](=O)[O-])cc3c1OCOC3)C2 ZINC000515124038 467974334 /nfs/dbraw/zinc/97/43/34/467974334.db2.gz YCMXQRVHDYXMMP-UHFFFAOYSA-N 1 1 342.355 2.118 20 5 EEBDMO Cc1ncc2c(n1)CC[N@H+](Cc1cc([N+](=O)[O-])cc3c1OCOC3)C2 ZINC000515124038 467974336 /nfs/dbraw/zinc/97/43/36/467974336.db2.gz YCMXQRVHDYXMMP-UHFFFAOYSA-N 1 1 342.355 2.118 20 5 EEBDMO COc1ccc(CC(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000532057187 468093795 /nfs/dbraw/zinc/09/37/95/468093795.db2.gz HOHWRLBIPWXTJY-HNNXBMFYSA-N 1 1 349.431 2.240 20 5 EEBDMO Cn1ccnc1[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000533861531 468226619 /nfs/dbraw/zinc/22/66/19/468226619.db2.gz VCHDDWJDTCFEPQ-GFCCVEGCSA-N 1 1 344.371 2.184 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@H](CNC(=O)/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000490790312 468251582 /nfs/dbraw/zinc/25/15/82/468251582.db2.gz OIFLNQQYHHKGKR-XITLMJRVSA-N 1 1 347.415 2.081 20 5 EEBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000594195319 468508631 /nfs/dbraw/zinc/50/86/31/468508631.db2.gz FNZGYIOGDOVTAV-OLZOCXBDSA-N 1 1 347.371 2.070 20 5 EEBDMO CC(C)[N@H+]1CCCC[C@H]1CN1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000556193033 468514356 /nfs/dbraw/zinc/51/43/56/468514356.db2.gz NJPAFQPTQXUYQE-KRWDZBQOSA-N 1 1 347.463 2.375 20 5 EEBDMO Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1c(F)cccc1[N+](=O)[O-])C2 ZINC000601185471 468775364 /nfs/dbraw/zinc/77/53/64/468775364.db2.gz RYLMOQGQBGBXJS-NSHDSACASA-N 1 1 334.351 2.201 20 5 EEBDMO CCCCCNC(=O)C1CC[NH+](Cc2onc(C)c2[N+](=O)[O-])CC1 ZINC000595293833 468802478 /nfs/dbraw/zinc/80/24/78/468802478.db2.gz BGDZFMKKRZTFFA-UHFFFAOYSA-N 1 1 338.408 2.410 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@H+](CCN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1 ZINC000595370921 468828798 /nfs/dbraw/zinc/82/87/98/468828798.db2.gz LYVOFKNYPCWNOZ-OWCLPIDISA-N 1 1 347.463 2.454 20 5 EEBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595444734 468855580 /nfs/dbraw/zinc/85/55/80/468855580.db2.gz CWEKIMQEOQYXKR-SNVBAGLBSA-N 1 1 349.284 2.234 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000593187948 468898601 /nfs/dbraw/zinc/89/86/01/468898601.db2.gz WKIQPOPTRRMZFG-MCIONIFRSA-N 1 1 335.404 2.303 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000595576242 468908579 /nfs/dbraw/zinc/90/85/79/468908579.db2.gz XHRAIYHCFVBSDV-CQSZACIVSA-N 1 1 334.420 2.309 20 5 EEBDMO COC(=O)c1ccnc(NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000598589787 468925157 /nfs/dbraw/zinc/92/51/57/468925157.db2.gz JNIWZUKAJSJIQH-NWDGAFQWSA-N 1 1 336.392 2.451 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@@H+]2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000610604938 469015797 /nfs/dbraw/zinc/01/57/97/469015797.db2.gz RGMIJSDCTMTFSK-DTORHVGOSA-N 1 1 346.231 2.464 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@H+]2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000610604938 469015803 /nfs/dbraw/zinc/01/58/03/469015803.db2.gz RGMIJSDCTMTFSK-DTORHVGOSA-N 1 1 346.231 2.464 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC000602803907 469085732 /nfs/dbraw/zinc/08/57/32/469085732.db2.gz GZDDLTJCOZDLNS-HNNXBMFYSA-N 1 1 334.351 2.392 20 5 EEBDMO COc1ccc2c(c1)CC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])CC2 ZINC000602801577 469086398 /nfs/dbraw/zinc/08/63/98/469086398.db2.gz WLCRNJNJGBGCQH-UHFFFAOYSA-N 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C[C@@H]1CN(CC[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C[C@H](C)O1 ZINC000801551249 1235821918 /nfs/dbraw/zinc/82/19/18/1235821918.db2.gz LVGMOTWIJYPPKE-BETUJISGSA-N 1 1 325.384 2.275 20 5 EEBDMO C[C@@H]1C[N@@H+](CCN(C)Cc2ccc([N+](=O)[O-])c(F)c2)C[C@H](C)O1 ZINC000801551249 1235821928 /nfs/dbraw/zinc/82/19/28/1235821928.db2.gz LVGMOTWIJYPPKE-BETUJISGSA-N 1 1 325.384 2.275 20 5 EEBDMO C[C@@H]1C[N@H+](CCN(C)Cc2ccc([N+](=O)[O-])c(F)c2)C[C@H](C)O1 ZINC000801551249 1235821934 /nfs/dbraw/zinc/82/19/34/1235821934.db2.gz LVGMOTWIJYPPKE-BETUJISGSA-N 1 1 325.384 2.275 20 5 EEBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001048525168 1237860292 /nfs/dbraw/zinc/86/02/92/1237860292.db2.gz NXJOHCJZHIEUHO-ZHCJQAHYSA-N 1 1 335.448 2.201 20 5 EEBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525168 1237860304 /nfs/dbraw/zinc/86/03/04/1237860304.db2.gz NXJOHCJZHIEUHO-ZHCJQAHYSA-N 1 1 335.448 2.201 20 5 EEBDMO 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ZINC001072391565 1255121802 /nfs/dbraw/zinc/12/18/02/1255121802.db2.gz ONQTZOOMMYFRLW-UHFFFAOYSA-N 1 1 339.342 2.284 20 5 EEBDMO Cn1nccc1[C@H](O)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000856799308 1293637474 /nfs/dbraw/zinc/63/74/74/1293637474.db2.gz PRSLBGLINRXRIC-QGZVFWFLSA-N 1 1 348.378 2.413 20 5 EEBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000794640023 1296481712 /nfs/dbraw/zinc/48/17/12/1296481712.db2.gz NZSSLIUBSANLPA-ZDUSSCGKSA-N 1 1 347.371 2.351 20 5 EEBDMO CO[C@@]1(C)CCC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000794650103 1296508674 /nfs/dbraw/zinc/50/86/74/1296508674.db2.gz NXINCUCPKOVKKQ-INIZCTEOSA-N 1 1 331.376 2.312 20 5 EEBDMO CO[C@@]1(C)CCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000794650103 1296508683 /nfs/dbraw/zinc/50/86/83/1296508683.db2.gz NXINCUCPKOVKKQ-INIZCTEOSA-N 1 1 331.376 2.312 20 5 EEBDMO O=C(NCC1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1)C(F)F ZINC001222217338 1299422132 /nfs/dbraw/zinc/42/21/32/1299422132.db2.gz RYOCQNKGSDPXHJ-UHFFFAOYSA-N 1 1 333.360 2.250 20 5 EEBDMO Cc1ccc(NCCN(C)C(=O)C[N@@H+](C)C2CCC2)c([N+](=O)[O-])c1 ZINC001102017415 1300147334 /nfs/dbraw/zinc/14/73/34/1300147334.db2.gz XPRYPYHPCQWFNC-UHFFFAOYSA-N 1 1 334.420 2.258 20 5 EEBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cc(C)ccc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001225683285 1301122066 /nfs/dbraw/zinc/12/20/66/1301122066.db2.gz QVHZZDGOBARROW-YOKBYHGQSA-N 1 1 334.372 2.449 20 5 EEBDMO O=c1cc(O[C@H]2CCc3[nH+]ccn3C2)c2cc([N+](=O)[O-])ccc2[nH]1 ZINC001227221592 1301737234 /nfs/dbraw/zinc/73/72/34/1301737234.db2.gz RALSHADMJVRSST-NSHDSACASA-N 1 1 326.312 2.439 20 5 EEBDMO C[N@H+]1[C@@H]2C[C@H](Oc3ccc4cccc([N+](=O)[O-])c4n3)[C@H]1CC(=O)C2 ZINC001233835677 1304609511 /nfs/dbraw/zinc/60/95/11/1304609511.db2.gz CAQIRHCWYUCTLO-GLQYFDAESA-N 1 1 327.340 2.326 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCc4ncncc4C3)CC2)cc1 ZINC001254478438 1318083594 /nfs/dbraw/zinc/08/35/94/1318083594.db2.gz CMBTWAYIJGDZQL-UHFFFAOYSA-N 1 1 339.399 2.412 20 5 EEBDMO O=C(C1CCC1)N1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254599930 1318140366 /nfs/dbraw/zinc/14/03/66/1318140366.db2.gz MYVZXIHHUFECHZ-GOSISDBHSA-N 1 1 343.427 2.396 20 5 EEBDMO CCOC(=O)c1cc([N+](=O)[O-])cnc1N1CC[C@@H]([N@@H+](C)C(C)C)C1 ZINC001157020525 1318350230 /nfs/dbraw/zinc/35/02/30/1318350230.db2.gz JEJREJRBIWKSPN-GFCCVEGCSA-N 1 1 336.392 2.085 20 5 EEBDMO N=C(NCCCC[NH3+])Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC001157101273 1318403743 /nfs/dbraw/zinc/40/37/43/1318403743.db2.gz CYGMRXBHZQEDIG-UHFFFAOYSA-N 1 1 328.376 2.332 20 5 EEBDMO COC[C@H]1CC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256103243 1318649138 /nfs/dbraw/zinc/64/91/38/1318649138.db2.gz KAJKXTUEIUQLEZ-OAHLLOKOSA-N 1 1 335.404 2.293 20 5 EEBDMO O=C(NCCC[NH2+]Cc1cccc(Cl)c1Cl)[C@@H]1CC1[N+](=O)[O-] ZINC001157767660 1318848006 /nfs/dbraw/zinc/84/80/06/1318848006.db2.gz RFLQRXJMONRMAH-ZYHUDNBSSA-N 1 1 346.214 2.255 20 5 EEBDMO Cc1ccnc(N2CC[NH+](Cc3cccc(N)c3)CC2)c1[N+](=O)[O-] ZINC001158478201 1319260503 /nfs/dbraw/zinc/26/05/03/1319260503.db2.gz BJJFTISAHBLECK-UHFFFAOYSA-N 1 1 327.388 2.203 20 5 EEBDMO Cc1nc2c(o1)CCN(c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C2 ZINC001158829228 1319457101 /nfs/dbraw/zinc/45/71/01/1319457101.db2.gz PHRSTNIXQJVBOQ-GQCTYLIASA-N 1 1 329.360 2.381 20 5 EEBDMO CCOCC(=O)NCCC1=CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001159144120 1319638465 /nfs/dbraw/zinc/63/84/65/1319638465.db2.gz VPDQOLCGWYOAFZ-UHFFFAOYSA-N 1 1 347.415 2.270 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+](C(C)C)C[C@H]2C)n1 ZINC001163371147 1321107926 /nfs/dbraw/zinc/10/79/26/1321107926.db2.gz NNFXZJQFXGLDAC-VXGBXAGGSA-N 1 1 336.392 2.307 20 5 EEBDMO [NH3+][C@H]1CN(c2ccc(-c3ccc([N+](=O)[O-])cc3)nn2)CCC1(F)F ZINC001164327485 1321352187 /nfs/dbraw/zinc/35/21/87/1321352187.db2.gz ONFITOOIPIMCIY-ZDUSSCGKSA-N 1 1 335.314 2.225 20 5 EEBDMO CNC(=O)c1ccc(N2CC[N@@H+](C3CCCC3)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001262706233 1322354611 /nfs/dbraw/zinc/35/46/11/1322354611.db2.gz HKCRBSWPAHCZJB-CYBMUJFWSA-N 1 1 346.431 2.408 20 5 EEBDMO Cn1c[nH+]cc1C1CCN(c2cc(F)c([N+](=O)[O-])cc2CO)CC1 ZINC001262727500 1322361722 /nfs/dbraw/zinc/36/17/22/1322361722.db2.gz PAACJXLNTFFORW-UHFFFAOYSA-N 1 1 334.351 2.344 20 5 EEBDMO C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccnn1C ZINC001308017892 1331557954 /nfs/dbraw/zinc/55/79/54/1331557954.db2.gz XSMRJGYFJUFZIK-SECBINFHSA-N 1 1 337.767 2.271 20 5 EEBDMO CCC[N@@H+](CC)CCNS(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1F ZINC001309258393 1331624523 /nfs/dbraw/zinc/62/45/23/1331624523.db2.gz RHFKGCTURASHHH-UHFFFAOYSA-N 1 1 347.412 2.053 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001318899674 1332620954 /nfs/dbraw/zinc/62/09/54/1332620954.db2.gz ILRGZULNAZZDJO-UHFFFAOYSA-N 1 1 329.360 2.215 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@@H+](CC(C)C)C1 ZINC001319072129 1332645462 /nfs/dbraw/zinc/64/54/62/1332645462.db2.gz QDIPDPJKPAXHEO-ZDUSSCGKSA-N 1 1 334.420 2.344 20 5 EEBDMO CC(C)(C)[N@H+]1CCCN(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CC1 ZINC001609075923 1351832118 /nfs/dbraw/zinc/83/21/18/1351832118.db2.gz QQXFHRXIUJOUOW-UHFFFAOYSA-N 1 1 345.407 2.086 20 5 EEBDMO CC1(C)CCC[N@@H+](CCNc2ccc(-c3nn[nH]n3)c([N+](=O)[O-])c2)C1 ZINC001609145119 1351861115 /nfs/dbraw/zinc/86/11/15/1351861115.db2.gz AZBOUJAOEDVTEX-UHFFFAOYSA-N 1 1 345.407 2.309 20 5 EEBDMO CC(C)(CC(N)=O)[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001332870961 1335921996 /nfs/dbraw/zinc/92/19/96/1335921996.db2.gz HZYISLPIQWGSLR-UHFFFAOYSA-N 1 1 330.182 2.101 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H]3OCCC[C@H]3C1)OCCO2 ZINC001337033246 1336634265 /nfs/dbraw/zinc/63/42/65/1336634265.db2.gz SBUGOVHYAGCTGI-SWLSCSKDSA-N 1 1 334.372 2.367 20 5 EEBDMO CCN(CCNC(=O)CC[N@@H+](C)CC)c1cc(C)ccc1[N+](=O)[O-] ZINC001100606977 1338541755 /nfs/dbraw/zinc/54/17/55/1338541755.db2.gz FQUYYWGXMVTJQL-UHFFFAOYSA-N 1 1 336.436 2.188 20 5 EEBDMO C[C@H]([NH2+]Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])c1ccccn1 ZINC001575380205 1343784077 /nfs/dbraw/zinc/78/40/77/1343784077.db2.gz SKNMRJSXLPWADU-JTQLQIEISA-N 1 1 325.332 2.021 20 5 EEBDMO CC(C)(C)[NH+]1CCC(NC(=O)[C@](C)(N)c2cccc([N+](=O)[O-])c2)CC1 ZINC001576080056 1343963370 /nfs/dbraw/zinc/96/33/70/1343963370.db2.gz BHOHPJXRVDNSRV-GOSISDBHSA-N 1 1 348.447 2.148 20 5 EEBDMO Cn1nc(C2CC2)cc1NC(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC001579992572 1344445374 /nfs/dbraw/zinc/44/53/74/1344445374.db2.gz KUVIFTMMHHZZTC-MRXNPFEDSA-N 1 1 329.360 2.018 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](CNc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])C1 ZINC001603077858 1350634438 /nfs/dbraw/zinc/63/44/38/1350634438.db2.gz LDDYSWOWTDEPSZ-LLVKDONJSA-N 1 1 345.407 2.307 20 5 EEBDMO C[C@H](CNc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC001603895464 1350797078 /nfs/dbraw/zinc/79/70/78/1350797078.db2.gz LJGLFLDLPRASQV-VXGBXAGGSA-N 1 1 345.407 2.450 20 5 EEBDMO Cc1ccc([C@H](C)[NH2+]Cc2cc(-c3nn[nH]n3)ccn2)cc1[N+](=O)[O-] ZINC001605828246 1351230163 /nfs/dbraw/zinc/23/01/63/1351230163.db2.gz PLAVFYIWHAPOTR-NSHDSACASA-N 1 1 339.359 2.329 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@@H+](C[C@H]2CCOC2)C2CC2)nc1-c1ccccn1 ZINC000853489082 1369339174 /nfs/dbraw/zinc/33/91/74/1369339174.db2.gz FDRZFPVTLATOOY-CYBMUJFWSA-N 1 1 343.387 2.312 20 5 EEBDMO CC(C)(C(=O)O[C@H]1C[C@@H]([NH+]2CCOCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000838907036 1372874018 /nfs/dbraw/zinc/87/40/18/1372874018.db2.gz DIVLJAURWOTRJS-IYBDPMFKSA-N 1 1 348.399 2.279 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1oc(C)nc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001753080536 1406670887 /nfs/dbraw/zinc/67/08/87/1406670887.db2.gz ZGPOUORVPHFZJT-UHFFFAOYSA-N 1 1 346.387 2.452 20 5 EEBDMO CN(CC(C)(C)C[NH2+]C/C(Cl)=C/Cl)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001755280275 1407290132 /nfs/dbraw/zinc/29/01/32/1407290132.db2.gz DUKGAVLJGLCCIN-XFDQCWFDSA-N 1 1 338.235 2.045 20 5 EEBDMO CCOc1cccc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)n1 ZINC001578194625 1403723305 /nfs/dbraw/zinc/72/33/05/1403723305.db2.gz UHXRVRMGSQRYMA-INIZCTEOSA-N 1 1 330.344 2.201 20 5 EEBDMO COCC[N@@H+](Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])C1CCCC1 ZINC001591424401 1403910673 /nfs/dbraw/zinc/91/06/73/1403910673.db2.gz BFQUQZXLEGUCOI-UHFFFAOYSA-N 1 1 346.391 2.166 20 5 EEBDMO CCn1ccnc1C(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001751988996 1406167860 /nfs/dbraw/zinc/16/78/60/1406167860.db2.gz VLWALYJKEPFQDS-UHFFFAOYSA-N 1 1 345.403 2.063 20 5 EEBDMO O=[N+]([O-])c1c(Cl)ccnc1N1CC[NH+](CCc2ccccn2)CC1 ZINC001165054096 722008866 /nfs/dbraw/zinc/00/88/66/722008866.db2.gz IPDZYVGICJUGHZ-UHFFFAOYSA-N 1 1 347.806 2.403 20 5 EEBDMO Cc1cc(C(=O)NCC2C[NH+](Cc3cccc([N+](=O)[O-])c3)C2)co1 ZINC001031632828 770489524 /nfs/dbraw/zinc/48/95/24/770489524.db2.gz HTZVENVELVKRIY-UHFFFAOYSA-N 1 1 329.356 2.358 20 5 EEBDMO C[N@@H+](CC(=O)NC[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2)C1)C1CCC1 ZINC001091411287 790633042 /nfs/dbraw/zinc/63/30/42/790633042.db2.gz ZRLWFZXNFAMPHR-OTVXOJSOSA-N 1 1 346.431 2.386 20 5 EEBDMO CSCC(=O)N1CCC2(C[NH+](Cc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001035643522 784905894 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CN(CCC[N@@H+](C)Cc1ccco1)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000286323233 464880476 /nfs/dbraw/zinc/88/04/76/464880476.db2.gz AEPYVPKSDKCZQO-UHFFFAOYSA-N 1 1 346.387 2.364 20 5 EEBDMO CCC[N@@H+](CC)CCNC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000266950722 464882636 /nfs/dbraw/zinc/88/26/36/464882636.db2.gz ZRSWWSQSJMZHCO-UHFFFAOYSA-N 1 1 339.392 2.074 20 5 EEBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CC[C@@H](C[NH+]2CCOCC2)C1 ZINC000276535768 464970597 /nfs/dbraw/zinc/97/05/97/464970597.db2.gz CNIYRTNAYFYFLZ-AWEZNQCLSA-N 1 1 342.399 2.302 20 5 EEBDMO COC(=O)[C@]1(C)C[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000337465184 465385109 /nfs/dbraw/zinc/38/51/09/465385109.db2.gz SXRIQZXHEXKPDV-NVGCLXPQSA-N 1 1 349.387 2.053 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C[N@H+]1C1CC1 ZINC000342935574 465399359 /nfs/dbraw/zinc/39/93/59/465399359.db2.gz SMINHBIDGNBJON-WDEREUQCSA-N 1 1 328.372 2.431 20 5 EEBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCC[N@@H+](C)CC1 ZINC000298656951 465462331 /nfs/dbraw/zinc/46/23/31/465462331.db2.gz GXHYJFLQDWZSNY-NSHDSACASA-N 1 1 340.811 2.213 20 5 EEBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000298861644 465526915 /nfs/dbraw/zinc/52/69/15/465526915.db2.gz CYYKURKFUIAXNA-LBPRGKRZSA-N 1 1 328.372 2.100 20 5 EEBDMO COc1ccc(CNC(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000298912370 465540357 /nfs/dbraw/zinc/54/03/57/465540357.db2.gz DSQMMNSQQJRKEB-KBPBESRZSA-N 1 1 348.403 2.029 20 5 EEBDMO C[C@H]1CC[N@H+](C)CCN1c1ncc([N+](=O)[O-])cc1Br ZINC000362250978 465606826 /nfs/dbraw/zinc/60/68/26/465606826.db2.gz SOBIDZNXNGTWFX-VIFPVBQESA-N 1 1 329.198 2.283 20 5 EEBDMO C[C@H]1CC[N@@H+](C)CCN1c1ncc([N+](=O)[O-])cc1Br ZINC000362250978 465606833 /nfs/dbraw/zinc/60/68/33/465606833.db2.gz SOBIDZNXNGTWFX-VIFPVBQESA-N 1 1 329.198 2.283 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 ZINC000554859253 468446759 /nfs/dbraw/zinc/44/67/59/468446759.db2.gz KFOLWBPYAANUHT-OLZOCXBDSA-N 1 1 335.408 2.045 20 5 EEBDMO Cc1n[nH]c(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000299549217 465796391 /nfs/dbraw/zinc/79/63/91/465796391.db2.gz QOCKBTHNYIVSGB-CQSZACIVSA-N 1 1 343.387 2.021 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(Cc2noc([C@H]3C[N@@H+](C)C[C@@H]3C)n2)c1 ZINC000361252294 465863751 /nfs/dbraw/zinc/86/37/51/465863751.db2.gz OPMUUHKGVBGSSY-GWCFXTLKSA-N 1 1 332.360 2.242 20 5 EEBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000331288749 466015302 /nfs/dbraw/zinc/01/53/02/466015302.db2.gz NLXYRMCKUPUGLZ-IOASZLSFSA-N 1 1 335.404 2.039 20 5 EEBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000346279193 466055606 /nfs/dbraw/zinc/05/56/06/466055606.db2.gz VENKWGRQLWVALA-DZKIICNBSA-N 1 1 347.415 2.162 20 5 EEBDMO Cc1ccc(C(=O)N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000371989058 466105463 /nfs/dbraw/zinc/10/54/63/466105463.db2.gz XXMBVBORJBHORQ-HOTGVXAUSA-N 1 1 347.415 2.276 20 5 EEBDMO O=C([C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1)N1CCCC1 ZINC000331696110 466202488 /nfs/dbraw/zinc/20/24/88/466202488.db2.gz VLWYAAMUOGCUHU-MRXNPFEDSA-N 1 1 331.416 2.472 20 5 EEBDMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@@H+](C)Cc1ccccc1 ZINC000346857874 466203826 /nfs/dbraw/zinc/20/38/26/466203826.db2.gz XCNOJYIOYZPGIW-CYBMUJFWSA-N 1 1 330.388 2.184 20 5 EEBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@](O)(C(=O)N2CCCC2)C1 ZINC000331709524 466210224 /nfs/dbraw/zinc/21/02/24/466210224.db2.gz FCHWZSCSONILAA-KDOFPFPSSA-N 1 1 347.415 2.105 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000363179321 466265850 /nfs/dbraw/zinc/26/58/50/466265850.db2.gz JBBQMXSRVSZLET-KGLIPLIRSA-N 1 1 348.403 2.029 20 5 EEBDMO C[C@H](O)[C@@H]1CCCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000304241683 466265934 /nfs/dbraw/zinc/26/59/34/466265934.db2.gz SKTBMLIWQSDQQS-JSGCOSHPSA-N 1 1 349.387 2.128 20 5 EEBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000372297573 466286122 /nfs/dbraw/zinc/28/61/22/466286122.db2.gz IWLYPKGIRBQNOH-INIZCTEOSA-N 1 1 340.383 2.310 20 5 EEBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000372297573 466286128 /nfs/dbraw/zinc/28/61/28/466286128.db2.gz IWLYPKGIRBQNOH-INIZCTEOSA-N 1 1 340.383 2.310 20 5 EEBDMO C[C@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000331978968 466331553 /nfs/dbraw/zinc/33/15/53/466331553.db2.gz DZQPSPZHLOWXMU-GJZGRUSLSA-N 1 1 346.431 2.482 20 5 EEBDMO Cc1cc(N2C[C@H]3OCC[N@H+](C)[C@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000338723703 466335923 /nfs/dbraw/zinc/33/59/23/466335923.db2.gz GXTXINPNQDNQKY-UONOGXRCSA-N 1 1 345.321 2.441 20 5 EEBDMO C[C@@H](NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)C1=CC[N@@H+](C)CC1 ZINC000358115474 466469489 /nfs/dbraw/zinc/46/94/89/466469489.db2.gz DEPZTQWPFSFJPW-LLVKDONJSA-N 1 1 328.372 2.456 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H]1CCCC[C@@H]1O ZINC000305811851 466472679 /nfs/dbraw/zinc/47/26/79/466472679.db2.gz MOKOFVMLPKBKOK-WWGRRREGSA-N 1 1 335.404 2.405 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000332356049 466524433 /nfs/dbraw/zinc/52/44/33/466524433.db2.gz ZMTMEKAXXAHROH-DZGCQCFKSA-N 1 1 346.431 2.408 20 5 EEBDMO CCC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CC(=O)N(C)C1=O ZINC000338963860 466528128 /nfs/dbraw/zinc/52/81/28/466528128.db2.gz RAHGYANXMZQWSS-PMGBHYCQSA-N 1 1 331.372 2.077 20 5 EEBDMO CCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CC(=O)N(C)C1=O ZINC000338963860 466528137 /nfs/dbraw/zinc/52/81/37/466528137.db2.gz RAHGYANXMZQWSS-PMGBHYCQSA-N 1 1 331.372 2.077 20 5 EEBDMO C[C@H]1COCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000372925128 466639275 /nfs/dbraw/zinc/63/92/75/466639275.db2.gz JNUABBPHJOAKMG-LLVKDONJSA-N 1 1 325.340 2.031 20 5 EEBDMO Cc1c(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000363935978 466660522 /nfs/dbraw/zinc/66/05/22/466660522.db2.gz CXXZXYYDHZILSG-NWDGAFQWSA-N 1 1 348.359 2.168 20 5 EEBDMO C[C@H](NC[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000423382273 466733497 /nfs/dbraw/zinc/73/34/97/466733497.db2.gz IJUYLDMCDYQUCH-SMDDNHRTSA-N 1 1 346.353 2.082 20 5 EEBDMO CCOC(=O)c1cc(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)ccc1[N+](=O)[O-] ZINC000373676367 466885312 /nfs/dbraw/zinc/88/53/12/466885312.db2.gz WEMRIIRJPKHNKS-KGLIPLIRSA-N 1 1 349.387 2.047 20 5 EEBDMO Cc1noc([C@H]2CCC[N@@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000411733067 466889083 /nfs/dbraw/zinc/88/90/83/466889083.db2.gz VEHBXOGHSZWZKF-CQSZACIVSA-N 1 1 345.359 2.452 20 5 EEBDMO Cc1noc([C@H]2CCC[N@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000411733067 466889085 /nfs/dbraw/zinc/88/90/85/466889085.db2.gz VEHBXOGHSZWZKF-CQSZACIVSA-N 1 1 345.359 2.452 20 5 EEBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000411965969 466950482 /nfs/dbraw/zinc/95/04/82/466950482.db2.gz KTKQEMCJGAQZHI-IBGZPJMESA-N 1 1 339.395 2.266 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000412080053 466999405 /nfs/dbraw/zinc/99/94/05/466999405.db2.gz VOGAVENMHWGOGV-QGZVFWFLSA-N 1 1 349.387 2.117 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000412080053 466999408 /nfs/dbraw/zinc/99/94/08/466999408.db2.gz VOGAVENMHWGOGV-QGZVFWFLSA-N 1 1 349.387 2.117 20 5 EEBDMO CCOC(=O)c1cc(N2CC[C@@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000366130526 467066771 /nfs/dbraw/zinc/06/67/71/467066771.db2.gz RHLHCGCVXOVUDP-QGZVFWFLSA-N 1 1 333.388 2.304 20 5 EEBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)NCCc1ccccc1[N+](=O)[O-])C2 ZINC000377891659 467160773 /nfs/dbraw/zinc/16/07/73/467160773.db2.gz DTEKAWJOWFHIBH-AWEZNQCLSA-N 1 1 328.372 2.021 20 5 EEBDMO CC(C)C[C@H](CN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[NH+]1CCOCC1 ZINC000427989066 467191610 /nfs/dbraw/zinc/19/16/10/467191610.db2.gz FLVQEEQUVNSRSH-CQSZACIVSA-N 1 1 347.419 2.052 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C(N)=O)[C@H](C)c1ccccc1 ZINC000428843331 467274285 /nfs/dbraw/zinc/27/42/85/467274285.db2.gz SUKLUCIRHFETEG-PXAZEXFGSA-N 1 1 343.383 2.351 20 5 EEBDMO CC(C)c1ccc(C(=O)NC[C@H]2CCC[N@H+]2CCCO)cc1[N+](=O)[O-] ZINC000452368210 467360295 /nfs/dbraw/zinc/36/02/95/467360295.db2.gz QMGWYXZUNYZHKC-OAHLLOKOSA-N 1 1 349.431 2.295 20 5 EEBDMO Cc1c(CC(=O)N(C)C(C)(C)C[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000414043622 467367474 /nfs/dbraw/zinc/36/74/74/467367474.db2.gz QUNRKVHOCSNJPT-UHFFFAOYSA-N 1 1 349.431 2.015 20 5 EEBDMO CCCC[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000448962219 467608589 /nfs/dbraw/zinc/60/85/89/467608589.db2.gz PWHKYENDTIOXDZ-UHFFFAOYSA-N 1 1 345.403 2.242 20 5 EEBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)/C=C\c3ccc(F)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000493100794 467841395 /nfs/dbraw/zinc/84/13/95/467841395.db2.gz WPCYHGUALZUFFV-VWEWAFOGSA-N 1 1 333.363 2.300 20 5 EEBDMO CC(C)C[N@H+](Cc1cnn(C)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000459594766 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335.404 2.342 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](CNC(C)=O)C1 ZINC000175134484 207097513 /nfs/dbraw/zinc/09/75/13/207097513.db2.gz JHKXXSWZVMNJRU-CQSZACIVSA-N 1 1 335.404 2.342 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CN(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000175390288 207121619 /nfs/dbraw/zinc/12/16/19/207121619.db2.gz ZOWFGZAKHKJMTD-CQSZACIVSA-N 1 1 341.433 2.008 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000177315443 207320852 /nfs/dbraw/zinc/32/08/52/207320852.db2.gz LZQQUMOWGLAUEI-WBVHZDCISA-N 1 1 346.431 2.116 20 5 EEBDMO O=[N+]([O-])c1c2cccnc2ccc1N1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000371371784 285079796 /nfs/dbraw/zinc/07/97/96/285079796.db2.gz UIVDCYQBRYYKBE-CYBMUJFWSA-N 1 1 328.372 2.054 20 5 EEBDMO CN(c1ncc([N+](=O)[O-])cc1Br)[C@H]1CCC[N@H+](C)C1 ZINC000267204455 256037053 /nfs/dbraw/zinc/03/70/53/256037053.db2.gz GFZOICYEDLVPOW-VIFPVBQESA-N 1 1 329.198 2.283 20 5 EEBDMO CN(c1ncc([N+](=O)[O-])cc1Br)[C@H]1CCC[N@@H+](C)C1 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CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)c1 ZINC000282882612 269520357 /nfs/dbraw/zinc/52/03/57/269520357.db2.gz RHIMRILIVIKAIR-IUODEOHRSA-N 1 1 335.404 2.452 20 5 EEBDMO CC(C)OCC[NH+]1CCN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000286341038 274862072 /nfs/dbraw/zinc/86/20/72/274862072.db2.gz IPXOTDLFOKNNBC-UHFFFAOYSA-N 1 1 343.374 2.416 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCCc3occc3C2)c1 ZINC000288750135 275083733 /nfs/dbraw/zinc/08/37/33/275083733.db2.gz HYVSUMXVTCPETK-HNNXBMFYSA-N 1 1 332.356 2.376 20 5 EEBDMO CCC[C@]1(CO)CC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000288915542 275091187 /nfs/dbraw/zinc/09/11/87/275091187.db2.gz UPVWSTGSZOBKCK-DYVFJYSZSA-N 1 1 335.404 2.406 20 5 EEBDMO CCC[C@]1(CO)CC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000288915542 275091188 /nfs/dbraw/zinc/09/11/88/275091188.db2.gz UPVWSTGSZOBKCK-DYVFJYSZSA-N 1 1 335.404 2.406 20 5 EEBDMO Cc1cnn([C@H]2CC[N@@H+]([C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)C2)c1 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C[C@@H](c1ccccn1)[N@H+]1CCC[C@@H](Oc2cc[n+]([O-])cc2[N+](=O)[O-])C1 ZINC001229453926 1302789393 /nfs/dbraw/zinc/78/93/93/1302789393.db2.gz BXKWPHQVGDCJPV-UONOGXRCSA-N 1 1 344.371 2.228 20 5 EEBDMO CO[C@@H]1CC[N@@H+](CCOc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC001233751624 1304577521 /nfs/dbraw/zinc/57/75/21/1304577521.db2.gz WHTFAWCQWBGOEV-SECBINFHSA-N 1 1 335.282 2.108 20 5 EEBDMO CCc1cc(C(=O)NCCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)[nH]n1 ZINC001234205099 1304796926 /nfs/dbraw/zinc/79/69/26/1304796926.db2.gz LLKYDRSQNVMXAY-UHFFFAOYSA-N 1 1 345.403 2.132 20 5 EEBDMO COCCCCC(=O)NCCC[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001235339395 1305198691 /nfs/dbraw/zinc/19/86/91/1305198691.db2.gz SRWOEFOMNONPJA-UHFFFAOYSA-N 1 1 343.449 2.411 20 5 EEBDMO COCCCCC(=O)NCCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001235339395 1305198695 /nfs/dbraw/zinc/19/86/95/1305198695.db2.gz SRWOEFOMNONPJA-UHFFFAOYSA-N 1 1 343.449 2.411 20 5 EEBDMO CCOc1cc(C[N@H+]2CCC[C@@H](C(=O)NC3CC3)C2)ccc1[N+](=O)[O-] ZINC001116760169 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GNXDUMOMXYGETL-HNNXBMFYSA-N 1 1 330.413 2.341 20 5 EEBDMO COc1ccc2ncc([N+](=O)[O-])c(N[C@H]3CC[N@@H+](CC4CC4)C3)c2c1 ZINC001306963754 1331503791 /nfs/dbraw/zinc/50/37/91/1331503791.db2.gz HJKWDPKZCBMPQG-ZDUSSCGKSA-N 1 1 342.399 2.470 20 5 EEBDMO O=C(NCC[NH+]1CC=CC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001323482786 1333473824 /nfs/dbraw/zinc/47/38/24/1333473824.db2.gz MDLKYMGHFJHWKJ-UHFFFAOYSA-N 1 1 344.396 2.320 20 5 EEBDMO CC1(C)CCC[N@H+]1CCNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001609145243 1351860304 /nfs/dbraw/zinc/86/03/04/1351860304.db2.gz GVPFOMFXKPLLNO-UHFFFAOYSA-N 1 1 331.380 2.061 20 5 EEBDMO Cc1ccncc1C[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001609439052 1351977831 /nfs/dbraw/zinc/97/78/31/1351977831.db2.gz FWLMNFDGMBGEHS-UHFFFAOYSA-N 1 1 339.359 2.110 20 5 EEBDMO Cc1ccncc1C[N@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001609439052 1351977833 /nfs/dbraw/zinc/97/78/33/1351977833.db2.gz FWLMNFDGMBGEHS-UHFFFAOYSA-N 1 1 339.359 2.110 20 5 EEBDMO 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CCOc1cccc([N+](=O)[O-])c1C(=O)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2 ZINC000923269255 789280318 /nfs/dbraw/zinc/28/03/18/789280318.db2.gz YFUYFQYGFPVWKV-OLZOCXBDSA-N 1 1 333.388 2.302 20 5 EEBDMO CSCCC(=O)N1CC2(C1)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001146959676 791598264 /nfs/dbraw/zinc/59/82/64/791598264.db2.gz VEVIFXACZYCVPB-UHFFFAOYSA-N 1 1 349.456 2.382 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)N1CCN(c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC001093185172 794791997 /nfs/dbraw/zinc/79/19/97/794791997.db2.gz AAPMJEINTIQQHN-UHFFFAOYSA-N 1 1 348.447 2.282 20 5 EEBDMO COC(=O)CO[C@H]1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172913943 797148419 /nfs/dbraw/zinc/14/84/19/797148419.db2.gz WEHNPDLQWFQVAW-WBVHZDCISA-N 1 1 348.399 2.106 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N1CCC(Nc2cc(C)c([N+](=O)[O-])cn2)CC1 ZINC001095235805 797569075 /nfs/dbraw/zinc/56/90/75/797569075.db2.gz LPCDITJDOJNTDE-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N1CCC(Nc2nc(C)ccc2[N+](=O)[O-])CC1 ZINC001095236186 797569849 /nfs/dbraw/zinc/56/98/49/797569849.db2.gz ZJATVJILBJSMEU-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SC[C@H]1CCC[N@H+]1C ZINC000917469928 798240828 /nfs/dbraw/zinc/24/08/28/798240828.db2.gz ZQUJPDFUJVMSDL-LLVKDONJSA-N 1 1 334.401 2.028 20 5 EEBDMO O=C(NCCCCCC[NH2+]CCCC1CCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001178463906 799486751 /nfs/dbraw/zinc/48/67/51/799486751.db2.gz MSCJCNHWIDWJSS-HZPDHXFCSA-N 1 1 325.453 2.498 20 5 EEBDMO Cc1cc(Cl)c([N+](=O)[O-])c(NCC2(N(C)C)CC[NH+](C)CC2)n1 ZINC001156181495 803311479 /nfs/dbraw/zinc/31/14/79/803311479.db2.gz DJKMCYQNVKRODB-UHFFFAOYSA-N 1 1 341.843 2.390 20 5 EEBDMO CC(C)(C)OC(=O)N[C@@H]1CC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C[C@H]1F ZINC001169012188 803571259 /nfs/dbraw/zinc/57/12/59/803571259.db2.gz OPMUKKRTJOYEBY-XJFOESAGSA-N 1 1 345.415 2.369 20 5 EEBDMO C[N@H+](C1CCOCC1)C1CCN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169034907 803579423 /nfs/dbraw/zinc/57/94/23/803579423.db2.gz IMJYDRFKINIQLE-WMLDXEAASA-N 1 1 325.453 2.007 20 5 EEBDMO C[N@@H+](C1CCOCC1)C1CCN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169034907 803579427 /nfs/dbraw/zinc/57/94/27/803579427.db2.gz IMJYDRFKINIQLE-WMLDXEAASA-N 1 1 325.453 2.007 20 5 EEBDMO CCOC[C@@H]1C[N@@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2c1cnn2CC ZINC001169021791 803588313 /nfs/dbraw/zinc/58/83/13/803588313.db2.gz QJPZBJDOQNDLPL-KKUMJFAQSA-N 1 1 336.436 2.284 20 5 EEBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2c1cnn2CC ZINC001169021791 803588318 /nfs/dbraw/zinc/58/83/18/803588318.db2.gz QJPZBJDOQNDLPL-KKUMJFAQSA-N 1 1 336.436 2.284 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CC[C@]3(C[C@H](Oc4cccnc4)CO3)C2)C1 ZINC001169020723 803588539 /nfs/dbraw/zinc/58/85/39/803588539.db2.gz MCCFRAUDVFFDSV-MVJTYMMSSA-N 1 1 347.415 2.139 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C[N@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169052477 803595573 /nfs/dbraw/zinc/59/55/73/803595573.db2.gz GFEYOFBYELCRDX-MQYQWHSLSA-N 1 1 327.425 2.419 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)N(C)CCCNc1ccccc1[N+](=O)[O-] ZINC001109455587 805493964 /nfs/dbraw/zinc/49/39/64/805493964.db2.gz DZBYOGIRRNCAOK-UHFFFAOYSA-N 1 1 331.376 2.060 20 5 EEBDMO C[N@H+]1CCC[C@@H](CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000790670206 808854966 /nfs/dbraw/zinc/85/49/66/808854966.db2.gz WOTWUYJTBCWKLU-JTQLQIEISA-N 1 1 343.786 2.388 20 5 EEBDMO CC[C@]1(CO)CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000187583691 529424363 /nfs/dbraw/zinc/42/43/63/529424363.db2.gz IXTDZJBMMCQEFS-KRWDZBQOSA-N 1 1 335.404 2.042 20 5 EEBDMO CC[C@]1(CO)CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000187583691 529424364 /nfs/dbraw/zinc/42/43/64/529424364.db2.gz IXTDZJBMMCQEFS-KRWDZBQOSA-N 1 1 335.404 2.042 20 5 EEBDMO C[N@H+]1CC[C@@H](CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000109847387 529792909 /nfs/dbraw/zinc/79/29/09/529792909.db2.gz PAYYVWPULXQDHY-HNNXBMFYSA-N 1 1 349.434 2.223 20 5 EEBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000115442289 282294817 /nfs/dbraw/zinc/29/48/17/282294817.db2.gz NRYARMOICHERSX-ZDUSSCGKSA-N 1 1 334.420 2.075 20 5 EEBDMO Cc1nnc([C@H](C)[NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)s1 ZINC000353655849 282339628 /nfs/dbraw/zinc/33/96/28/282339628.db2.gz GYBZCQWOSJZURF-VIFPVBQESA-N 1 1 335.389 2.434 20 5 EEBDMO C[C@@H](C[C@H]1COCC[NH2+]1)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000423087507 240359935 /nfs/dbraw/zinc/35/99/35/240359935.db2.gz OIFNCSDQKOEBLW-GWCFXTLKSA-N 1 1 347.337 2.470 20 5 EEBDMO O=C(CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)N1CCOCC1 ZINC000451547152 243154540 /nfs/dbraw/zinc/15/45/40/243154540.db2.gz KIQAYWRTNANUDV-MRXNPFEDSA-N 1 1 347.415 2.023 20 5 EEBDMO CC(C)C[C@@H]1COCC[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000247028959 243356551 /nfs/dbraw/zinc/35/65/51/243356551.db2.gz QWQPFZYLQPFCPA-HZPDHXFCSA-N 1 1 338.404 2.081 20 5 EEBDMO CC(C)C[C@@H]1COCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000247028959 243356556 /nfs/dbraw/zinc/35/65/56/243356556.db2.gz QWQPFZYLQPFCPA-HZPDHXFCSA-N 1 1 338.404 2.081 20 5 EEBDMO Cc1c(NC(=O)N2CC[NH+](C[C@@H]3CCCO3)CC2)cccc1[N+](=O)[O-] ZINC000069775300 203048517 /nfs/dbraw/zinc/04/85/17/203048517.db2.gz TXMNXVPLCLYVAS-AWEZNQCLSA-N 1 1 348.403 2.232 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](CN2CCOCC2)C1 ZINC000069857738 203058953 /nfs/dbraw/zinc/05/89/53/203058953.db2.gz YYBYSHVEXWUAHI-OAHLLOKOSA-N 1 1 349.431 2.148 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C)C1CC1 ZINC000101958593 204026879 /nfs/dbraw/zinc/02/68/79/204026879.db2.gz DUPQYFVHUNFLMR-UHFFFAOYSA-N 1 1 336.348 2.026 20 5 EEBDMO C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000487519590 245587070 /nfs/dbraw/zinc/58/70/70/245587070.db2.gz RULKJQSNUPYOMX-ZANVPECISA-N 1 1 345.321 2.428 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000266499854 248332609 /nfs/dbraw/zinc/33/26/09/248332609.db2.gz WVFKMTBGTGHKPC-HZPDHXFCSA-N 1 1 334.351 2.128 20 5 EEBDMO Nc1c(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)cccc1[N+](=O)[O-] ZINC000175743627 207155102 /nfs/dbraw/zinc/15/51/02/207155102.db2.gz FTPDSHVAUJZMLD-AWEZNQCLSA-N 1 1 344.371 2.337 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[NH+]2CCN(Cc3cccc(Cl)c3)CC2)n1 ZINC000176195273 207199221 /nfs/dbraw/zinc/19/92/21/207199221.db2.gz VIBGATKBVKHFSI-UHFFFAOYSA-N 1 1 349.822 2.263 20 5 EEBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000068047317 285163581 /nfs/dbraw/zinc/16/35/81/285163581.db2.gz OGAPHQDUJAEBJN-SFHVURJKSA-N 1 1 327.384 2.450 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NCCC[N@@H+](C)C(C)C)c1F ZINC000411391294 533216787 /nfs/dbraw/zinc/21/67/87/533216787.db2.gz RHCDYANBPQZBBV-UHFFFAOYSA-N 1 1 341.383 2.132 20 5 EEBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc(OC)c(OC)c1 ZINC000267106613 256027710 /nfs/dbraw/zinc/02/77/10/256027710.db2.gz WGCXGXHHQLFRCE-UHFFFAOYSA-N 1 1 334.376 2.331 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000270334196 256124435 /nfs/dbraw/zinc/12/44/35/256124435.db2.gz IVYLMOHQBKDQDE-HZPDHXFCSA-N 1 1 332.404 2.063 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](N2CCCC2=O)C1 ZINC000270847117 256178757 /nfs/dbraw/zinc/17/87/57/256178757.db2.gz GCNURYZXEXLIJF-HNNXBMFYSA-N 1 1 333.388 2.190 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](N2CCCC2=O)C1 ZINC000270847117 256178759 /nfs/dbraw/zinc/17/87/59/256178759.db2.gz GCNURYZXEXLIJF-HNNXBMFYSA-N 1 1 333.388 2.190 20 5 EEBDMO C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)C1=CC[N@@H+](C)CC1 ZINC000273029688 256259053 /nfs/dbraw/zinc/25/90/53/256259053.db2.gz UUMYOKYIVLINIJ-GFCCVEGCSA-N 1 1 332.404 2.041 20 5 EEBDMO O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000081290854 159150497 /nfs/dbraw/zinc/15/04/97/159150497.db2.gz WPIRUCXSOHPBEA-HNNXBMFYSA-N 1 1 346.431 2.387 20 5 EEBDMO O=[N+]([O-])c1cnc(N[C@@H]2CC[N@@H+](C3CC3)C2)c(Br)c1 ZINC000093434033 159235434 /nfs/dbraw/zinc/23/54/34/159235434.db2.gz RKIJMKHVOQHXJC-MRVPVSSYSA-N 1 1 327.182 2.401 20 5 EEBDMO O=[N+]([O-])c1cnc(N[C@@H]2CC[N@H+](C3CC3)C2)c(Br)c1 ZINC000093434033 159235437 /nfs/dbraw/zinc/23/54/37/159235437.db2.gz RKIJMKHVOQHXJC-MRVPVSSYSA-N 1 1 327.182 2.401 20 5 EEBDMO C[C@H]1C(=O)NCCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000189272798 160139175 /nfs/dbraw/zinc/13/91/75/160139175.db2.gz RYQKUTNYKZQZRE-LBPRGKRZSA-N 1 1 344.371 2.003 20 5 EEBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCO[C@H]([C@H]3CCCO3)C2)cc1 ZINC000247312014 160319765 /nfs/dbraw/zinc/31/97/65/160319765.db2.gz LZHYKCAVNVMLJP-SJORKVTESA-N 1 1 336.388 2.244 20 5 EEBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCO[C@H]([C@H]3CCCO3)C2)cc1 ZINC000247312014 160319767 /nfs/dbraw/zinc/31/97/67/160319767.db2.gz LZHYKCAVNVMLJP-SJORKVTESA-N 1 1 336.388 2.244 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCS1 ZINC000247496043 160326552 /nfs/dbraw/zinc/32/65/52/160326552.db2.gz LHIXDIFUZSHEDL-ZBFHGGJFSA-N 1 1 340.445 2.408 20 5 EEBDMO C[C@@H](c1ccncc1)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248449796 160347166 /nfs/dbraw/zinc/34/71/66/160347166.db2.gz IJIYPPHVUVEKAD-DZGCQCFKSA-N 1 1 331.372 2.423 20 5 EEBDMO Cc1ccc([C@@H](C)NC(=O)[C@@H]2CC[NH2+]CC2(F)F)cc1[N+](=O)[O-] ZINC000342644578 161080261 /nfs/dbraw/zinc/08/02/61/161080261.db2.gz BYKBFSLMVFZZHW-PWSUYJOCSA-N 1 1 327.331 2.325 20 5 EEBDMO C[C@@H](C1CCC1)[N@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000343717992 161161948 /nfs/dbraw/zinc/16/19/48/161161948.db2.gz CJYDJIKQDFWQRK-LBPRGKRZSA-N 1 1 326.418 2.489 20 5 EEBDMO C[C@@H](C1CCC1)[N@@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000343717992 161161949 /nfs/dbraw/zinc/16/19/49/161161949.db2.gz CJYDJIKQDFWQRK-LBPRGKRZSA-N 1 1 326.418 2.489 20 5 EEBDMO C[NH+](C)Cc1cccc(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)c1 ZINC000345326206 161292290 /nfs/dbraw/zinc/29/22/90/161292290.db2.gz IHWWXOFMTWLGOA-UHFFFAOYSA-N 1 1 329.356 2.292 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CCC([NH+]3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000345889244 161339926 /nfs/dbraw/zinc/33/99/26/161339926.db2.gz PMHDTDDQWQKELX-UHFFFAOYSA-N 1 1 349.435 2.361 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000355335650 163150080 /nfs/dbraw/zinc/15/00/80/163150080.db2.gz UHNGXLHTXYYHTL-HNNXBMFYSA-N 1 1 330.388 2.367 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000355335650 163150081 /nfs/dbraw/zinc/15/00/81/163150081.db2.gz UHNGXLHTXYYHTL-HNNXBMFYSA-N 1 1 330.388 2.367 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1CN1CC[NH+](C/C=C/c2ccccc2)CC1 ZINC000355801750 163305850 /nfs/dbraw/zinc/30/58/50/163305850.db2.gz ODTBEMSNFBIWRD-VMPITWQZSA-N 1 1 341.415 2.159 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000356203752 163365013 /nfs/dbraw/zinc/36/50/13/163365013.db2.gz VIGCURVBSOUMCE-INIZCTEOSA-N 1 1 329.356 2.333 20 5 EEBDMO CCOC(=O)c1c[nH+]ccc1NCc1cc([N+](=O)[O-])ccc1OC ZINC000358947598 164021624 /nfs/dbraw/zinc/02/16/24/164021624.db2.gz HSSIVMSHNIRRAV-UHFFFAOYSA-N 1 1 331.328 2.209 20 5 EEBDMO CN(C(=O)C[NH2+][C@H](CO)c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000359625639 164140400 /nfs/dbraw/zinc/14/04/00/164140400.db2.gz OAVZXQKJMAUKOA-MRXNPFEDSA-N 1 1 347.346 2.020 20 5 EEBDMO O=C(CCOc1ccccc1[N+](=O)[O-])NCc1c[nH+]c2n1CCCC2 ZINC000375375374 167121436 /nfs/dbraw/zinc/12/14/36/167121436.db2.gz CQQMHVWOYYKFRJ-UHFFFAOYSA-N 1 1 344.371 2.213 20 5 EEBDMO C[C@@]1(O)CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000375906541 167223471 /nfs/dbraw/zinc/22/34/71/167223471.db2.gz SYKQIADQIMBFRS-MRXNPFEDSA-N 1 1 332.360 2.382 20 5 EEBDMO C[C@@]1(O)CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000375906541 167223473 /nfs/dbraw/zinc/22/34/73/167223473.db2.gz SYKQIADQIMBFRS-MRXNPFEDSA-N 1 1 332.360 2.382 20 5 EEBDMO O=C(NCc1ccccc1[N+](=O)[O-])NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000278021390 269207607 /nfs/dbraw/zinc/20/76/07/269207607.db2.gz FKYQKLCHDPKCDZ-OAHLLOKOSA-N 1 1 332.404 2.411 20 5 EEBDMO CO[C@@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1C ZINC000451558276 274064815 /nfs/dbraw/zinc/06/48/15/274064815.db2.gz FSWVELHISVDECK-DAXOMENPSA-N 1 1 333.388 2.057 20 5 EEBDMO C[NH+]1CCN(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000269929481 274120155 /nfs/dbraw/zinc/12/01/55/274120155.db2.gz AIXMVJRLKIGKKU-UHFFFAOYSA-N 1 1 343.181 2.137 20 5 EEBDMO C[C@@H]1CN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO ZINC000450795692 274364949 /nfs/dbraw/zinc/36/49/49/274364949.db2.gz UTSGRKNRQLKGBV-BETUJISGSA-N 1 1 330.388 2.034 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C[N@H+]1C1CC1 ZINC000157731568 274391182 /nfs/dbraw/zinc/39/11/82/274391182.db2.gz ZUGYKMMTAJZOMB-VXGBXAGGSA-N 1 1 340.383 2.498 20 5 EEBDMO CCC[C@]1(CO)CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000288752134 275083832 /nfs/dbraw/zinc/08/38/32/275083832.db2.gz IBZWCMNPQHEVES-KRWDZBQOSA-N 1 1 338.404 2.467 20 5 EEBDMO COc1ccc(OCC[N@H+]2CC[C@@H](n3cc(C)cn3)C2)c([N+](=O)[O-])c1 ZINC000289782100 275148259 /nfs/dbraw/zinc/14/82/59/275148259.db2.gz HEZTVEQPWCGSOV-CQSZACIVSA-N 1 1 346.387 2.434 20 5 EEBDMO CS(=O)(=O)CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290788897 275239950 /nfs/dbraw/zinc/23/99/50/275239950.db2.gz CWXQLLOYVWJYDG-UHFFFAOYSA-N 1 1 327.189 2.036 20 5 EEBDMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000290858637 275246724 /nfs/dbraw/zinc/24/67/24/275246724.db2.gz BIHXFFCRCYZHAS-CYBMUJFWSA-N 1 1 332.404 2.394 20 5 EEBDMO O=C(CC[N@H+]1CC[C@@H](n2cccn2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000291148226 275275648 /nfs/dbraw/zinc/27/56/48/275275648.db2.gz AEARJICTJQIKID-CYBMUJFWSA-N 1 1 329.360 2.067 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353447456 276379441 /nfs/dbraw/zinc/37/94/41/276379441.db2.gz MAMRQADXVNFXTP-DLBZAZTESA-N 1 1 343.431 2.492 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420332474 281261431 /nfs/dbraw/zinc/26/14/31/281261431.db2.gz CZUDLHPXJSXLDR-HUUCEWRRSA-N 1 1 346.431 2.163 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCCO1 ZINC000293234342 293158373 /nfs/dbraw/zinc/15/83/73/293158373.db2.gz SJBYXHMKVKBOAC-RHSMWYFYSA-N 1 1 338.404 2.081 20 5 EEBDMO Cc1cc(C(=O)N2CC[C@]3(C2)CCC[N@H+](C)C3)c(N)c([N+](=O)[O-])c1 ZINC000293840101 293307614 /nfs/dbraw/zinc/30/76/14/293307614.db2.gz CMMVCOWVUHHYBC-QGZVFWFLSA-N 1 1 332.404 2.043 20 5 EEBDMO C[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000296715289 294048204 /nfs/dbraw/zinc/04/82/04/294048204.db2.gz MKHGOTKNTVZBSI-AWEZNQCLSA-N 1 1 346.431 2.340 20 5 EEBDMO C[C@@H]1CN(C2CC2)CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000296715289 294048206 /nfs/dbraw/zinc/04/82/06/294048206.db2.gz MKHGOTKNTVZBSI-AWEZNQCLSA-N 1 1 346.431 2.340 20 5 EEBDMO C[C@@H]1CN(C2CC2)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000296715289 294048208 /nfs/dbraw/zinc/04/82/08/294048208.db2.gz MKHGOTKNTVZBSI-AWEZNQCLSA-N 1 1 346.431 2.340 20 5 EEBDMO COc1ccc(OCCN2CC[N@H+](C3CC3)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000296812145 294073881 /nfs/dbraw/zinc/07/38/81/294073881.db2.gz UYWTUSZYCLXEBM-CQSZACIVSA-N 1 1 349.431 2.398 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2C[C@@H](C)OC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000297985134 294389415 /nfs/dbraw/zinc/38/94/15/294389415.db2.gz WNNHZKFSSUVMBR-NWDGAFQWSA-N 1 1 337.376 2.041 20 5 EEBDMO O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1c1ccncc1 ZINC000423961743 304518755 /nfs/dbraw/zinc/51/87/55/304518755.db2.gz DSGBWSXAABHQKA-HNNXBMFYSA-N 1 1 346.774 2.430 20 5 EEBDMO Cc1cnc(N2CCC[C@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000160495037 302350238 /nfs/dbraw/zinc/35/02/38/302350238.db2.gz OIFSOZILUUUPKG-ZNMIVQPWSA-N 1 1 334.420 2.376 20 5 EEBDMO Cc1cnc(N2CCC[C@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000160495037 302350240 /nfs/dbraw/zinc/35/02/40/302350240.db2.gz OIFSOZILUUUPKG-ZNMIVQPWSA-N 1 1 334.420 2.376 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]CCC1(O)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000342842355 302991936 /nfs/dbraw/zinc/99/19/36/302991936.db2.gz QDOLDBIWYMGYKY-HNNXBMFYSA-N 1 1 330.388 2.312 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 ZINC000332526048 312020525 /nfs/dbraw/zinc/02/05/25/312020525.db2.gz VJOAHHRPHZCOQK-CYBMUJFWSA-N 1 1 349.435 2.435 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCCC[N@H+](C)C1CC1 ZINC000416499562 313239325 /nfs/dbraw/zinc/23/93/25/313239325.db2.gz BYRJBCYMVBJIRA-UHFFFAOYSA-N 1 1 341.433 2.056 20 5 EEBDMO COC(=O)CCC1CC[NH+](CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000533481649 317915851 /nfs/dbraw/zinc/91/58/51/317915851.db2.gz OJVAFYGFQRJLGF-UHFFFAOYSA-N 1 1 349.387 2.199 20 5 EEBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000565995330 319233234 /nfs/dbraw/zinc/23/32/34/319233234.db2.gz QWIDDNCSOIIKLQ-QGZVFWFLSA-N 1 1 332.404 2.222 20 5 EEBDMO CCN1CCN(C[C@H](C)C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000577413556 320254653 /nfs/dbraw/zinc/25/46/53/320254653.db2.gz YHTUFEXLDVZARE-QAPCUYQASA-N 1 1 346.475 2.445 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCc3c(cnn3-c3ccccc3)C2)n1 ZINC000358281064 465036351 /nfs/dbraw/zinc/03/63/51/465036351.db2.gz ZOGLADITWIWOKJ-UHFFFAOYSA-N 1 1 338.371 2.035 20 5 EEBDMO CNc1c(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000326429599 465038196 /nfs/dbraw/zinc/03/81/96/465038196.db2.gz OKGYAZZKDHPFDV-TZMCWYRMSA-N 1 1 332.404 2.193 20 5 EEBDMO CC[C@H](c1ccccc1OC)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000347552905 465089808 /nfs/dbraw/zinc/08/98/08/465089808.db2.gz DESAHUGJFAXUCJ-GDBMZVCRSA-N 1 1 348.403 2.244 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)n1 ZINC000341528878 465216812 /nfs/dbraw/zinc/21/68/12/465216812.db2.gz GENYISKFJOBZSR-NWDGAFQWSA-N 1 1 336.392 2.451 20 5 EEBDMO CCCC[N@H+](C)C[C@@H](C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000341945549 465277261 /nfs/dbraw/zinc/27/72/61/465277261.db2.gz OQQQQUAMUZKUME-LLVKDONJSA-N 1 1 347.412 2.133 20 5 EEBDMO CCCC[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000341945549 465277266 /nfs/dbraw/zinc/27/72/66/465277266.db2.gz OQQQQUAMUZKUME-LLVKDONJSA-N 1 1 347.412 2.133 20 5 EEBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000347930988 465316157 /nfs/dbraw/zinc/31/61/57/465316157.db2.gz KSEKHZPJARENHO-AWEZNQCLSA-N 1 1 334.420 2.386 20 5 EEBDMO CNc1ccc(C(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000074322303 462586858 /nfs/dbraw/zinc/58/68/58/462586858.db2.gz VULKMVMIFYPGMW-AWEZNQCLSA-N 1 1 346.431 2.440 20 5 EEBDMO C[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)[N@H+]1CCC[C@H](C)C1 ZINC000063810168 462673167 /nfs/dbraw/zinc/67/31/67/462673167.db2.gz CXKKRSUDYOUVMD-WDEREUQCSA-N 1 1 338.383 2.166 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCOC3(CCC3)C2)cccc1[N+](=O)[O-] ZINC000154282848 462749171 /nfs/dbraw/zinc/74/91/71/462749171.db2.gz JWKFAFHUZLJKJN-UHFFFAOYSA-N 1 1 333.388 2.487 20 5 EEBDMO COCC[N@H+]1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000116278026 462752161 /nfs/dbraw/zinc/75/21/61/462752161.db2.gz MWMYCXFWYAWWLP-LBPRGKRZSA-N 1 1 327.812 2.401 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCOC2(CCC2)C1 ZINC000154334853 462756789 /nfs/dbraw/zinc/75/67/89/462756789.db2.gz MPDKFKCSJPQSKV-UHFFFAOYSA-N 1 1 347.371 2.148 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCOC2(CCC2)C1 ZINC000154334853 462756794 /nfs/dbraw/zinc/75/67/94/462756794.db2.gz MPDKFKCSJPQSKV-UHFFFAOYSA-N 1 1 347.371 2.148 20 5 EEBDMO Cc1ccc(C(=O)N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000047632898 462807805 /nfs/dbraw/zinc/80/78/05/462807805.db2.gz BZQHSFQBUHRHNG-INIZCTEOSA-N 1 1 347.415 2.230 20 5 EEBDMO CCc1ccc(OC[C@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000155304631 462872902 /nfs/dbraw/zinc/87/29/02/462872902.db2.gz IOYIPLWTCFDIAS-VNHYZAJKSA-N 1 1 338.404 2.006 20 5 EEBDMO CCc1ccc(OC[C@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000155304631 462872909 /nfs/dbraw/zinc/87/29/09/462872909.db2.gz IOYIPLWTCFDIAS-VNHYZAJKSA-N 1 1 338.404 2.006 20 5 EEBDMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)c2c([N+](=O)[O-])cnn2C)c1 ZINC000119966953 462946966 /nfs/dbraw/zinc/94/69/66/462946966.db2.gz TUNSWACBICDJIZ-UHFFFAOYSA-N 1 1 345.403 2.099 20 5 EEBDMO COc1ccc(C(=O)NC[C@@H](C)Cn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000054625327 463250362 /nfs/dbraw/zinc/25/03/62/463250362.db2.gz CUDVDOGXBKOWQG-LLVKDONJSA-N 1 1 332.360 2.174 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000137231580 463284399 /nfs/dbraw/zinc/28/43/99/463284399.db2.gz WXMPDZNDDSWIDZ-WBVHZDCISA-N 1 1 346.431 2.263 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)NCc3cccc([N+](=O)[O-])c3)CC[C@@H]21 ZINC000137873698 463301734 /nfs/dbraw/zinc/30/17/34/463301734.db2.gz HEKSCLLJTOGNGW-ZBFHGGJFSA-N 1 1 332.404 2.221 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000139915784 463333428 /nfs/dbraw/zinc/33/34/28/463333428.db2.gz MLFQXCDYFYFQRH-CABCVRRESA-N 1 1 346.431 2.258 20 5 EEBDMO C[C@H]1C[NH+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H](C)S1 ZINC000072771794 463542124 /nfs/dbraw/zinc/54/21/24/463542124.db2.gz VNKXHOHLKZFNDV-RYUDHWBXSA-N 1 1 335.429 2.310 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC2(C1)CCOCC2 ZINC000072898569 463560984 /nfs/dbraw/zinc/56/09/84/463560984.db2.gz CTYXLILLSIQDJT-ZDUSSCGKSA-N 1 1 333.388 2.424 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000110992658 463668579 /nfs/dbraw/zinc/66/85/79/463668579.db2.gz WATJJTQLXGYPOD-AWEZNQCLSA-N 1 1 335.404 2.354 20 5 EEBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000286837783 463720825 /nfs/dbraw/zinc/72/08/25/463720825.db2.gz XXYFLSNUEJGKEG-UHFFFAOYSA-N 1 1 346.387 2.364 20 5 EEBDMO CCN1CC[NH+](CCC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000177867808 463806268 /nfs/dbraw/zinc/80/62/68/463806268.db2.gz KKCVNQOPVVGLLS-OAHLLOKOSA-N 1 1 348.447 2.108 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000177995146 463825704 /nfs/dbraw/zinc/82/57/04/463825704.db2.gz QDDGJEFHYJPQPE-LBPRGKRZSA-N 1 1 336.392 2.409 20 5 EEBDMO COC[C@H](C)OC[C@@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000278809268 463989793 /nfs/dbraw/zinc/98/97/93/463989793.db2.gz ZNXOSXLSKHPERC-YOEHRIQHSA-N 1 1 340.420 2.218 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000270057367 464173496 /nfs/dbraw/zinc/17/34/96/464173496.db2.gz GMWAECIGTBDYSH-BBRMVZONSA-N 1 1 335.404 2.325 20 5 EEBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H]1CCC[C@H]1O ZINC000270132278 464194970 /nfs/dbraw/zinc/19/49/70/464194970.db2.gz OSWRSJSIEIIDDC-TZMCWYRMSA-N 1 1 332.360 2.238 20 5 EEBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H]1CCC[C@H]1O ZINC000270132278 464194978 /nfs/dbraw/zinc/19/49/78/464194978.db2.gz OSWRSJSIEIIDDC-TZMCWYRMSA-N 1 1 332.360 2.238 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](CS(C)(=O)=O)C1 ZINC000292395702 464217719 /nfs/dbraw/zinc/21/77/19/464217719.db2.gz YJPWRTDWLKDWBI-STQMWFEESA-N 1 1 326.418 2.331 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](CS(C)(=O)=O)C1 ZINC000292395702 464217723 /nfs/dbraw/zinc/21/77/23/464217723.db2.gz YJPWRTDWLKDWBI-STQMWFEESA-N 1 1 326.418 2.331 20 5 EEBDMO Cc1cc(C2CC[NH+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])CC2)n[nH]1 ZINC000271616901 464343472 /nfs/dbraw/zinc/34/34/72/464343472.db2.gz LVVCHXYVRRYXRQ-UHFFFAOYSA-N 1 1 343.387 2.105 20 5 EEBDMO Cc1ccc(NCCCNC(=O)c2c(N)cccc2[N+](=O)[O-])[nH+]c1 ZINC000180841503 464405941 /nfs/dbraw/zinc/40/59/41/464405941.db2.gz LPCCBTNMKUBCJD-UHFFFAOYSA-N 1 1 329.360 2.112 20 5 EEBDMO CCCc1n[nH]c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000264702976 464429953 /nfs/dbraw/zinc/42/99/53/464429953.db2.gz WXLNYKQOUZOCNM-NEPJUHHUSA-N 1 1 337.424 2.121 20 5 EEBDMO C[C@H]([NH2+]CCCN1CCCO[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285032197 464432759 /nfs/dbraw/zinc/43/27/59/464432759.db2.gz HUOSWOOBVWLCNE-KGLIPLIRSA-N 1 1 336.436 2.329 20 5 EEBDMO C[C@H](NCCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285032197 464432764 /nfs/dbraw/zinc/43/27/64/464432764.db2.gz HUOSWOOBVWLCNE-KGLIPLIRSA-N 1 1 336.436 2.329 20 5 EEBDMO C[C@H](NCCC[N@H+]1CCCO[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285032197 464432766 /nfs/dbraw/zinc/43/27/66/464432766.db2.gz HUOSWOOBVWLCNE-KGLIPLIRSA-N 1 1 336.436 2.329 20 5 EEBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@H+]1CCCOCC1 ZINC000189478401 464514111 /nfs/dbraw/zinc/51/41/11/464514111.db2.gz FQIJYOWGFUSRKE-MRXNPFEDSA-N 1 1 349.431 2.002 20 5 EEBDMO C[C@@H](C(=O)NCC(F)(F)F)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285317743 464522055 /nfs/dbraw/zinc/52/20/55/464522055.db2.gz MQRQULTWOWYBNE-JTQLQIEISA-N 1 1 333.310 2.136 20 5 EEBDMO C[C@@H](C(=O)NCC(F)(F)F)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285317743 464522062 /nfs/dbraw/zinc/52/20/62/464522062.db2.gz MQRQULTWOWYBNE-JTQLQIEISA-N 1 1 333.310 2.136 20 5 EEBDMO C[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272244517 464533970 /nfs/dbraw/zinc/53/39/70/464533970.db2.gz LCVDWHRPQZRJGZ-OCCSQVGLSA-N 1 1 342.403 2.290 20 5 EEBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181893559 464536577 /nfs/dbraw/zinc/53/65/77/464536577.db2.gz NDGFQISHWQSJKD-CYBMUJFWSA-N 1 1 349.387 2.318 20 5 EEBDMO CCOC(=O)[C@@H](C)[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000281885517 464621555 /nfs/dbraw/zinc/62/15/55/464621555.db2.gz ANQSFHHFSOJKDO-GFCCVEGCSA-N 1 1 349.387 2.339 20 5 EEBDMO CCOC(=O)[C@@H](C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000281885517 464621563 /nfs/dbraw/zinc/62/15/63/464621563.db2.gz ANQSFHHFSOJKDO-GFCCVEGCSA-N 1 1 349.387 2.339 20 5 EEBDMO COc1cc(CN2CC[C@H]3CC[N@@H+](C)C[C@H]32)c([N+](=O)[O-])cc1OC ZINC000272584035 464668308 /nfs/dbraw/zinc/66/83/08/464668308.db2.gz GZWVXULBQIEBFX-IUODEOHRSA-N 1 1 335.404 2.138 20 5 EEBDMO COc1cc(CN2CC[C@@H]3CC[N@@H+](C)C[C@H]32)c([N+](=O)[O-])cc1OC ZINC000272584038 464668884 /nfs/dbraw/zinc/66/88/84/464668884.db2.gz GZWVXULBQIEBFX-SWLSCSKDSA-N 1 1 335.404 2.138 20 5 EEBDMO COC[C@@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000265770384 464680162 /nfs/dbraw/zinc/68/01/62/464680162.db2.gz IPGXTCMUQJBPRP-SNVBAGLBSA-N 1 1 327.768 2.155 20 5 EEBDMO COC[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000265770384 464680170 /nfs/dbraw/zinc/68/01/70/464680170.db2.gz IPGXTCMUQJBPRP-SNVBAGLBSA-N 1 1 327.768 2.155 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](O)CC(C)(C)C1 ZINC000295196441 464741632 /nfs/dbraw/zinc/74/16/32/464741632.db2.gz BGOXPWDYMRVHOO-SWLSCSKDSA-N 1 1 335.404 2.405 20 5 EEBDMO Nc1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@H+](Cc3ccccc3)CCO2)c1 ZINC000282286646 464765252 /nfs/dbraw/zinc/76/52/52/464765252.db2.gz VNCTUIFNWVCSBJ-MRXNPFEDSA-N 1 1 342.399 2.490 20 5 EEBDMO Nc1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)c1 ZINC000282286646 464765258 /nfs/dbraw/zinc/76/52/58/464765258.db2.gz VNCTUIFNWVCSBJ-MRXNPFEDSA-N 1 1 342.399 2.490 20 5 EEBDMO CCc1n[nH]c(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000183363099 464855277 /nfs/dbraw/zinc/85/52/77/464855277.db2.gz ZVDMLVVGCMQSBW-VXGBXAGGSA-N 1 1 349.435 2.263 20 5 EEBDMO Cc1ccc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3CC(=O)N(C)C)c([N+](=O)[O-])c1 ZINC000286317008 464877177 /nfs/dbraw/zinc/87/71/77/464877177.db2.gz JKDWEPGNTXEFDV-GOOCMWNKSA-N 1 1 346.431 2.399 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](O)CC(C)(C)C1 ZINC000295593341 464895170 /nfs/dbraw/zinc/89/51/70/464895170.db2.gz WTYVBQBREQVPLV-DOMZBBRYSA-N 1 1 335.404 2.405 20 5 EEBDMO C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000286438974 464918180 /nfs/dbraw/zinc/91/81/80/464918180.db2.gz SKZHNDVSVRPGNK-BBRMVZONSA-N 1 1 342.399 2.442 20 5 EEBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000286559345 464960375 /nfs/dbraw/zinc/96/03/75/464960375.db2.gz TUGZQNNHUDZCAX-GOEBONIOSA-N 1 1 335.404 2.009 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000268187746 464963761 /nfs/dbraw/zinc/96/37/61/464963761.db2.gz UZDMYTROBJCUCU-DOMZBBRYSA-N 1 1 332.404 2.219 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC3(CCC3)[C@@H]2c2ccccc2)c1 ZINC000295903871 465000674 /nfs/dbraw/zinc/00/06/74/465000674.db2.gz GTRJNTHKIWUVRL-IRXDYDNUSA-N 1 1 342.399 2.379 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1CNS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000352500632 465535558 /nfs/dbraw/zinc/53/55/58/465535558.db2.gz PUQOZSSLTLTJKJ-ZDUSSCGKSA-N 1 1 341.433 2.056 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)[C@@H]2C1 ZINC000352805656 465557261 /nfs/dbraw/zinc/55/72/61/465557261.db2.gz PVXSFIKBNCZBFW-XHDPSFHLSA-N 1 1 328.372 2.242 20 5 EEBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C[C@H]1C1CC1 ZINC000353135958 465664579 /nfs/dbraw/zinc/66/45/79/465664579.db2.gz KFYMATKNAISEMO-UONOGXRCSA-N 1 1 334.372 2.234 20 5 EEBDMO CNC(=O)CC[C@@H]1CCCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000353181014 465698104 /nfs/dbraw/zinc/69/81/04/465698104.db2.gz KXXYIDFQKRYALY-LBPRGKRZSA-N 1 1 345.403 2.352 20 5 EEBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000353181014 465698110 /nfs/dbraw/zinc/69/81/10/465698110.db2.gz KXXYIDFQKRYALY-LBPRGKRZSA-N 1 1 345.403 2.352 20 5 EEBDMO Cn1ncc(C2CC2)c1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000597118011 468449619 /nfs/dbraw/zinc/44/96/19/468449619.db2.gz UDKOXDLXKVFFHP-UHFFFAOYSA-N 1 1 326.360 2.372 20 5 EEBDMO CNC(=O)c1ccc(N[C@@H]2CC[N@H+](C3CCCC3)C2)c([N+](=O)[O-])c1 ZINC000301213712 465922314 /nfs/dbraw/zinc/92/23/14/465922314.db2.gz YQFPLAWZNRRYBS-CYBMUJFWSA-N 1 1 332.404 2.383 20 5 EEBDMO CC(C)[N@@H+](C)CCN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353497577 465932156 /nfs/dbraw/zinc/93/21/56/465932156.db2.gz PNAGFXQBLLYHQU-MRXNPFEDSA-N 1 1 331.420 2.348 20 5 EEBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000346209458 465994216 /nfs/dbraw/zinc/99/42/16/465994216.db2.gz XSJJYTNSIDSMSW-JJRVBVJISA-N 1 1 346.431 2.195 20 5 EEBDMO COc1c(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000346263805 466040540 /nfs/dbraw/zinc/04/05/40/466040540.db2.gz NJTQBVOSMVUXKI-WOSRLPQWSA-N 1 1 347.415 2.406 20 5 EEBDMO CCOC(=O)c1cc(N2CCC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000371929061 466073025 /nfs/dbraw/zinc/07/30/25/466073025.db2.gz SZDCLZDLNYAGBJ-AWEZNQCLSA-N 1 1 333.388 2.446 20 5 EEBDMO C[N@H+]1CCO[C@H]2CN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])C[C@@H]21 ZINC000357616888 466179798 /nfs/dbraw/zinc/17/97/98/466179798.db2.gz KDZCOIJEZVIKDC-RYUDHWBXSA-N 1 1 332.187 2.421 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1C[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC000340671058 466254350 /nfs/dbraw/zinc/25/43/50/466254350.db2.gz BSFGQXGUZLGWQQ-INIZCTEOSA-N 1 1 330.388 2.391 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)c1 ZINC000338607526 466255839 /nfs/dbraw/zinc/25/58/39/466255839.db2.gz ORAKWUHARRYXIG-MRXNPFEDSA-N 1 1 335.404 2.406 20 5 EEBDMO Cc1ncc([N+](=O)[O-])cc1-c1nc([C@H]2C[N@H+]3CCC[C@@]3(C)CO2)no1 ZINC000347317158 466559174 /nfs/dbraw/zinc/55/91/74/466559174.db2.gz IQODZHUXXSFYEA-CJNGLKHVSA-N 1 1 345.359 2.274 20 5 EEBDMO C[NH+](C)Cc1ccsc1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000354519012 466625127 /nfs/dbraw/zinc/62/51/27/466625127.db2.gz CLHJDXDMCUUWCS-UHFFFAOYSA-N 1 1 345.384 2.847 20 5 EEBDMO Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000363922300 466655513 /nfs/dbraw/zinc/65/55/13/466655513.db2.gz OCYZPBPBKBHAKY-HNNXBMFYSA-N 1 1 343.387 2.073 20 5 EEBDMO Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000363922300 466655517 /nfs/dbraw/zinc/65/55/17/466655517.db2.gz OCYZPBPBKBHAKY-HNNXBMFYSA-N 1 1 343.387 2.073 20 5 EEBDMO Cn1ccnc1[C@H](NCC1(C)CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423319222 466716692 /nfs/dbraw/zinc/71/66/92/466716692.db2.gz DFKXPZIPLJJCTP-MRXNPFEDSA-N 1 1 343.431 2.397 20 5 EEBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000411964361 466949129 /nfs/dbraw/zinc/94/91/29/466949129.db2.gz INLFTDSPZSZJFF-GOSISDBHSA-N 1 1 325.368 2.224 20 5 EEBDMO CN(Cc1c(F)cc([N+](=O)[O-])cc1F)C(C)(C)C[NH+]1CCOCC1 ZINC000412103294 467010447 /nfs/dbraw/zinc/01/04/47/467010447.db2.gz ZAMMORIKWRGDKC-UHFFFAOYSA-N 1 1 343.374 2.416 20 5 EEBDMO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H]1CCc2cn[nH]c2C1 ZINC000374469303 467055497 /nfs/dbraw/zinc/05/54/97/467055497.db2.gz PNMWQGIPHYGOSP-FZMZJTMJSA-N 1 1 343.387 2.182 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000378236659 467237195 /nfs/dbraw/zinc/23/71/95/467237195.db2.gz PHQWLKPSNIYDOW-MGPQQGTHSA-N 1 1 333.388 2.280 20 5 EEBDMO O=C(C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)NC[C@H]1CCCO1 ZINC000451580402 467261818 /nfs/dbraw/zinc/26/18/18/467261818.db2.gz ZXYOVMDJEACJOR-DOTOQJQBSA-N 1 1 347.415 2.069 20 5 EEBDMO 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ZINC000434709369 467422214 /nfs/dbraw/zinc/42/22/14/467422214.db2.gz GQNWTTLTHQHYTJ-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO CN(CC[N@H+]1CCOC(C)(C)C1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000434709369 467422217 /nfs/dbraw/zinc/42/22/17/467422217.db2.gz GQNWTTLTHQHYTJ-UHFFFAOYSA-N 1 1 325.384 2.277 20 5 EEBDMO Cn1cc(CNC[C@@H]2CCC[NH2+]C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000414836271 467436221 /nfs/dbraw/zinc/43/62/21/467436221.db2.gz USEAGWDYBOBEPT-CYBMUJFWSA-N 1 1 329.404 2.085 20 5 EEBDMO COc1ccc(CN2CCC([C@@H]3OCCC[C@H]3[NH3+])CC2)cc1[N+](=O)[O-] ZINC000415100453 467489533 /nfs/dbraw/zinc/48/95/33/467489533.db2.gz AIYKZQLBINJBHW-QAPCUYQASA-N 1 1 349.431 2.322 20 5 EEBDMO C[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1C[NH3+] ZINC000415126296 467496233 /nfs/dbraw/zinc/49/62/33/467496233.db2.gz LXYAQPYPQCOVSY-ZFWWWQNUSA-N 1 1 343.431 2.412 20 5 EEBDMO C[C@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1C[NH3+] ZINC000415126296 467496237 /nfs/dbraw/zinc/49/62/37/467496237.db2.gz 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331.380 2.060 20 5 EEBDMO C[C@@H](C[NH+]1CCCCC1)Nc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001603517892 1350715743 /nfs/dbraw/zinc/71/57/43/1350715743.db2.gz PDYQPPKIHHXCIK-VIFPVBQESA-N 1 1 337.409 2.123 20 5 EEBDMO O=[N+]([O-])c1sc(-c2nn[nH]n2)cc1N[C@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC001607088490 1351413508 /nfs/dbraw/zinc/41/35/08/1351413508.db2.gz PUTBZGYEJNJOOR-GXSJLCMTSA-N 1 1 349.420 2.265 20 5 EEBDMO O=[N+]([O-])c1sc(-c2nn[nH]n2)cc1N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC001607088490 1351413510 /nfs/dbraw/zinc/41/35/10/1351413510.db2.gz PUTBZGYEJNJOOR-GXSJLCMTSA-N 1 1 349.420 2.265 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NC1(C)CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC001110596045 1369125164 /nfs/dbraw/zinc/12/51/64/1369125164.db2.gz RSRNNVZEWQLSJS-UHFFFAOYSA-N 1 1 348.447 2.412 20 5 EEBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC(C)(C)NC(=O)OC(C)(C)C ZINC000852306209 1369260824 /nfs/dbraw/zinc/26/08/24/1369260824.db2.gz AIKTWBOHVWBKHM-UHFFFAOYSA-N 1 1 341.412 2.026 20 5 EEBDMO 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/nfs/dbraw/zinc/65/53/15/784655315.db2.gz IBTFYKTWAWAXDP-GHMZBOCLSA-N 1 1 341.795 2.137 20 5 EEBDMO Cc1ccc(NC/C=C/CNC(=O)C[N@H+](C)C(C)C)c([N+](=O)[O-])c1 ZINC001107233161 786548590 /nfs/dbraw/zinc/54/85/90/786548590.db2.gz LPJLRNPYNQQDHS-AATRIKPKSA-N 1 1 334.420 2.328 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NC/C=C\CNc1ccc([N+](=O)[O-])cc1 ZINC001107391857 787105830 /nfs/dbraw/zinc/10/58/30/787105830.db2.gz OAAGSMXKXRSROH-SREVYHEPSA-N 1 1 334.420 2.409 20 5 EEBDMO C[C@H]1CN(Cc2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000822791289 787380384 /nfs/dbraw/zinc/38/03/84/787380384.db2.gz QPTQNFPHUITRHO-JTQLQIEISA-N 1 1 328.210 2.493 20 5 EEBDMO Cc1nn(C[N@H+]2CCC[C@@H](OC(C)C)C2)c2ncc([N+](=O)[O-])cc12 ZINC000844715325 789318333 /nfs/dbraw/zinc/31/83/33/789318333.db2.gz CEIVXVOJAPZLSY-CQSZACIVSA-N 1 1 333.392 2.495 20 5 EEBDMO Cc1nn(C[N@@H+]2CCC[C@@H](OC(C)C)C2)c2ncc([N+](=O)[O-])cc12 ZINC000844715325 789318339 /nfs/dbraw/zinc/31/83/39/789318339.db2.gz CEIVXVOJAPZLSY-CQSZACIVSA-N 1 1 333.392 2.495 20 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797147334 /nfs/dbraw/zinc/14/73/34/797147334.db2.gz AMTKQFRMOJEBAQ-SFHVURJKSA-N 1 1 346.475 2.069 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@@H](F)[C@@H](O)CC2)c1F ZINC001173181324 797279610 /nfs/dbraw/zinc/27/96/10/797279610.db2.gz OMZKOWPRZPNVPA-SUHUHFCYSA-N 1 1 344.358 2.468 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCc3cnn(C)c3C2)c1F ZINC001173192184 797281987 /nfs/dbraw/zinc/28/19/87/797281987.db2.gz JLYIIHQFGQLHHB-LLVKDONJSA-N 1 1 348.378 2.465 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCc3cnn(C)c3C2)c1F ZINC001173192184 797281990 /nfs/dbraw/zinc/28/19/90/797281990.db2.gz JLYIIHQFGQLHHB-LLVKDONJSA-N 1 1 348.378 2.465 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCC1(Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC001110193765 798368471 /nfs/dbraw/zinc/36/84/71/798368471.db2.gz WVZFLRYNRCSLGA-UHFFFAOYSA-N 1 1 338.383 2.136 20 5 EEBDMO O=C(NCCCCCC[NH2+]C/C(Cl)=C\Cl)[C@@H]1CC1[N+](=O)[O-] ZINC001178458655 799484230 /nfs/dbraw/zinc/48/42/30/799484230.db2.gz QFGQZPYMJIMBJG-BXAYLQTHSA-N 1 1 338.235 2.237 20 5 EEBDMO O=[N+]([O-])c1ccc(CN2CC[NH+](CCc3ccncc3)CC2)cc1F ZINC000829051962 800920617 /nfs/dbraw/zinc/92/06/17/800920617.db2.gz QGEMMHHOIUPQCU-UHFFFAOYSA-N 1 1 344.390 2.489 20 5 EEBDMO CC1(C)CC(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])CC[C@@H]3C2)C1 ZINC000946589194 801539740 /nfs/dbraw/zinc/53/97/40/801539740.db2.gz LNIWCDJYCHRDGS-YYIAUSFCSA-N 1 1 349.475 2.258 20 5 EEBDMO CC1(C)CC(C[N@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)C1 ZINC000946589194 801539742 /nfs/dbraw/zinc/53/97/42/801539742.db2.gz LNIWCDJYCHRDGS-YYIAUSFCSA-N 1 1 349.475 2.258 20 5 EEBDMO CC1(C)CC(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)C1 ZINC000946589194 801539745 /nfs/dbraw/zinc/53/97/45/801539745.db2.gz LNIWCDJYCHRDGS-YYIAUSFCSA-N 1 1 349.475 2.258 20 5 EEBDMO CC(C)(C)OC(=O)N[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC12CC2 ZINC001169007467 803569000 /nfs/dbraw/zinc/56/90/00/803569000.db2.gz OCRZHSKCRBBWJT-MELADBBJSA-N 1 1 339.436 2.421 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H](F)[C@@](O)(C(F)(F)F)CC2)C1 ZINC001169012884 803571396 /nfs/dbraw/zinc/57/13/96/803571396.db2.gz SKAHKVOUVDSLNC-WRWGMCAJSA-N 1 1 328.306 2.159 20 5 EEBDMO CC[N@H+]([C@@H]1CCOC1)C1CCN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169033664 803578938 /nfs/dbraw/zinc/57/89/38/803578938.db2.gz DEXHSGPMTPHMHQ-DJIMGWMZSA-N 1 1 325.453 2.007 20 5 EEBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169033664 803578941 /nfs/dbraw/zinc/57/89/41/803578941.db2.gz DEXHSGPMTPHMHQ-DJIMGWMZSA-N 1 1 325.453 2.007 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)N(C)CCCNc1cccc(F)c1[N+](=O)[O-] ZINC001109455925 805495935 /nfs/dbraw/zinc/49/59/35/805495935.db2.gz XMZDJVNRWPMLSE-UHFFFAOYSA-N 1 1 349.366 2.199 20 5 EEBDMO CC(=O)NCC[C@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000808216580 812522111 /nfs/dbraw/zinc/52/21/11/812522111.db2.gz BOSWEUXDWHPRMN-CQSZACIVSA-N 1 1 345.403 2.140 20 5 EEBDMO CN(C[C@]12CCC[C@H]1OCC2)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC001524143458 1119990313 /nfs/dbraw/zinc/99/03/13/1119990313.db2.gz IPRUUVGDWONIDQ-KBAYOESNSA-N 1 1 347.415 2.186 20 5 EEBDMO Cc1cc(NC(=O)N2CC[NH+](C[C@H]3CCCO3)CC2)cc([N+](=O)[O-])c1 ZINC001526957356 1120627564 /nfs/dbraw/zinc/62/75/64/1120627564.db2.gz PUBXOXDODQZMPT-MRXNPFEDSA-N 1 1 348.403 2.232 20 5 EEBDMO CC[C@@]1(CO)CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000187585454 529554243 /nfs/dbraw/zinc/55/42/43/529554243.db2.gz RVOBZONNMYMAEA-SUMWQHHRSA-N 1 1 335.404 2.406 20 5 EEBDMO CC[C@@]1(CO)CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000187585454 529554246 /nfs/dbraw/zinc/55/42/46/529554246.db2.gz RVOBZONNMYMAEA-SUMWQHHRSA-N 1 1 335.404 2.406 20 5 EEBDMO C[N@H+]1CC[C@H](CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000109847383 529803642 /nfs/dbraw/zinc/80/36/42/529803642.db2.gz PAYYVWPULXQDHY-OAHLLOKOSA-N 1 1 349.434 2.223 20 5 EEBDMO Nc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CC[C@@H](O)C2)c1 ZINC000193497315 240188770 /nfs/dbraw/zinc/18/87/70/240188770.db2.gz VYVBMXPODIXRJQ-MRXNPFEDSA-N 1 1 342.399 2.356 20 5 EEBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000426107782 241219451 /nfs/dbraw/zinc/21/94/51/241219451.db2.gz BIUVTHGEKQFTMC-NSHDSACASA-N 1 1 331.294 2.095 20 5 EEBDMO C[C@H](C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)S(C)(=O)=O ZINC000451545940 243152494 /nfs/dbraw/zinc/15/24/94/243152494.db2.gz IALUYFUDEIUZRU-OCCSQVGLSA-N 1 1 326.418 2.207 20 5 EEBDMO C[C@H](C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)S(C)(=O)=O ZINC000451545940 243152499 /nfs/dbraw/zinc/15/24/99/243152499.db2.gz IALUYFUDEIUZRU-OCCSQVGLSA-N 1 1 326.418 2.207 20 5 EEBDMO C[C@@H](NC[C@@H](N1CC[NH2+]CC1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000423382240 296127391 /nfs/dbraw/zinc/12/73/91/296127391.db2.gz IJUYLDMCDYQUCH-BXUZGUMPSA-N 1 1 346.353 2.082 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1 ZINC000110815195 204324786 /nfs/dbraw/zinc/32/47/86/204324786.db2.gz KFXCGLOZHDZYTD-UHFFFAOYSA-N 1 1 332.404 2.337 20 5 EEBDMO CCc1ccc(C(=O)NCCCC[N@H+]2CCC[C@H]2CO)cc1[N+](=O)[O-] ZINC000131264855 205280917 /nfs/dbraw/zinc/28/09/17/205280917.db2.gz SOAKADGSEFTRNN-INIZCTEOSA-N 1 1 349.431 2.124 20 5 EEBDMO C[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc(Br)o1 ZINC000157670084 206148777 /nfs/dbraw/zinc/14/87/77/206148777.db2.gz BGYVMWFRLOKZQU-UHFFFAOYSA-N 1 1 329.154 2.279 20 5 EEBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc(Br)o1 ZINC000157670084 206148779 /nfs/dbraw/zinc/14/87/79/206148779.db2.gz BGYVMWFRLOKZQU-UHFFFAOYSA-N 1 1 329.154 2.279 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000492072064 246288238 /nfs/dbraw/zinc/28/82/38/246288238.db2.gz HZPPUFXCSKGLSX-UMCUBORVSA-N 1 1 333.363 2.489 20 5 EEBDMO C[C@H](Cn1cccn1)[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000265098672 247201686 /nfs/dbraw/zinc/20/16/86/247201686.db2.gz WJEKFFHYTVDJDE-LLVKDONJSA-N 1 1 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O=C1C[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C[C@H]2CCCN12 ZINC001172921316 797151232 /nfs/dbraw/zinc/15/12/32/797151232.db2.gz OJAIFYLWKRKCTL-DOTOQJQBSA-N 1 1 329.400 2.149 20 5 EEBDMO CC(=O)N[C@@H]1CCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172911613 797169851 /nfs/dbraw/zinc/16/98/51/797169851.db2.gz CYPFHGHKGSMEBY-SJORKVTESA-N 1 1 331.416 2.443 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCc3c(cnn3C)C2)c1F ZINC001173192923 797282820 /nfs/dbraw/zinc/28/28/20/797282820.db2.gz NOZQXVXMYORSJJ-LLVKDONJSA-N 1 1 348.378 2.465 20 5 EEBDMO C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001169033626 803578977 /nfs/dbraw/zinc/57/89/77/803578977.db2.gz CQHYEWIASDLEQW-BFHYXJOUSA-N 1 1 327.425 2.373 20 5 EEBDMO CC(C)(C)OC(=O)NC[C@H]1CC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169034967 803579101 /nfs/dbraw/zinc/57/91/01/803579101.db2.gz IXDYJUXEFPXDQQ-MJBXVCDLSA-N 1 1 327.425 2.278 20 5 EEBDMO 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Cc1cccc(C(=O)OCCC[NH+]2CCN(C(C)C)CC2)c1[N+](=O)[O-] ZINC000787562773 807152323 /nfs/dbraw/zinc/15/23/23/807152323.db2.gz JKSYBAWNAJSMCS-UHFFFAOYSA-N 1 1 349.431 2.476 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@@H]3[C@H]3CCCO3)n2)c1 ZINC000789509908 808033801 /nfs/dbraw/zinc/03/38/01/808033801.db2.gz WGLANSZYSMDUCW-HZPDHXFCSA-N 1 1 343.387 2.454 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3c(cnn3C)C2)c([N+](=O)[O-])c1 ZINC001170355218 809902887 /nfs/dbraw/zinc/90/28/87/809902887.db2.gz XTJZLEJMHSSQRF-LBPRGKRZSA-N 1 1 330.388 2.326 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000072858466 216319123 /nfs/dbraw/zinc/31/91/23/216319123.db2.gz VQSFRVBPECHOOB-CYBMUJFWSA-N 1 1 345.403 2.418 20 5 EEBDMO CCO[C@@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H]1C ZINC000451523113 243143969 /nfs/dbraw/zinc/14/39/69/243143969.db2.gz CKBWHVQMLXPVDX-CXAGYDPISA-N 1 1 347.415 2.231 20 5 EEBDMO CCO[C@@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H]1C 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Cc1[nH+]ccn1CCCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000337828210 160676236 /nfs/dbraw/zinc/67/62/36/160676236.db2.gz UOJLCMGPYUINPY-UHFFFAOYSA-N 1 1 338.389 2.005 20 5 EEBDMO COc1cc([N+](=O)[O-])c(C(=O)NCC[N@@H+](C)C(C)C)cc1SC ZINC000343781914 161168022 /nfs/dbraw/zinc/16/80/22/161168022.db2.gz QSSCPVRDOBSRNW-UHFFFAOYSA-N 1 1 341.433 2.395 20 5 EEBDMO C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCC[N@@H+]1C ZINC000343962569 161184927 /nfs/dbraw/zinc/18/49/27/161184927.db2.gz CGVCKDAFDQMLBD-KOLCDFICSA-N 1 1 347.824 2.009 20 5 EEBDMO C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCC[N@H+]1C ZINC000343962569 161184928 /nfs/dbraw/zinc/18/49/28/161184928.db2.gz CGVCKDAFDQMLBD-KOLCDFICSA-N 1 1 347.824 2.009 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](CO)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000344130958 161200773 /nfs/dbraw/zinc/20/07/73/161200773.db2.gz IUPSHBVRBYGIRL-OCCSQVGLSA-N 1 1 335.404 2.325 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1[N@@H+](C)CCCC1(C)C ZINC000344705575 161237669 /nfs/dbraw/zinc/23/76/69/161237669.db2.gz KWDLIVVFQJBQKB-OAHLLOKOSA-N 1 1 335.404 2.454 20 5 EEBDMO COC(=O)CC1CC[NH+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000345305360 161290151 /nfs/dbraw/zinc/29/01/51/161290151.db2.gz PNBYYXCBBXETQF-GFCCVEGCSA-N 1 1 349.387 2.197 20 5 EEBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000352638667 162222829 /nfs/dbraw/zinc/22/28/29/162222829.db2.gz VCSSUSRYXMIHDL-UWVGGRQHSA-N 1 1 343.330 2.361 20 5 EEBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000352638667 162222831 /nfs/dbraw/zinc/22/28/31/162222831.db2.gz VCSSUSRYXMIHDL-UWVGGRQHSA-N 1 1 343.330 2.361 20 5 EEBDMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)c2cc([N+](=O)[O-])nn2C)c1 ZINC000360800841 164382885 /nfs/dbraw/zinc/38/28/85/164382885.db2.gz IMXFQKAVFYFZHB-UHFFFAOYSA-N 1 1 345.403 2.099 20 5 EEBDMO Cc1ccc([C@@]2(C)CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000370028245 166380391 /nfs/dbraw/zinc/38/03/91/166380391.db2.gz CJUPNDZJLRLKRE-MSOLQXFVSA-N 1 1 344.415 2.124 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)[C@H](C)C1 ZINC000275429764 274247925 /nfs/dbraw/zinc/24/79/25/274247925.db2.gz VFCBFJMRNXLBRR-CHWSQXEVSA-N 1 1 330.388 2.034 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000277597816 274318205 /nfs/dbraw/zinc/31/82/05/274318205.db2.gz OGNLHGOXTYVCBA-IUODEOHRSA-N 1 1 333.388 2.160 20 5 EEBDMO C[C@@H](C(=O)N(C)CCc1ccccc1[N+](=O)[O-])[NH+]1CCSCC1 ZINC000288154220 275029634 /nfs/dbraw/zinc/02/96/34/275029634.db2.gz DLUUTSOKLLKUPV-ZDUSSCGKSA-N 1 1 337.445 2.033 20 5 EEBDMO CCC[C@@]1(CO)CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000288721339 275082343 /nfs/dbraw/zinc/08/23/43/275082343.db2.gz FYWNINDJILVNCW-QGZVFWFLSA-N 1 1 335.404 2.326 20 5 EEBDMO CCC[C@@]1(CO)CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000288721339 275082344 /nfs/dbraw/zinc/08/23/44/275082344.db2.gz FYWNINDJILVNCW-QGZVFWFLSA-N 1 1 335.404 2.326 20 5 EEBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000289438910 275115943 /nfs/dbraw/zinc/11/59/43/275115943.db2.gz OFRLXORJPIEWOO-NVXWUHKLSA-N 1 1 348.403 2.244 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000291469258 275308408 /nfs/dbraw/zinc/30/84/08/275308408.db2.gz BXIJBLVGDDLFSX-AWEZNQCLSA-N 1 1 332.404 2.383 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)c1cc(C[NH+]2CCCC2)on1 ZINC000291869825 275348342 /nfs/dbraw/zinc/34/83/42/275348342.db2.gz IBLNXPBPFQHVNU-UHFFFAOYSA-N 1 1 344.371 2.151 20 5 EEBDMO C[C@@H]1CN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000292136281 275382421 /nfs/dbraw/zinc/38/24/21/275382421.db2.gz IUYODDNVDRCEPG-KDOFPFPSSA-N 1 1 333.432 2.434 20 5 EEBDMO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1(CO)CCC1 ZINC000292198179 275392490 /nfs/dbraw/zinc/39/24/90/275392490.db2.gz RZABLZVWBLGIGE-UHFFFAOYSA-N 1 1 327.768 2.034 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1(CO)CCC1 ZINC000292198179 275392492 /nfs/dbraw/zinc/39/24/92/275392492.db2.gz RZABLZVWBLGIGE-UHFFFAOYSA-N 1 1 327.768 2.034 20 5 EEBDMO CCC(=O)c1ccc(N2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)c([N+](=O)[O-])c1 ZINC000375662441 276205242 /nfs/dbraw/zinc/20/52/42/276205242.db2.gz GJCSLQBWKVMFDW-QAPCUYQASA-N 1 1 347.415 2.223 20 5 EEBDMO C[C@@H]1C[N@H+](CCCNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000491198665 288161708 /nfs/dbraw/zinc/16/17/08/288161708.db2.gz DGJVNPSTBBYJJL-VUEDLFODSA-N 1 1 347.415 2.224 20 5 EEBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)COCC(F)(F)F ZINC000292899795 293072441 /nfs/dbraw/zinc/07/24/41/293072441.db2.gz JZGPRXOGQBIDQX-CYBMUJFWSA-N 1 1 336.310 2.009 20 5 EEBDMO C[N@H+]1CC[C@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000293584183 293244790 /nfs/dbraw/zinc/24/47/90/293244790.db2.gz ANCKSMUKWRGCEI-INIZCTEOSA-N 1 1 337.807 2.345 20 5 EEBDMO NC(=O)c1cccc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000342774181 295188151 /nfs/dbraw/zinc/18/81/51/295188151.db2.gz BUQILDBIPHDSKT-SWLSCSKDSA-N 1 1 344.415 2.147 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@@H]2CCCC[N@@H+]2C[C@@H]1C ZINC000332488978 312014953 /nfs/dbraw/zinc/01/49/53/312014953.db2.gz ODHCXERDXVXJES-HOCLYGCPSA-N 1 1 346.431 2.400 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000421743344 314153020 /nfs/dbraw/zinc/15/30/20/314153020.db2.gz WDOGACFKOAAKIU-GASCZTMLSA-N 1 1 349.431 2.441 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(C)C[C@H]2CCC[N@H+]2C)c1 ZINC000422027677 314171658 /nfs/dbraw/zinc/17/16/58/314171658.db2.gz VSLLHQHIEYHGJD-CQSZACIVSA-N 1 1 335.404 2.225 20 5 EEBDMO COCC(C)(C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)cc2C)CC1 ZINC000425026611 314323488 /nfs/dbraw/zinc/32/34/88/314323488.db2.gz WILJUULOKOSUDO-UHFFFAOYSA-N 1 1 349.431 2.394 20 5 EEBDMO O=C(Nc1ccccc1C[NH+]1CCSCC1)c1c[nH]nc1[N+](=O)[O-] ZINC000548741490 318408753 /nfs/dbraw/zinc/40/87/53/318408753.db2.gz NEJDLXNCDSZDMX-UHFFFAOYSA-N 1 1 347.400 2.119 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCn2c(C)[nH+]cc2C1 ZINC000576350387 320164274 /nfs/dbraw/zinc/16/42/74/320164274.db2.gz ZJHWDZQFGUXQBJ-LLVKDONJSA-N 1 1 329.360 2.343 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H](C)C(C)(C)O ZINC000298028261 465278629 /nfs/dbraw/zinc/27/86/29/465278629.db2.gz BVTAPJGBXQSZCZ-NSHDSACASA-N 1 1 339.392 2.023 20 5 EEBDMO CCC[N@H+]1CCC[C@@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000351852616 465399769 /nfs/dbraw/zinc/39/97/69/465399769.db2.gz WISBDTVMRSHGNX-MRXNPFEDSA-N 1 1 334.420 2.311 20 5 EEBDMO CC[C@H]1CCCC[N@H+]1CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000113301468 462588162 /nfs/dbraw/zinc/58/81/62/462588162.db2.gz LVXXIVXPIDTLGZ-ZDUSSCGKSA-N 1 1 341.433 2.138 20 5 EEBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087087195 462588387 /nfs/dbraw/zinc/58/83/87/462588387.db2.gz ODNFEVZPMRHMRX-CYBMUJFWSA-N 1 1 334.420 2.393 20 5 EEBDMO CC[N@@H+]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000590684790 468305669 /nfs/dbraw/zinc/30/56/69/468305669.db2.gz PIHQFVFTCDJIGQ-CYBMUJFWSA-N 1 1 333.388 2.110 20 5 EEBDMO CC[N@H+]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000590684790 468305674 /nfs/dbraw/zinc/30/56/74/468305674.db2.gz PIHQFVFTCDJIGQ-CYBMUJFWSA-N 1 1 333.388 2.110 20 5 EEBDMO C[N@H+](CCc1ccccn1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000152970223 462601212 /nfs/dbraw/zinc/60/12/12/462601212.db2.gz NMUILKBVFZKOJF-QGZVFWFLSA-N 1 1 340.383 2.270 20 5 EEBDMO C[N@@H+](CCc1ccccn1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000152970223 462601214 /nfs/dbraw/zinc/60/12/14/462601214.db2.gz NMUILKBVFZKOJF-QGZVFWFLSA-N 1 1 340.383 2.270 20 5 EEBDMO COC(=O)Cc1ccc(N[C@@H]2CC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000590689598 468306903 /nfs/dbraw/zinc/30/69/03/468306903.db2.gz CBHDFUBPUQJRAJ-CQSZACIVSA-N 1 1 333.388 2.207 20 5 EEBDMO CC(C)(C)[N@H+]1CCCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1 ZINC000063726804 462666609 /nfs/dbraw/zinc/66/66/09/462666609.db2.gz DXVFIQGOCFAREU-UHFFFAOYSA-N 1 1 335.404 2.306 20 5 EEBDMO CCCNC(=O)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000065244195 462747034 /nfs/dbraw/zinc/74/70/34/462747034.db2.gz VPYNTAQPVHWAEE-CYBMUJFWSA-N 1 1 335.404 2.342 20 5 EEBDMO Cc1nsc(N2CCC[N@H+](Cc3ccccc3[N+](=O)[O-])CC2)n1 ZINC000075968050 462779732 /nfs/dbraw/zinc/77/97/32/462779732.db2.gz ZMVJIIOETMDKJE-UHFFFAOYSA-N 1 1 333.417 2.467 20 5 EEBDMO Cc1nsc(N2CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])CC2)n1 ZINC000075968050 462779736 /nfs/dbraw/zinc/77/97/36/462779736.db2.gz ZMVJIIOETMDKJE-UHFFFAOYSA-N 1 1 333.417 2.467 20 5 EEBDMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000119451391 462902442 /nfs/dbraw/zinc/90/24/42/462902442.db2.gz ISIUIRHEYIJJIJ-OAHLLOKOSA-N 1 1 346.362 2.473 20 5 EEBDMO Cc1c(C[N@@H+]2CCCC[C@@H]2C(=O)N2CCOCC2)cccc1[N+](=O)[O-] ZINC000066892362 462941736 /nfs/dbraw/zinc/94/17/36/462941736.db2.gz WDPLQUBQONFEAE-QGZVFWFLSA-N 1 1 347.415 2.117 20 5 EEBDMO Cc1c(C[N@H+]2CCCC[C@@H]2C(=O)N2CCOCC2)cccc1[N+](=O)[O-] ZINC000066892362 462941740 /nfs/dbraw/zinc/94/17/40/462941740.db2.gz WDPLQUBQONFEAE-QGZVFWFLSA-N 1 1 347.415 2.117 20 5 EEBDMO C[N@@H+](CCC1CCOCC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000120611631 463019074 /nfs/dbraw/zinc/01/90/74/463019074.db2.gz XHGZIJGLNRHMGO-QGZVFWFLSA-N 1 1 347.415 2.449 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccc4c(c3)CCO4)CC2)cn1 ZINC000078596437 463130996 /nfs/dbraw/zinc/13/09/96/463130996.db2.gz WZZWFDHMMQJPKW-UHFFFAOYSA-N 1 1 340.383 2.247 20 5 EEBDMO CC(C)C[C@@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000026063676 463148849 /nfs/dbraw/zinc/14/88/49/463148849.db2.gz RFNGNDWZWBWXGQ-INIZCTEOSA-N 1 1 349.431 2.000 20 5 EEBDMO COc1ccc(C[N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000026712117 463169023 /nfs/dbraw/zinc/16/90/23/463169023.db2.gz FUHUAAOCLMQNHI-MRXNPFEDSA-N 1 1 346.383 2.475 20 5 EEBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1 ZINC000053749838 463187451 /nfs/dbraw/zinc/18/74/51/463187451.db2.gz NWJDTAADTTYYAA-OCCSQVGLSA-N 1 1 328.372 2.488 20 5 EEBDMO Cc1cccc(C(=O)N2CCC[C@H](C[NH+]3CCOCC3)C2)c1[N+](=O)[O-] ZINC000069744083 463316829 /nfs/dbraw/zinc/31/68/29/463316829.db2.gz WVRQPKDSAQMNHB-OAHLLOKOSA-N 1 1 347.415 2.088 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000140032355 463336885 /nfs/dbraw/zinc/33/68/85/463336885.db2.gz XGCITRUAKORYSF-CKEIUWERSA-N 1 1 346.431 2.338 20 5 EEBDMO Cc1[nH+]ccn1CCCCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O ZINC000124588345 463439947 /nfs/dbraw/zinc/43/99/47/463439947.db2.gz NPZCYLGUDYFTNZ-UHFFFAOYSA-N 1 1 328.328 2.176 20 5 EEBDMO Cc1nnc([C@@H]2CCC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)C2)[nH]1 ZINC000268466696 463754574 /nfs/dbraw/zinc/75/45/74/463754574.db2.gz LUWMTEZYLPWERK-CYBMUJFWSA-N 1 1 331.376 2.280 20 5 EEBDMO Cc1n[nH]c([C@@H]2CCC[N@H+](CCOc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000268466696 463754579 /nfs/dbraw/zinc/75/45/79/463754579.db2.gz LUWMTEZYLPWERK-CYBMUJFWSA-N 1 1 331.376 2.280 20 5 EEBDMO Cc1n[nH]c([C@@H]2CCC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000268466696 463754583 /nfs/dbraw/zinc/75/45/83/463754583.db2.gz LUWMTEZYLPWERK-CYBMUJFWSA-N 1 1 331.376 2.280 20 5 EEBDMO C[C@@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000193896397 463755557 /nfs/dbraw/zinc/75/55/57/463755557.db2.gz PPJABOGLQRBWLE-VXGBXAGGSA-N 1 1 348.403 2.078 20 5 EEBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000287218779 463837073 /nfs/dbraw/zinc/83/70/73/463837073.db2.gz FRTWNSLBGSRMGD-WBVHZDCISA-N 1 1 346.431 2.406 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCCCCn2cc[nH+]c2C)n1 ZINC000287274110 463854196 /nfs/dbraw/zinc/85/41/96/463854196.db2.gz LKKQPCWVEUVBIB-UHFFFAOYSA-N 1 1 333.348 2.174 20 5 EEBDMO CC[C@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000185793995 463879790 /nfs/dbraw/zinc/87/97/90/463879790.db2.gz FVHXEIIGIFOUOD-ZDUSSCGKSA-N 1 1 341.433 2.138 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)NCCCn2cc[nH+]c2C)c1 ZINC000283513497 463911943 /nfs/dbraw/zinc/91/19/43/463911943.db2.gz PZHKTGUTFQWUKJ-UHFFFAOYSA-N 1 1 332.360 2.319 20 5 EEBDMO CCNC(=O)NC(=O)[C@@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000178726718 463953351 /nfs/dbraw/zinc/95/33/51/463953351.db2.gz NXGFUOSWMWPYLL-GFCCVEGCSA-N 1 1 336.392 2.039 20 5 EEBDMO CCOC(=O)C[N@H+](CC)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000195206329 464017367 /nfs/dbraw/zinc/01/73/67/464017367.db2.gz ZFQZMQIUTSQQNO-UHFFFAOYSA-N 1 1 337.376 2.117 20 5 EEBDMO CCOC(=O)C[N@@H+](CC)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000195206329 464017375 /nfs/dbraw/zinc/01/73/75/464017375.db2.gz ZFQZMQIUTSQQNO-UHFFFAOYSA-N 1 1 337.376 2.117 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCOC2)O1 ZINC000280233148 464194623 /nfs/dbraw/zinc/19/46/23/464194623.db2.gz AMSWLISBYZEAGP-RHSMWYFYSA-N 1 1 336.388 2.244 20 5 EEBDMO CNC(=O)c1ccc(N2CC[N@H+](C3CCC3)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000292429708 464230419 /nfs/dbraw/zinc/23/04/19/464230419.db2.gz XDBINBNIKWFCKX-ZDUSSCGKSA-N 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COC(=O)[C@]1(C)C[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000337423905 465360257 /nfs/dbraw/zinc/36/02/57/465360257.db2.gz CGIWNROGMOIPDR-NVGCLXPQSA-N 1 1 349.387 2.053 20 5 EEBDMO COC(=O)[C@]1(C)C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1C ZINC000337426227 465361161 /nfs/dbraw/zinc/36/11/61/465361161.db2.gz CXANSJNYXFDILC-QLJPJBMISA-N 1 1 332.360 2.102 20 5 EEBDMO COC(=O)[C@]1(C)C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1C ZINC000337426227 465361167 /nfs/dbraw/zinc/36/11/67/465361167.db2.gz CXANSJNYXFDILC-QLJPJBMISA-N 1 1 332.360 2.102 20 5 EEBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000298768411 465499715 /nfs/dbraw/zinc/49/97/15/465499715.db2.gz WLLAAQLDYYHEAD-ZBFHGGJFSA-N 1 1 332.404 2.363 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CNc1cc[nH+]c(N2CCCCC2)n1 ZINC000352392445 465525037 /nfs/dbraw/zinc/52/50/37/465525037.db2.gz UDMGSLLCRVQXLO-UHFFFAOYSA-N 1 1 343.387 2.996 20 5 EEBDMO COc1ccc(CNC(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000298912376 465539963 /nfs/dbraw/zinc/53/99/63/465539963.db2.gz DSQMMNSQQJRKEB-KGLIPLIRSA-N 1 1 348.403 2.029 20 5 EEBDMO C[N@H+]1CCCN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CC1 ZINC000299082039 465593022 /nfs/dbraw/zinc/59/30/22/465593022.db2.gz RBTAYDSVMICNMN-UHFFFAOYSA-N 1 1 343.387 2.317 20 5 EEBDMO C[C@@H]1[C@H](C)N(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C ZINC000356891859 465605950 /nfs/dbraw/zinc/60/59/50/465605950.db2.gz WNODDYSJFSRQPO-KGLIPLIRSA-N 1 1 334.420 2.338 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000371345458 465733201 /nfs/dbraw/zinc/73/32/01/465733201.db2.gz QTGIGUODLDNDOI-CYBMUJFWSA-N 1 1 340.383 2.453 20 5 EEBDMO C[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000340119077 465782392 /nfs/dbraw/zinc/78/23/92/465782392.db2.gz GNKGQIGQWONXBO-VIFPVBQESA-N 1 1 331.294 2.390 20 5 EEBDMO C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F 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/nfs/dbraw/zinc/99/84/42/465998442.db2.gz IUTJTWJZUYDPLQ-GOSISDBHSA-N 1 1 349.431 2.491 20 5 EEBDMO CC(C)(C)OC(=O)CN[C@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000349148151 465998452 /nfs/dbraw/zinc/99/84/52/465998452.db2.gz IUTJTWJZUYDPLQ-GOSISDBHSA-N 1 1 349.431 2.491 20 5 EEBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000301989195 466074096 /nfs/dbraw/zinc/07/40/96/466074096.db2.gz OKYXNFZTLORMEG-NSHDSACASA-N 1 1 329.360 2.062 20 5 EEBDMO Cc1cnc(N2CCC[C@@H]2C[NH+]2C[C@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000302512674 466149813 /nfs/dbraw/zinc/14/98/13/466149813.db2.gz OIFSOZILUUUPKG-SOUVJXGZSA-N 1 1 334.420 2.376 20 5 EEBDMO CC[C@H]1C[N@H+](C)CCCN1S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000349666828 466183264 /nfs/dbraw/zinc/18/32/64/466183264.db2.gz OQRCPMFORMGYJN-NSHDSACASA-N 1 1 347.462 2.070 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCCN1S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000349666828 466183268 /nfs/dbraw/zinc/18/32/68/466183268.db2.gz OQRCPMFORMGYJN-NSHDSACASA-N 1 1 347.462 2.070 20 5 EEBDMO COc1cc(C(=O)Nc2c[nH+]ccc2-n2cccn2)ccc1[N+](=O)[O-] ZINC000346879299 466219898 /nfs/dbraw/zinc/21/98/98/466219898.db2.gz MBTQEEYDNDNTRY-UHFFFAOYSA-N 1 1 339.311 2.436 20 5 EEBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@](O)(C(=O)N2CCCC2)C1 ZINC000331749018 466230688 /nfs/dbraw/zinc/23/06/88/466230688.db2.gz ZSVKDYRNHZRASU-KSSFIOAISA-N 1 1 347.415 2.105 20 5 EEBDMO COC(=O)C[C@@]1([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCOC1 ZINC000361740623 466249566 /nfs/dbraw/zinc/24/95/66/466249566.db2.gz JTZTVAKUVXFHDJ-AWEZNQCLSA-N 1 1 328.752 2.060 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1C(C)(C)O ZINC000305429768 466407462 /nfs/dbraw/zinc/40/74/62/466407462.db2.gz DIZRYZPUVVOIGZ-OAHLLOKOSA-N 1 1 335.404 2.467 20 5 EEBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+](C2CC2)C1 ZINC000341002632 466504741 /nfs/dbraw/zinc/50/47/41/466504741.db2.gz ODBBZSUEZQWXBU-AWEZNQCLSA-N 1 1 332.404 2.140 20 5 EEBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000354432891 466563865 /nfs/dbraw/zinc/56/38/65/466563865.db2.gz CGFYQFXNVTZURQ-AWEZNQCLSA-N 1 1 335.404 2.354 20 5 EEBDMO COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@@H](C)[N@H+]2CCc2ccc([N+](=O)[O-])cc2)O1 ZINC000374686896 466714765 /nfs/dbraw/zinc/71/47/65/466714765.db2.gz OVTGFIHDLCTAAJ-VZEFYGNVSA-N 1 1 348.399 2.321 20 5 EEBDMO CCOc1cccc(N2CCN([C@H]3CCC[N@@H+](C)C3)CC2)c1[N+](=O)[O-] ZINC000364943301 466724291 /nfs/dbraw/zinc/72/42/91/466724291.db2.gz KYHPVRPDJYPDEE-HNNXBMFYSA-N 1 1 348.447 2.210 20 5 EEBDMO O=C(CC[N@H+]1CC[C@H]([C@H]2CCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000370990034 467065753 /nfs/dbraw/zinc/06/57/53/467065753.db2.gz BIOSROJRLFSFII-KBPBESRZSA-N 1 1 333.388 2.282 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000427900148 467185103 /nfs/dbraw/zinc/18/51/03/467185103.db2.gz GRZKYWSLNFQLHM-BETUJISGSA-N 1 1 335.404 2.398 20 5 EEBDMO 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ZINC000178167242 463856038 /nfs/dbraw/zinc/85/60/38/463856038.db2.gz QRLMAIVXURXPQW-BETUJISGSA-N 1 1 334.420 2.275 20 5 EEBDMO Cc1[nH+]ccn1CCNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000269199009 463906705 /nfs/dbraw/zinc/90/67/05/463906705.db2.gz HDRHFZFRCJQUCX-UHFFFAOYSA-N 1 1 343.387 2.474 20 5 EEBDMO Cc1c(CC(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000278805042 463988329 /nfs/dbraw/zinc/98/83/29/463988329.db2.gz ZKLXCSIPMWRAAR-AWEZNQCLSA-N 1 1 349.431 2.063 20 5 EEBDMO C[N@H+]1CC[C@]2(CCN(c3ncc([N+](=O)[O-])cc3Br)C2)C1 ZINC000292408209 464222338 /nfs/dbraw/zinc/22/23/38/464222338.db2.gz VOHTYNJIXQDPJT-ZDUSSCGKSA-N 1 1 341.209 2.284 20 5 EEBDMO COc1cc(C[N@@H+]2CC[C@@H](CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180026094 464226099 /nfs/dbraw/zinc/22/60/99/464226099.db2.gz PQQSIOSBUFITTJ-SNVBAGLBSA-N 1 1 346.330 2.062 20 5 EEBDMO COc1cc(C[N@H+]2CC[C@@H](CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180026094 464226104 /nfs/dbraw/zinc/22/61/04/464226104.db2.gz PQQSIOSBUFITTJ-SNVBAGLBSA-N 1 1 346.330 2.062 20 5 EEBDMO CN(CC[C@H]1CCCC[N@H+]1C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000173641969 464298628 /nfs/dbraw/zinc/29/86/28/464298628.db2.gz WJHYJTWQLRNBTA-CQSZACIVSA-N 1 1 334.420 2.340 20 5 EEBDMO O=C(C[N@@H+]1CC[C@@H](C2CCC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000591062090 468401641 /nfs/dbraw/zinc/40/16/41/468401641.db2.gz VDZNILPJHOLSTK-GFCCVEGCSA-N 1 1 347.371 2.384 20 5 EEBDMO O=C(C[N@H+]1CC[C@@H](C2CCC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000591062090 468401644 /nfs/dbraw/zinc/40/16/44/468401644.db2.gz VDZNILPJHOLSTK-GFCCVEGCSA-N 1 1 347.371 2.384 20 5 EEBDMO Cc1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000281014885 464299632 /nfs/dbraw/zinc/29/96/32/464299632.db2.gz PBRREPSFULZHFL-ZDUSSCGKSA-N 1 1 335.408 2.153 20 5 EEBDMO C[N@H+]1CCC[C@@]2(CCN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)C1 ZINC000292841925 464361311 /nfs/dbraw/zinc/36/13/11/464361311.db2.gz BDDHIZBPPZQAKU-MRXNPFEDSA-N 1 1 334.376 2.421 20 5 EEBDMO COc1cc(C(=O)NC[C@H](C)Cn2cc[nH+]c2C)cc([N+](=O)[O-])c1C ZINC000189066018 464425776 /nfs/dbraw/zinc/42/57/76/464425776.db2.gz AGQAVHZJZBUBSO-NSHDSACASA-N 1 1 346.387 2.483 20 5 EEBDMO CC1(C)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCS1 ZINC000181978194 464543330 /nfs/dbraw/zinc/54/33/30/464543330.db2.gz WWHMSNWKFYPKDO-LBPRGKRZSA-N 1 1 326.418 2.162 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000246248129 464563494 /nfs/dbraw/zinc/56/34/94/464563494.db2.gz VZCVHPMKPHMTJS-GJZGRUSLSA-N 1 1 348.447 2.268 20 5 EEBDMO C[C@H](CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[NH+]1CCCCC1 ZINC000182243235 464608935 /nfs/dbraw/zinc/60/89/35/464608935.db2.gz GSSUCXNDAKFCDC-GFCCVEGCSA-N 1 1 345.403 2.465 20 5 EEBDMO C[C@H](c1ccncc1)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182287122 464620193 /nfs/dbraw/zinc/62/01/93/464620193.db2.gz IJIYPPHVUVEKAD-HIFRSBDPSA-N 1 1 331.372 2.423 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3cccc(Cl)c3)CC2)n1 ZINC000176189919 464715874 /nfs/dbraw/zinc/71/58/74/464715874.db2.gz XYMXGDXBEYVMNO-UHFFFAOYSA-N 1 1 335.795 2.267 20 5 EEBDMO Cn1cc([C@H]2CSCC[N@@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000191201412 464796351 /nfs/dbraw/zinc/79/63/51/464796351.db2.gz NQAXASXXNAOYJG-CVEARBPZSA-N 1 1 348.428 2.152 20 5 EEBDMO Cn1cc([C@H]2CSCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000191201412 464796355 /nfs/dbraw/zinc/79/63/55/464796355.db2.gz NQAXASXXNAOYJG-CVEARBPZSA-N 1 1 348.428 2.152 20 5 EEBDMO COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)[N@@H+]2Cc2ccccc2[N+](=O)[O-])O1 ZINC000282486924 464837581 /nfs/dbraw/zinc/83/75/81/464837581.db2.gz PKQQSXLQRDNENA-MPESAESLSA-N 1 1 334.372 2.278 20 5 EEBDMO COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)[N@H+]2Cc2ccccc2[N+](=O)[O-])O1 ZINC000282486924 464837589 /nfs/dbraw/zinc/83/75/89/464837589.db2.gz PKQQSXLQRDNENA-MPESAESLSA-N 1 1 334.372 2.278 20 5 EEBDMO CCN(CCn1cc([N+](=O)[O-])cn1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000183761757 464906777 /nfs/dbraw/zinc/90/67/77/464906777.db2.gz HETAEXJVLAOYBC-KRWDZBQOSA-N 1 1 343.431 2.388 20 5 EEBDMO CC[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000183761757 464906782 /nfs/dbraw/zinc/90/67/82/464906782.db2.gz HETAEXJVLAOYBC-KRWDZBQOSA-N 1 1 343.431 2.388 20 5 EEBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000183761757 464906790 /nfs/dbraw/zinc/90/67/90/464906790.db2.gz HETAEXJVLAOYBC-KRWDZBQOSA-N 1 1 343.431 2.388 20 5 EEBDMO C[N@@H+](CCCO)C1CCN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000286504352 464942035 /nfs/dbraw/zinc/94/20/35/464942035.db2.gz RLYQSDBQHSXRTM-UHFFFAOYSA-N 1 1 343.374 2.152 20 5 EEBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000286606232 464975964 /nfs/dbraw/zinc/97/59/64/464975964.db2.gz RISSATXPSDPGEB-BOOVAVIHSA-N 1 1 333.344 2.358 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000268261465 464996208 /nfs/dbraw/zinc/99/62/08/464996208.db2.gz ZIGPOUILBKPTBQ-BDJLRTHQSA-N 1 1 344.415 2.382 20 5 EEBDMO CC[C@H](C)[N@@H+](CCO)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000286730779 465016906 /nfs/dbraw/zinc/01/69/06/465016906.db2.gz BORHHSUILNZFDR-NSHDSACASA-N 1 1 327.356 2.155 20 5 EEBDMO C[C@@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+]1Cc1ccccc1 ZINC000554641044 468435348 /nfs/dbraw/zinc/43/53/48/468435348.db2.gz FNCRWOULHWLTJR-CZUORRHYSA-N 1 1 342.399 2.326 20 5 EEBDMO Cn1nc([N+](=O)[O-])cc1C(=O)Nc1cccc(CC[N@@H+](C)C2CC2)c1 ZINC000356747470 465517835 /nfs/dbraw/zinc/51/78/35/465517835.db2.gz RQZQJLFQWZPBCI-UHFFFAOYSA-N 1 1 343.387 2.217 20 5 EEBDMO CC(C)[N@H+](C)C[C@H](C)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000356750007 465519311 /nfs/dbraw/zinc/51/93/11/465519311.db2.gz ZFZFJLCBPCNHFM-ZDUSSCGKSA-N 1 1 345.403 2.239 20 5 EEBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000299078797 465590343 /nfs/dbraw/zinc/59/03/43/465590343.db2.gz IREDOTNTEBHKCG-UONOGXRCSA-N 1 1 335.404 2.210 20 5 EEBDMO CC1(C)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC[N@@H+]1Cc1ccccc1 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RYKDIINYJLMVNA-GWCFXTLKSA-N 1 1 338.389 2.495 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)NCCn1cc[nH+]c1C(C)C ZINC001318598026 1332566074 /nfs/dbraw/zinc/56/60/74/1332566074.db2.gz BJOJJTNTNOEVBP-UHFFFAOYSA-N 1 1 331.376 2.386 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001322194420 1333225145 /nfs/dbraw/zinc/22/51/45/1333225145.db2.gz LNKWGXRGGXFYSG-CABCVRRESA-N 1 1 330.388 2.247 20 5 EEBDMO C[N@@H+](Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[C@@H](CO)CC(C)(C)C ZINC001609278823 1351919880 /nfs/dbraw/zinc/91/98/80/1351919880.db2.gz XXHXWGAXJUYERB-CYBMUJFWSA-N 1 1 348.407 2.004 20 5 EEBDMO O=C1N(C[N@@H+]2CCC[C@@H](CF)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC001333809633 1336138276 /nfs/dbraw/zinc/13/82/76/1336138276.db2.gz WNWFJFIWYSPBLW-ZDUSSCGKSA-N 1 1 336.367 2.476 20 5 EEBDMO O=C1N(C[N@H+]2CCC[C@@H](CF)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC001333809633 1336138279 /nfs/dbraw/zinc/13/82/79/1336138279.db2.gz WNWFJFIWYSPBLW-ZDUSSCGKSA-N 1 1 336.367 2.476 20 5 EEBDMO C[C@@]([NH3+])(C(=O)Nc1ccnc(C2(C)CC2)n1)c1cccc([N+](=O)[O-])c1 ZINC001576565199 1344032860 /nfs/dbraw/zinc/03/28/60/1344032860.db2.gz QPWWUPALTNCLJX-KRWDZBQOSA-N 1 1 341.371 2.249 20 5 EEBDMO C[C@H]1CCC[N@H+]1CCN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000780768601 1369485054 /nfs/dbraw/zinc/48/50/54/1369485054.db2.gz ROWHRPPOULCOLH-YOEHRIQHSA-N 1 1 343.431 2.492 20 5 EEBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001116164862 1371721833 /nfs/dbraw/zinc/72/18/33/1371721833.db2.gz SKNGNNLHELUZSX-GFCCVEGCSA-N 1 1 330.388 2.104 20 5 EEBDMO [NH3+][C@H]1CCc2ccccc2N(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC001580203439 1403846556 /nfs/dbraw/zinc/84/65/56/1403846556.db2.gz KHPAAPRPKSKPNR-ZDUSSCGKSA-N 1 1 327.340 2.221 20 5 EEBDMO C[N@@H+](CCCNC(=O)c1ccns1)Cc1ccccc1[N+](=O)[O-] ZINC001751984912 1406164231 /nfs/dbraw/zinc/16/42/31/1406164231.db2.gz BZSKHVWIDBDZFU-UHFFFAOYSA-N 1 1 334.401 2.303 20 5 EEBDMO O=[N+]([O-])c1ccnc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164725219 720332723 /nfs/dbraw/zinc/33/27/23/720332723.db2.gz MRDCRFZJXFWONI-HOTGVXAUSA-N 1 1 325.372 2.238 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCCN(CC)c1cccc(F)c1[N+](=O)[O-] ZINC001100576452 760306032 /nfs/dbraw/zinc/30/60/32/760306032.db2.gz CTAALDULUHDSFC-UHFFFAOYSA-N 1 1 340.399 2.018 20 5 EEBDMO CCN(CCNc1cc(C)ccc1[N+](=O)[O-])C(=O)Cn1c[nH+]cc1C ZINC001106891221 769259815 /nfs/dbraw/zinc/25/98/15/769259815.db2.gz BCZYGKVEPKSXGA-UHFFFAOYSA-N 1 1 345.403 2.369 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)N(C)CCN(C)c1cc(C)ccc1[N+](=O)[O-] ZINC001105404987 782744263 /nfs/dbraw/zinc/74/42/63/782744263.db2.gz DZHGPXYHGWCQKX-UHFFFAOYSA-N 1 1 345.403 2.003 20 5 EEBDMO Cc1nscc1C(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001031624598 770412568 /nfs/dbraw/zinc/41/25/68/770412568.db2.gz OYJXRIGDRQPHQS-UHFFFAOYSA-N 1 1 346.412 2.222 20 5 EEBDMO Cc1cc(N(C)CCN(C)C(=O)C[N@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC001105415263 783184251 /nfs/dbraw/zinc/18/42/51/783184251.db2.gz KPSGJFBDESCFEK-UHFFFAOYSA-N 1 1 336.436 2.138 20 5 EEBDMO Cc1cocc1C(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001031900820 779021929 /nfs/dbraw/zinc/02/19/29/779021929.db2.gz DEDLCBYSDWVVRT-UHFFFAOYSA-N 1 1 329.356 2.358 20 5 EEBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N(C)C[C@@H]1CCC[N@H+]1C ZINC000817131827 784527410 /nfs/dbraw/zinc/52/74/10/784527410.db2.gz RDDHVLGIGKLQSE-NSHDSACASA-N 1 1 339.367 2.441 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)NC/C=C/CNc1cccc(F)c1[N+](=O)[O-] ZINC001107200747 786371947 /nfs/dbraw/zinc/37/19/47/786371947.db2.gz SMTDHBGMLILMSA-NSCUHMNNSA-N 1 1 347.350 2.023 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)NC/C=C\CNc1cccc(F)c1[N+](=O)[O-] ZINC001107200746 786371978 /nfs/dbraw/zinc/37/19/78/786371978.db2.gz SMTDHBGMLILMSA-IHWYPQMZSA-N 1 1 347.350 2.023 20 5 EEBDMO COc1cc(Cc2noc([C@@H]3CCCC[NH2+]3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000823145879 787565058 /nfs/dbraw/zinc/56/50/58/787565058.db2.gz JXXYZJDGZFVXQZ-LBPRGKRZSA-N 1 1 348.359 2.400 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(NCCCN(C)C(=O)C[N@@H+](C)C2CCC2)n1 ZINC001109653501 805831016 /nfs/dbraw/zinc/83/10/16/805831016.db2.gz YZYNCYXYBVEHRC-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO O=[N+]([O-])c1ccc(CNC[C@H]2CCC[N@H+]2CCCO)cc1Cl ZINC000824565478 788216891 /nfs/dbraw/zinc/21/68/91/788216891.db2.gz WTRAXPUDLCNBGV-CYBMUJFWSA-N 1 1 327.812 2.185 20 5 EEBDMO O=[N+]([O-])c1ccc(CNC[C@H]2CCC[N@@H+]2CCCO)cc1Cl ZINC000824565478 788216904 /nfs/dbraw/zinc/21/69/04/788216904.db2.gz WTRAXPUDLCNBGV-CYBMUJFWSA-N 1 1 327.812 2.185 20 5 EEBDMO COC/C(C)=C\C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000845574336 789849390 /nfs/dbraw/zinc/84/93/90/789849390.db2.gz AQVYGYGFVMLNRK-RQPMMQJISA-N 1 1 334.372 2.305 20 5 EEBDMO COC/C(C)=C\C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000845574336 789849393 /nfs/dbraw/zinc/84/93/93/789849393.db2.gz AQVYGYGFVMLNRK-RQPMMQJISA-N 1 1 334.372 2.305 20 5 EEBDMO Cc1nn(CCC(=O)OC[C@H]2CC[N@H+]2C(C)(C)C)c(C)c1[N+](=O)[O-] ZINC000845735128 789928744 /nfs/dbraw/zinc/92/87/44/789928744.db2.gz KXDOSYJOVIBADX-CYBMUJFWSA-N 1 1 338.408 2.214 20 5 EEBDMO O=[N+]([O-])c1ccc2nc(NCC3([NH+]4CCCC4)COC3)ccc2c1 ZINC001168442331 794192324 /nfs/dbraw/zinc/19/23/24/794192324.db2.gz KLSZTZJDEDBVNW-UHFFFAOYSA-N 1 1 328.372 2.420 20 5 EEBDMO CC1(C)CC[N@@H+](CC(=O)NCCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC001094784375 796578272 /nfs/dbraw/zinc/57/82/72/796578272.db2.gz RIHZRPBEZFRLEW-UHFFFAOYSA-N 1 1 334.420 2.245 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCO[C@@H]3C[C@H](CO)C[C@@H]31)CC2 ZINC001172903917 797130989 /nfs/dbraw/zinc/13/09/89/797130989.db2.gz JPBWNKYBVUSKMW-VLDUQVBPSA-N 1 1 346.427 2.314 20 5 EEBDMO O=C(NC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1)c1ccns1 ZINC001002934071 798852170 /nfs/dbraw/zinc/85/21/70/798852170.db2.gz GOCWXDWIGHKJFE-UHFFFAOYSA-N 1 1 346.412 2.446 20 5 EEBDMO COc1ccccc1C1([NH3+])CCN([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168994586 803561529 /nfs/dbraw/zinc/56/15/29/803561529.db2.gz QEKYAHZLPWZAEN-CABCVRRESA-N 1 1 333.432 2.390 20 5 EEBDMO CC(C)(C)OC(=O)N1C[C@@H]2CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]21 ZINC001169010298 803570905 /nfs/dbraw/zinc/57/09/05/803570905.db2.gz CMPXHEAJXRZUQG-AJNGGQMLSA-N 1 1 339.436 2.373 20 5 EEBDMO CC(C)(C)OC(=O)NCC12CC(C1)C[N@H+]2[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169014051 803571717 /nfs/dbraw/zinc/57/17/17/803571717.db2.gz YNKKAHLUKYIYIG-SMOJQAGNSA-N 1 1 339.436 2.421 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2C[C@H](Oc3cccnc3)[C@H]3OCCC[C@@H]32)C1 ZINC001169017521 803586670 /nfs/dbraw/zinc/58/66/70/803586670.db2.gz AGMLSBVTPANWPD-YFUQURRKSA-N 1 1 347.415 2.138 20 5 EEBDMO Cn1cc2c(n1)C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C[C@@H]2COCC1CC1 ZINC001169025270 803591186 /nfs/dbraw/zinc/59/11/86/803591186.db2.gz YITFROKIBPZILZ-BZUAXINKSA-N 1 1 348.447 2.191 20 5 EEBDMO Cn1cc2c(n1)C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C[C@@H]2COCC1CC1 ZINC001169025270 803591191 /nfs/dbraw/zinc/59/11/91/803591191.db2.gz YITFROKIBPZILZ-BZUAXINKSA-N 1 1 348.447 2.191 20 5 EEBDMO O=C1NCC[C@]12C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C[C@H]2c1ccccc1 ZINC001169026766 803592246 /nfs/dbraw/zinc/59/22/46/803592246.db2.gz NVPCAAMZRGGINN-VYCZESIESA-N 1 1 343.427 2.038 20 5 EEBDMO O=C(N[C@@H]1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1)c1cccc(F)c1 ZINC001169054890 803597198 /nfs/dbraw/zinc/59/71/98/803597198.db2.gz OBTJKOWJCUKXEF-IAOVAPTHSA-N 1 1 349.406 2.465 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC000789802205 808203816 /nfs/dbraw/zinc/20/38/16/808203816.db2.gz WAHRIPRDXZEXAX-CQSZACIVSA-N 1 1 336.392 2.050 20 5 EEBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)NNc1cccc(F)c1[N+](=O)[O-] ZINC000790610373 808846509 /nfs/dbraw/zinc/84/65/09/808846509.db2.gz ZRXIXGAZRMHKRC-SNVBAGLBSA-N 1 1 341.412 2.009 20 5 EEBDMO CCOC(=O)C1C[NH2+]CCC1=Nc1ccc([N+](=O)[O-])cc1OCC ZINC001170517928 812090539 /nfs/dbraw/zinc/09/05/39/812090539.db2.gz VTAKIIZTZHMLPV-UHFFFAOYSA-N 1 1 335.360 2.216 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[NH+](Cc2ccco2)Cc2ccco2)c1 ZINC000174706751 231285472 /nfs/dbraw/zinc/28/54/72/231285472.db2.gz ZWWPIKSVFMFKCQ-CQSZACIVSA-N 1 1 346.343 2.041 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)N(C)CC[N@@H+](C)C2CC2)cccc1[N+](=O)[O-] ZINC000186796624 236024133 /nfs/dbraw/zinc/02/41/33/236024133.db2.gz QFCUQFIYMZKJAV-ZDUSSCGKSA-N 1 1 334.420 2.256 20 5 EEBDMO CSc1ccc(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-] ZINC000425046095 241108906 /nfs/dbraw/zinc/10/89/06/241108906.db2.gz KODJBKPAEZKFEQ-GXTWGEPZSA-N 1 1 335.429 2.483 20 5 EEBDMO C[S@](=O)c1ccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000425974054 241193556 /nfs/dbraw/zinc/19/35/56/241193556.db2.gz BUTMGMQCAARRPU-DEOSSOPVSA-N 1 1 348.428 2.366 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCC[C@H]1C[C@@H](C)O ZINC000447825917 242322195 /nfs/dbraw/zinc/32/21/95/242322195.db2.gz FMVPSILPBQPURI-KGLIPLIRSA-N 1 1 335.404 2.467 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCCC[C@H]1C[C@@H](C)O ZINC000447825917 242322199 /nfs/dbraw/zinc/32/21/99/242322199.db2.gz FMVPSILPBQPURI-KGLIPLIRSA-N 1 1 335.404 2.467 20 5 EEBDMO CCO[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000451552213 243156818 /nfs/dbraw/zinc/15/68/18/243156818.db2.gz YKPULHQATLZVTB-OFQRWUPVSA-N 1 1 338.404 2.081 20 5 EEBDMO O=C(CC[N@H+]1CC[C@@H]2C[C@@H](O)CC[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000451700628 243213645 /nfs/dbraw/zinc/21/36/45/243213645.db2.gz YBOCSNKENDVOPX-ILXRZTDVSA-N 1 1 347.415 2.406 20 5 EEBDMO CN(C)CC(C)(C)[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000459551180 245164461 /nfs/dbraw/zinc/16/44/61/245164461.db2.gz RJYWPBLYLULPRF-UHFFFAOYSA-N 1 1 328.800 2.117 20 5 EEBDMO Cc1c(NC(=O)NC2CC[NH+](CCN(C)C)CC2)cccc1[N+](=O)[O-] ZINC000079085380 217189216 /nfs/dbraw/zinc/18/92/16/217189216.db2.gz QMEGQLCRQNFSPJ-UHFFFAOYSA-N 1 1 349.435 2.051 20 5 EEBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000079458544 217227047 /nfs/dbraw/zinc/22/70/47/217227047.db2.gz HUYMTBOUFKSVPR-ZDUSSCGKSA-N 1 1 332.404 2.221 20 5 EEBDMO CN(C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1 ZINC000491687203 246110688 /nfs/dbraw/zinc/11/06/88/246110688.db2.gz UWLIZJBCNIPFHJ-YFUKIHRRSA-N 1 1 333.363 2.442 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@H]2CCC[C@@H]21 ZINC000265101163 247203453 /nfs/dbraw/zinc/20/34/53/247203453.db2.gz DXQRCGNTDFBZAD-JKSUJKDBSA-N 1 1 333.388 2.485 20 5 EEBDMO CN(C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[C@H]1CCC[N@@H+](C)C1 ZINC000266131425 248118148 /nfs/dbraw/zinc/11/81/48/248118148.db2.gz MQLUTZBEBFIDFA-HNNXBMFYSA-N 1 1 330.388 2.102 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)c1 ZINC000267448509 256060308 /nfs/dbraw/zinc/06/03/08/256060308.db2.gz LMTBGRKWCJMDAB-OCCSQVGLSA-N 1 1 336.417 2.441 20 5 EEBDMO C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)CC[N@H+]1Cc1ccccc1 ZINC000267512059 256065458 /nfs/dbraw/zinc/06/54/58/256065458.db2.gz MCAIDWBWYKFAGY-GXTWGEPZSA-N 1 1 342.403 2.432 20 5 EEBDMO COCCC[N@H+](CCOC)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000271137320 256211807 /nfs/dbraw/zinc/21/18/07/256211807.db2.gz UONALRZPWLSLNN-UHFFFAOYSA-N 1 1 342.392 2.097 20 5 EEBDMO COCCC[N@@H+](CCOC)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000271137320 256211808 /nfs/dbraw/zinc/21/18/08/256211808.db2.gz UONALRZPWLSLNN-UHFFFAOYSA-N 1 1 342.392 2.097 20 5 EEBDMO Cc1nnc([C@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])s1 ZINC000273617777 256312449 /nfs/dbraw/zinc/31/24/49/256312449.db2.gz PUHCYWSXHLZSQI-VIFPVBQESA-N 1 1 335.389 2.434 20 5 EEBDMO COC(=O)CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@@H]1CCCO1 ZINC000078728204 292193190 /nfs/dbraw/zinc/19/31/90/292193190.db2.gz ZDAGWARMEZPLIT-HNNXBMFYSA-N 1 1 336.388 2.447 20 5 EEBDMO CC(C)[N@@H+](C)CCNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116763644 152061700 /nfs/dbraw/zinc/06/17/00/152061700.db2.gz QHPGCXPKHFQUTB-UHFFFAOYSA-N 1 1 343.811 2.474 20 5 EEBDMO CCCc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)c1[N+](=O)[O-] ZINC000173258916 152154396 /nfs/dbraw/zinc/15/43/96/152154396.db2.gz ZGPIOKQYFARKLH-ZDUSSCGKSA-N 1 1 349.435 2.265 20 5 EEBDMO C[NH+](C)Cc1cc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)no1 ZINC000359436171 153362079 /nfs/dbraw/zinc/36/20/79/153362079.db2.gz IQDJTCRHHXDLBU-UHFFFAOYSA-N 1 1 346.387 2.397 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000072672445 159043696 /nfs/dbraw/zinc/04/36/96/159043696.db2.gz ZUAOXJSWWMDONC-HNNXBMFYSA-N 1 1 336.392 2.073 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])C(C)C ZINC000102481131 159265196 /nfs/dbraw/zinc/26/51/96/159265196.db2.gz IUWQSFMFNXBOHW-UHFFFAOYSA-N 1 1 339.392 2.072 20 5 EEBDMO Cc1cc([C@H]2CCC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])on1 ZINC000342695756 161083765 /nfs/dbraw/zinc/08/37/65/161083765.db2.gz PZIDNOCTJOMPAE-UONOGXRCSA-N 1 1 347.371 2.468 20 5 EEBDMO C[C@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[N@H+]1CCCC[C@@H]1C ZINC000343066167 161099784 /nfs/dbraw/zinc/09/97/84/161099784.db2.gz CYDYHXBYAJUJMQ-NWDGAFQWSA-N 1 1 345.403 2.464 20 5 EEBDMO CC[C@@]1(C)CC[N@@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000343667427 161156772 /nfs/dbraw/zinc/15/67/72/161156772.db2.gz HNBXIWYEWSCCNE-YOEHRIQHSA-N 1 1 331.372 2.349 20 5 EEBDMO CC[C@@]1(C)CC[N@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000343667427 161156773 /nfs/dbraw/zinc/15/67/73/161156773.db2.gz HNBXIWYEWSCCNE-YOEHRIQHSA-N 1 1 331.372 2.349 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](CO)C[C@@H]1C ZINC000344132119 161200896 /nfs/dbraw/zinc/20/08/96/161200896.db2.gz OSPGPMWPLZFMIE-UONOGXRCSA-N 1 1 335.404 2.325 20 5 EEBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)N1CCN(C)CC1 ZINC000344851192 161250732 /nfs/dbraw/zinc/25/07/32/161250732.db2.gz LEWRHHOPQDYELT-RBFDBLARSA-N 1 1 332.448 2.224 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000352868763 162321662 /nfs/dbraw/zinc/32/16/62/162321662.db2.gz DLZCKCSKFZQPAU-OLZOCXBDSA-N 1 1 341.433 2.088 20 5 EEBDMO CC(C)[C@@]1(CO)CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000368067822 166045786 /nfs/dbraw/zinc/04/57/86/166045786.db2.gz BFFXDFVFERNOJT-KRWDZBQOSA-N 1 1 346.387 2.485 20 5 EEBDMO CC(C)[C@@]1(CO)CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000368067822 166045787 /nfs/dbraw/zinc/04/57/87/166045787.db2.gz BFFXDFVFERNOJT-KRWDZBQOSA-N 1 1 346.387 2.485 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000364091256 165020315 /nfs/dbraw/zinc/02/03/15/165020315.db2.gz RIGIMQHSWUSMTR-KBPBESRZSA-N 1 1 348.403 2.196 20 5 EEBDMO Cc1ccc([C@]2(C)CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000370028262 166380615 /nfs/dbraw/zinc/38/06/15/166380615.db2.gz CJUPNDZJLRLKRE-QZTJIDSGSA-N 1 1 344.415 2.124 20 5 EEBDMO C[C@@H]1C[C@H](N2CCCC2)C[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000375739330 167181978 /nfs/dbraw/zinc/18/19/78/167181978.db2.gz ZZMPZPYXZVCWRR-CABCVRRESA-N 1 1 346.431 2.482 20 5 EEBDMO C[C@@H]1C[C@H](N2CCCC2)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000375739330 167181982 /nfs/dbraw/zinc/18/19/82/167181982.db2.gz ZZMPZPYXZVCWRR-CABCVRRESA-N 1 1 346.431 2.482 20 5 EEBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@@H]1CCC[C@@H]1O ZINC000270132276 268792238 /nfs/dbraw/zinc/79/22/38/268792238.db2.gz OSWRSJSIEIIDDC-JSGCOSHPSA-N 1 1 332.360 2.238 20 5 EEBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@@H]1CCC[C@@H]1O ZINC000270132276 268792240 /nfs/dbraw/zinc/79/22/40/268792240.db2.gz OSWRSJSIEIIDDC-JSGCOSHPSA-N 1 1 332.360 2.238 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)Cn3ccc4cc([N+](=O)[O-])ccc43)[C@H]2C1 ZINC000272504206 268984233 /nfs/dbraw/zinc/98/42/33/268984233.db2.gz ODXFQBZELXOFTM-DYVFJYSZSA-N 1 1 342.399 2.102 20 5 EEBDMO COc1cc(N[C@H](C)CCN2CC[NH+](C)CC2)c(F)cc1[N+](=O)[O-] ZINC000274441086 269033559 /nfs/dbraw/zinc/03/35/59/269033559.db2.gz GTLNMPAMQSDULR-GFCCVEGCSA-N 1 1 340.399 2.180 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCNc2ccc([N+](=O)[O-])c(N)c2F)CCCO1 ZINC000277581012 269161950 /nfs/dbraw/zinc/16/19/50/269161950.db2.gz BVLBULSXDWJDAK-LLVKDONJSA-N 1 1 326.372 2.229 20 5 EEBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000277635860 269166130 /nfs/dbraw/zinc/16/61/30/269166130.db2.gz XOZHCZITZWQEKU-OAHLLOKOSA-N 1 1 346.431 2.408 20 5 EEBDMO COc1ccc(CNCCC[N@H+]2CCCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000277730706 269176210 /nfs/dbraw/zinc/17/62/10/269176210.db2.gz JPNZHSCHBVOQBS-CQSZACIVSA-N 1 1 337.420 2.194 20 5 EEBDMO COc1ccc(C[NH2+]CCCN2CCCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000277730706 269176212 /nfs/dbraw/zinc/17/62/12/269176212.db2.gz JPNZHSCHBVOQBS-CQSZACIVSA-N 1 1 337.420 2.194 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C3CCOCC3)C[C@H]2C)c1 ZINC000278840089 269245847 /nfs/dbraw/zinc/24/58/47/269245847.db2.gz KVHIXKIRCZPDTO-CQSZACIVSA-N 1 1 347.415 2.229 20 5 EEBDMO CO[C@]1(C)CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000280252641 269342765 /nfs/dbraw/zinc/34/27/65/269342765.db2.gz BNYOKZSXMCGWLI-RHSMWYFYSA-N 1 1 338.404 2.226 20 5 EEBDMO Cc1ccc([C@H]2CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C2)c(C)c1 ZINC000280311240 269349654 /nfs/dbraw/zinc/34/96/54/269349654.db2.gz GDFVXXMNWKWBEY-DOTOQJQBSA-N 1 1 344.415 2.259 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1C(=O)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000278274753 274342690 /nfs/dbraw/zinc/34/26/90/274342690.db2.gz FSBTUTGQRQMBEK-AWEZNQCLSA-N 1 1 335.404 2.134 20 5 EEBDMO Cc1cc(C(=O)N2CC[N@@H+](C3CCOCC3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000278474140 274361627 /nfs/dbraw/zinc/36/16/27/274361627.db2.gz JTQZPDRCVFRGAB-CQSZACIVSA-N 1 1 347.415 2.229 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1[nH]nc(CCC)c1[N+](=O)[O-] ZINC000290772333 275238010 /nfs/dbraw/zinc/23/80/10/275238010.db2.gz BUKPISZTYHBHQJ-NSHDSACASA-N 1 1 325.413 2.121 20 5 EEBDMO COc1ccc(C[NH2+][C@@]2(CO)CCOc3ccccc32)cc1[N+](=O)[O-] ZINC000281602257 292769810 /nfs/dbraw/zinc/76/98/10/292769810.db2.gz FXLCYYJHFFZKOA-GOSISDBHSA-N 1 1 344.367 2.363 20 5 EEBDMO CC[N@@H+](Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])[C@@H](C)CO ZINC000293522141 293229495 /nfs/dbraw/zinc/22/94/95/293229495.db2.gz WERAHKARIPTMNS-JTQLQIEISA-N 1 1 348.346 2.450 20 5 EEBDMO COCC[N@@H+](C)CCCNC(=O)Nc1cc([N+](=O)[O-])c(C)cc1F ZINC000296609365 294020424 /nfs/dbraw/zinc/02/04/24/294020424.db2.gz APPYJRQZMMVKOE-UHFFFAOYSA-N 1 1 342.371 2.132 20 5 EEBDMO CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@H]1CCC[N@H+]1C ZINC000420996833 314018711 /nfs/dbraw/zinc/01/87/11/314018711.db2.gz GAZXQEGCLCTJEP-CQSZACIVSA-N 1 1 331.376 2.171 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](CCO)CC1 ZINC000421019268 314028269 /nfs/dbraw/zinc/02/82/69/314028269.db2.gz PIUSHAANKWFVQX-ZIAGYGMSSA-N 1 1 335.404 2.406 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000448879312 315396165 /nfs/dbraw/zinc/39/61/65/315396165.db2.gz ZJHUQWIGEUOUKY-ZDUSSCGKSA-N 1 1 345.403 2.241 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000545194379 318206648 /nfs/dbraw/zinc/20/66/48/318206648.db2.gz USEGHKHIGNGBAY-XJKSGUPXSA-N 1 1 342.399 2.184 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000574355500 320017621 /nfs/dbraw/zinc/01/76/21/320017621.db2.gz WMSYLXAKELGNJG-HOTGVXAUSA-N 1 1 343.383 2.219 20 5 EEBDMO C[C@@H]1COCC[N@@H+]1C1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000576574478 320184057 /nfs/dbraw/zinc/18/40/57/320184057.db2.gz OZQDQISWIICNSR-OAHLLOKOSA-N 1 1 333.432 2.322 20 5 EEBDMO C[C@@H]1COCC[N@H+]1C1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000576574478 320184060 /nfs/dbraw/zinc/18/40/60/320184060.db2.gz OZQDQISWIICNSR-OAHLLOKOSA-N 1 1 333.432 2.322 20 5 EEBDMO C[N@@H+]1CCCC[C@H]1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000609549115 450048067 /nfs/dbraw/zinc/04/80/67/450048067.db2.gz JHICBQLKLZWFOP-AWEZNQCLSA-N 1 1 329.360 2.408 20 5 EEBDMO C[N@H+]1CCCC[C@H]1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000609549115 450048073 /nfs/dbraw/zinc/04/80/73/450048073.db2.gz JHICBQLKLZWFOP-AWEZNQCLSA-N 1 1 329.360 2.408 20 5 EEBDMO O=[N+]([O-])c1c(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)ccc2ncccc21 ZINC000325861807 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Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](CO)c1cccc(F)c1 ZINC000359546318 465446976 /nfs/dbraw/zinc/44/69/76/465446976.db2.gz ZVAIVWPBHNNEFC-AWEZNQCLSA-N 1 1 347.346 2.304 20 5 EEBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(c2nc3sccn3c2[N+](=O)[O-])C1 ZINC000348180127 465474894 /nfs/dbraw/zinc/47/48/94/465474894.db2.gz KVNMMJSRBZRANM-GFCCVEGCSA-N 1 1 335.433 2.472 20 5 EEBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)cc1F ZINC000348213019 465493113 /nfs/dbraw/zinc/49/31/13/465493113.db2.gz VIIHBZVTJDQVNB-UHFFFAOYSA-N 1 1 343.318 2.486 20 5 EEBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000330584254 465718016 /nfs/dbraw/zinc/71/80/16/465718016.db2.gz KWWQPNKTXWXCAZ-RYUDHWBXSA-N 1 1 331.376 2.169 20 5 EEBDMO CNc1c(C(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000361125160 465782684 /nfs/dbraw/zinc/78/26/84/465782684.db2.gz VRJSZRYDBODQPS-STQMWFEESA-N 1 1 334.420 2.487 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000338056215 465786043 /nfs/dbraw/zinc/78/60/43/465786043.db2.gz GKDSBOLMLDBLDY-HIFRSBDPSA-N 1 1 346.431 2.404 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)cccc1[N+](=O)[O-] ZINC000593993243 468454130 /nfs/dbraw/zinc/45/41/30/468454130.db2.gz FKEFZQYOZMWCCK-SOUVJXGZSA-N 1 1 346.431 2.399 20 5 EEBDMO CC(C)[N@@H+]1C[C@@H](C)[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000362562522 465833815 /nfs/dbraw/zinc/83/38/15/465833815.db2.gz ZKCNEZOMJYLAKY-BXUZGUMPSA-N 1 1 331.376 2.785 20 5 EEBDMO CC(C)[N@H+]1C[C@@H](C)[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000362562522 465833825 /nfs/dbraw/zinc/83/38/25/465833825.db2.gz ZKCNEZOMJYLAKY-BXUZGUMPSA-N 1 1 331.376 2.785 20 5 EEBDMO CN(C(=O)C[N@H+]1CCC[C@@H]1C1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000348921097 465875191 /nfs/dbraw/zinc/87/51/91/465875191.db2.gz QMXWCZDQOVTEIB-QGZVFWFLSA-N 1 1 347.415 2.449 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@H](CO)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000353508891 465942842 /nfs/dbraw/zinc/94/28/42/465942842.db2.gz HNPDKVHWVNOYOJ-HOCLYGCPSA-N 1 1 330.388 2.026 20 5 EEBDMO CC(C)[C@](C)(O)C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000353523470 465951288 /nfs/dbraw/zinc/95/12/88/465951288.db2.gz ULWMRDSNGFWVCY-DOTOQJQBSA-N 1 1 332.404 2.414 20 5 EEBDMO CCCc1n[nH]c(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000346181859 465968087 /nfs/dbraw/zinc/96/80/87/465968087.db2.gz BWZGCKUQZFFGSZ-MBNYWOFBSA-N 1 1 349.435 2.073 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[N@@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000346181859 465968091 /nfs/dbraw/zinc/96/80/91/465968091.db2.gz BWZGCKUQZFFGSZ-MBNYWOFBSA-N 1 1 349.435 2.073 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000346181859 465968101 /nfs/dbraw/zinc/96/81/01/465968101.db2.gz BWZGCKUQZFFGSZ-MBNYWOFBSA-N 1 1 349.435 2.073 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]CCc1cnccn1)c1ccc([N+](=O)[O-])cc1 ZINC000353588262 465996996 /nfs/dbraw/zinc/99/69/96/465996996.db2.gz CYGZRUKZLNCRHX-MRXNPFEDSA-N 1 1 338.371 2.040 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)C[C@H]1[C@@H](C)O ZINC000331273594 466007278 /nfs/dbraw/zinc/00/72/78/466007278.db2.gz CYTTWIGUVZEWIF-GHJWDPDVSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)C[C@H]1[C@@H](C)O ZINC000331273594 466007285 /nfs/dbraw/zinc/00/72/85/466007285.db2.gz CYTTWIGUVZEWIF-GHJWDPDVSA-N 1 1 335.404 2.323 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]C1CCC(O)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000353616579 466015540 /nfs/dbraw/zinc/01/55/40/466015540.db2.gz BLVYBAZFJNEGOU-AVVWSFFYSA-N 1 1 330.388 2.311 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C1CCC(O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000353617927 466017293 /nfs/dbraw/zinc/01/72/93/466017293.db2.gz FENBCQZNXSLJKG-BCLQGDPASA-N 1 1 330.388 2.311 20 5 EEBDMO COc1cc(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000346252827 466032756 /nfs/dbraw/zinc/03/27/56/466032756.db2.gz ZGPLTZLGOAEJLU-WOSRLPQWSA-N 1 1 347.415 2.406 20 5 EEBDMO C[C@@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccncc1F ZINC000338361487 466061134 /nfs/dbraw/zinc/06/11/34/466061134.db2.gz UBFMWQAHIKABDD-LLVKDONJSA-N 1 1 344.346 2.369 20 5 EEBDMO CC(C)[N@@H+](C)C[C@H](C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000357566134 466139060 /nfs/dbraw/zinc/13/90/60/466139060.db2.gz LGYVLHWODGLGHY-VIFPVBQESA-N 1 1 335.451 2.200 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C[N@H+](C)C(C)C)cc1C ZINC000349805321 466249466 /nfs/dbraw/zinc/24/94/66/466249466.db2.gz XCVQGJAASNTQCR-ZDUSSCGKSA-N 1 1 343.449 2.219 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N2C[C@@H]3CCCC[N@@H+]3C[C@H]2C)c1[N+](=O)[O-] ZINC000331913281 466303106 /nfs/dbraw/zinc/30/31/06/466303106.db2.gz BDAMELAZVFARSV-NEPJUHHUSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N2C[C@@H]3CCCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-] ZINC000331913281 466303112 /nfs/dbraw/zinc/30/31/12/466303112.db2.gz BDAMELAZVFARSV-NEPJUHHUSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2C[C@@H]3CCCC[N@@H+]3C[C@H]2C)c1[N+](=O)[O-] ZINC000331913281 466303129 /nfs/dbraw/zinc/30/31/29/466303129.db2.gz BDAMELAZVFARSV-NEPJUHHUSA-N 1 1 335.408 2.140 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2C[C@@H]3CCCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-] ZINC000331913281 466303134 /nfs/dbraw/zinc/30/31/34/466303134.db2.gz BDAMELAZVFARSV-NEPJUHHUSA-N 1 1 335.408 2.140 20 5 EEBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000354007559 466322853 /nfs/dbraw/zinc/32/28/53/466322853.db2.gz QNJOOFWYIYIYMI-ZDUSSCGKSA-N 1 1 330.388 2.102 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@@H](O)C1CC1 ZINC000305696426 466426024 /nfs/dbraw/zinc/42/60/24/466426024.db2.gz CBFMAPYLKLJEGB-QMTHXVAHSA-N 1 1 332.360 2.409 20 5 EEBDMO CS[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])C[C@@H]1[NH+]1CCCC1 ZINC000332217890 466453349 /nfs/dbraw/zinc/45/33/49/466453349.db2.gz UYXAUPBIUYVMJV-JKSUJKDBSA-N 1 1 337.445 2.312 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000322380663 466632199 /nfs/dbraw/zinc/63/21/99/466632199.db2.gz NBHBKRJTTCSQSE-UWVGGRQHSA-N 1 1 325.315 2.230 20 5 EEBDMO Cc1cc(C(=O)NC2CCN(c3[nH+]ccn3C)CC2)cc([N+](=O)[O-])c1 ZINC000373582223 466854993 /nfs/dbraw/zinc/85/49/93/466854993.db2.gz YHIFBQSRJIAEKF-UHFFFAOYSA-N 1 1 343.387 2.036 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](CO)[C@H]1C ZINC000412063473 466989683 /nfs/dbraw/zinc/98/96/83/466989683.db2.gz BCLCUMJFZJZLDK-ZIAGYGMSSA-N 1 1 335.404 2.325 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413174917 467184082 /nfs/dbraw/zinc/18/40/82/467184082.db2.gz UEKUBRPCWTZCLF-YLFCFFPRSA-N 1 1 329.400 2.441 20 5 EEBDMO CO[C@@H]1C[C@@H]([N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000451857281 467274668 /nfs/dbraw/zinc/27/46/68/467274668.db2.gz UGIFTHUHHAFRFY-HZPDHXFCSA-N 1 1 347.415 2.447 20 5 EEBDMO CO[C@@H]1C[C@@H]([N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000451857281 467274670 /nfs/dbraw/zinc/27/46/70/467274670.db2.gz UGIFTHUHHAFRFY-HZPDHXFCSA-N 1 1 347.415 2.447 20 5 EEBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C1CCN(CCC(F)(F)F)CC1 ZINC000452115657 467328606 /nfs/dbraw/zinc/32/86/06/467328606.db2.gz KTDIVUBTQJLUQP-UHFFFAOYSA-N 1 1 349.357 2.140 20 5 EEBDMO CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000420327917 467358814 /nfs/dbraw/zinc/35/88/14/467358814.db2.gz ZLLCGIYCIUBVLY-MZBDJJRSSA-N 1 1 332.404 2.138 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000420333755 467362532 /nfs/dbraw/zinc/36/25/32/467362532.db2.gz FRJNFNFVCOHURL-ILXRZTDVSA-N 1 1 346.431 2.243 20 5 EEBDMO O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@@H]2C[NH2+]CCO2)s1 ZINC000415095320 467488331 /nfs/dbraw/zinc/48/83/31/467488331.db2.gz LXRCOQPIDBAVQL-LBPRGKRZSA-N 1 1 333.413 2.401 20 5 EEBDMO CN(C)C(=O)N[C@@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000449744085 467704734 /nfs/dbraw/zinc/70/47/34/467704734.db2.gz DSAYFJJJYACXAB-SBJJXXPASA-N 1 1 332.404 2.344 20 5 EEBDMO CN(C)C(=O)N[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000449744085 467704739 /nfs/dbraw/zinc/70/47/39/467704739.db2.gz DSAYFJJJYACXAB-SBJJXXPASA-N 1 1 332.404 2.344 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+](CCCO)C2)cc1OC(F)F ZINC000450610736 467878756 /nfs/dbraw/zinc/87/87/56/467878756.db2.gz HECFKRPRWPPENR-GFCCVEGCSA-N 1 1 345.346 2.455 20 5 EEBDMO COc1ccc(OCCN2CC[N@@H+](C)[C@@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000488020809 468067899 /nfs/dbraw/zinc/06/78/99/468067899.db2.gz CKMAPMYDYKELAV-MRXNPFEDSA-N 1 1 337.420 2.254 20 5 EEBDMO COCCSCCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000488235698 468078528 /nfs/dbraw/zinc/07/85/28/468078528.db2.gz VRUSRCRLNSPCRB-ZDUSSCGKSA-N 1 1 340.449 2.246 20 5 EEBDMO COc1ccccc1[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[NH+](C)C ZINC000531887548 468082785 /nfs/dbraw/zinc/08/27/85/468082785.db2.gz GYFCNXCSDQVDKF-HNNXBMFYSA-N 1 1 344.371 2.031 20 5 EEBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CC(C)(C)OC)c([N+](=O)[O-])c1 ZINC000533022597 468162419 /nfs/dbraw/zinc/16/24/19/468162419.db2.gz YRXUHPWLRHQONX-LLVKDONJSA-N 1 1 339.392 2.287 20 5 EEBDMO COCC[N@H+]1CCC[C@H](NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000590035554 468206067 /nfs/dbraw/zinc/20/60/67/468206067.db2.gz DOOPDASMROUJMI-AWEZNQCLSA-N 1 1 349.431 2.099 20 5 EEBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594200396 468510590 /nfs/dbraw/zinc/51/05/90/468510590.db2.gz LSDWZZMCLQUUMR-HUUCEWRRSA-N 1 1 347.415 2.497 20 5 EEBDMO CCCN(C(=O)NCCc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000591968838 468586152 /nfs/dbraw/zinc/58/61/52/468586152.db2.gz GXTOWSUNUAKQSW-HNNXBMFYSA-N 1 1 334.420 2.263 20 5 EEBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594598712 468631520 /nfs/dbraw/zinc/63/15/20/468631520.db2.gz HQEZMEYAVPPOIY-HOTGVXAUSA-N 1 1 332.404 2.383 20 5 EEBDMO COC(=O)[C@@H]1C[C@H](O)C[N@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000592529652 468722241 /nfs/dbraw/zinc/72/22/41/468722241.db2.gz COBNKRCOJXOHGU-KGLIPLIRSA-N 1 1 336.388 2.074 20 5 EEBDMO COC(=O)[C@@H]1C[C@H](O)C[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000592529652 468722245 /nfs/dbraw/zinc/72/22/45/468722245.db2.gz COBNKRCOJXOHGU-KGLIPLIRSA-N 1 1 336.388 2.074 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C1CCN([C@H]2CCOC2)CC1 ZINC000594993309 468739994 /nfs/dbraw/zinc/73/99/94/468739994.db2.gz NTBBZSJXBHAZTA-KRWDZBQOSA-N 1 1 349.431 2.336 20 5 EEBDMO CC(C)O[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000593053203 468852589 /nfs/dbraw/zinc/85/25/89/468852589.db2.gz QENYCUQXQWEFGN-NVXWUHKLSA-N 1 1 338.404 2.224 20 5 EEBDMO CC(C)O[C@H]1CCC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000593054103 468853171 /nfs/dbraw/zinc/85/31/71/468853171.db2.gz ASOIYKZZJMDPKE-INIZCTEOSA-N 1 1 347.415 2.373 20 5 EEBDMO CC(C)O[C@H]1CCC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 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ZINC000750074395 577986737 /nfs/dbraw/zinc/98/67/37/577986737.db2.gz YFTNBGPJXKHZFK-CRAIPNDOSA-N 1 1 333.432 2.292 20 5 EEBDMO Cn1c2ccccc2c(N[C@H]2CC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1=O ZINC000891847325 676862467 /nfs/dbraw/zinc/86/24/67/676862467.db2.gz WZNANINQTRAKBD-DZGCQCFKSA-N 1 1 342.399 2.485 20 5 EEBDMO COc1c(O)ccc(C[N@@H+]2CCS[C@H]3COCC[C@H]32)c1[N+](=O)[O-] ZINC000892211427 678258303 /nfs/dbraw/zinc/25/83/03/678258303.db2.gz LSXWGOIMMQTRFE-YPMHNXCESA-N 1 1 340.401 2.015 20 5 EEBDMO COc1c(O)ccc(C[N@H+]2CCS[C@H]3COCC[C@H]32)c1[N+](=O)[O-] ZINC000892211427 678258305 /nfs/dbraw/zinc/25/83/05/678258305.db2.gz LSXWGOIMMQTRFE-YPMHNXCESA-N 1 1 340.401 2.015 20 5 EEBDMO CC(C)[N@H+](CC(=O)N1CCO[C@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000066434492 681598650 /nfs/dbraw/zinc/59/86/50/681598650.db2.gz XQNONLLTWVQSLK-CQSZACIVSA-N 1 1 335.404 2.053 20 5 EEBDMO CC(C)[N@@H+](CC(=O)N1CCO[C@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000066434492 681598656 /nfs/dbraw/zinc/59/86/56/681598656.db2.gz XQNONLLTWVQSLK-CQSZACIVSA-N 1 1 335.404 2.053 20 5 EEBDMO COCC[N@@H+](C)CCNc1cccc(Br)c1[N+](=O)[O-] ZINC000311904076 682863262 /nfs/dbraw/zinc/86/32/62/682863262.db2.gz QYPIRYFIPIPYSR-UHFFFAOYSA-N 1 1 332.198 2.347 20 5 EEBDMO Cc1ccoc1C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21 ZINC001025679804 683231793 /nfs/dbraw/zinc/23/17/93/683231793.db2.gz WGEZOMGFYWRDBJ-ZSHCYNCHSA-N 1 1 341.367 2.356 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)NCC[NH+]1CCCCC1 ZINC000101572002 683686824 /nfs/dbraw/zinc/68/68/24/683686824.db2.gz AWXHBASXKAYWOI-UHFFFAOYSA-N 1 1 347.824 2.012 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[C@@H]([C@H]2CCC[N@@H+](CC[N+](=O)[O-])C2)C1 ZINC000930655128 684328205 /nfs/dbraw/zinc/32/82/05/684328205.db2.gz NTBUSZVTTKFNHT-UONOGXRCSA-N 1 1 327.425 2.232 20 5 EEBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CCN(C(=O)c2cn[nH]c2)CC1 ZINC000985285413 686220431 /nfs/dbraw/zinc/22/04/31/686220431.db2.gz AEZUTNKDYKXZCY-UHFFFAOYSA-N 1 1 349.416 2.116 20 5 EEBDMO 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/nfs/dbraw/zinc/48/61/53/1202486153.db2.gz AFOYHAIHEQXORW-KRWDZBQOSA-N 1 1 326.400 2.349 20 5 EEBDMO COc1ccc(NC(=O)NC[C@@H]2CCCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000930767503 1206581366 /nfs/dbraw/zinc/58/13/66/1206581366.db2.gz AFJBLEMLYWUZMR-LBPRGKRZSA-N 1 1 336.392 2.457 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@@H](C4OCCO4)C3)co2)cc1 ZINC000932000282 1207506959 /nfs/dbraw/zinc/50/69/59/1207506959.db2.gz BWTHOFKIQRDMID-CYBMUJFWSA-N 1 1 345.355 2.445 20 5 EEBDMO C[C@@H](CNS(=O)(=O)c1csc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1 ZINC000119562056 1229547271 /nfs/dbraw/zinc/54/72/71/1229547271.db2.gz CWBLTWMYGICXNE-QWRGUYRKSA-N 1 1 347.462 2.055 20 5 EEBDMO Cc1cc(C)cc(C[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001045436151 1233744350 /nfs/dbraw/zinc/74/43/50/1233744350.db2.gz JXUNUJIZCUNCLM-IAGOWNOFSA-N 1 1 345.443 2.439 20 5 EEBDMO Cc1cc(F)ccc1C[NH+]1CCC(C)(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001045437727 1233745486 /nfs/dbraw/zinc/74/54/86/1233745486.db2.gz 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/nfs/dbraw/zinc/59/28/94/803592894.db2.gz MOPVAMNVRCWTPL-GDBMZVCRSA-N 1 1 325.453 2.007 20 5 EEBDMO COC(=O)[C@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)[C@@H]1C ZINC000787241851 807050968 /nfs/dbraw/zinc/05/09/68/807050968.db2.gz HJKUWLLQQSGBBM-YPMHNXCESA-N 1 1 332.360 2.094 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3ncn(C)c3C2)c([N+](=O)[O-])c1 ZINC001170354391 809902652 /nfs/dbraw/zinc/90/26/52/809902652.db2.gz KPFYMHIOIQNIEA-LBPRGKRZSA-N 1 1 330.388 2.326 20 5 EEBDMO CCOC(=O)[C@H]1CC[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170345024 809915986 /nfs/dbraw/zinc/91/59/86/809915986.db2.gz GLNDUYMURQXPLI-OCCSQVGLSA-N 1 1 336.388 2.419 20 5 EEBDMO COc1ccc(C[C@H](C)[N@@H+](C)[C@H]2CCCN(C(C)=O)C2)c([N+](=O)[O-])c1 ZINC001170351552 809919810 /nfs/dbraw/zinc/91/98/10/809919810.db2.gz DCSQBJNDENITKJ-BBRMVZONSA-N 1 1 349.431 2.477 20 5 EEBDMO CC(C)c1ccc(C[NH2+]C2CC[NH+](CC(=O)[O-])CC2)cc1[N+](=O)[O-] ZINC000874048174 956110088 /nfs/dbraw/zinc/11/00/88/956110088.db2.gz LSGRHXGZHOHFRT-UHFFFAOYSA-N 1 1 335.404 2.357 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+](Cc2ccc(F)cc2)CC2CC2)c1 ZINC000173757378 231026368 /nfs/dbraw/zinc/02/63/68/231026368.db2.gz PDWVSJDNUASVGA-QGZVFWFLSA-N 1 1 348.378 2.204 20 5 EEBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000055757382 214341175 /nfs/dbraw/zinc/34/11/75/214341175.db2.gz ZQFXNNLMCIWZFI-FRRDWIJNSA-N 1 1 334.420 2.394 20 5 EEBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1 ZINC000164071928 529808600 /nfs/dbraw/zinc/80/86/00/529808600.db2.gz JJTXGZNCAIYPSP-YGRLFVJLSA-N 1 1 339.342 2.429 20 5 EEBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1ncc([N+](=O)[O-])cc1Cl ZINC000130162637 529846608 /nfs/dbraw/zinc/84/66/08/529846608.db2.gz XCTCYXJAXXIYLH-UHFFFAOYSA-N 1 1 342.827 2.438 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000066176099 215019016 /nfs/dbraw/zinc/01/90/16/215019016.db2.gz KZQOAAMWVVEYCB-ZDUSSCGKSA-N 1 1 337.424 2.036 20 5 EEBDMO Cc1cc(C(=O)NC(C)(C)CCN2CC[NH+](C)CC2)cc([N+](=O)[O-])c1 ZINC000184184534 235326698 /nfs/dbraw/zinc/32/66/98/235326698.db2.gz XNEFMOTXKOUPIA-UHFFFAOYSA-N 1 1 348.447 2.049 20 5 EEBDMO Cc1cc(C(=O)NC(C)(C)CCN2CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC000184195440 235329153 /nfs/dbraw/zinc/32/91/53/235329153.db2.gz UPCGFKPHGATOBQ-UHFFFAOYSA-N 1 1 348.447 2.049 20 5 EEBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCCC[C@H]1O ZINC000426204473 241235649 /nfs/dbraw/zinc/23/56/49/241235649.db2.gz GKLMRFKHHWJZNZ-ZIAGYGMSSA-N 1 1 332.360 2.380 20 5 EEBDMO C[C@@H]1C[C@@H](Nc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000447813712 242319344 /nfs/dbraw/zinc/31/93/44/242319344.db2.gz XELNHXFREZRNCO-ZBFHGGJFSA-N 1 1 348.447 2.322 20 5 EEBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](SC)C2)c([N+](=O)[O-])c1 ZINC000451320119 243076946 /nfs/dbraw/zinc/07/69/46/243076946.db2.gz KFAZAUXRMRLVLT-CMPLNLGQSA-N 1 1 339.417 2.368 20 5 EEBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H](SC)C2)c([N+](=O)[O-])c1 ZINC000451320119 243076949 /nfs/dbraw/zinc/07/69/49/243076949.db2.gz KFAZAUXRMRLVLT-CMPLNLGQSA-N 1 1 339.417 2.368 20 5 EEBDMO CCN(C)C(=O)[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C ZINC000451310804 243072184 /nfs/dbraw/zinc/07/21/84/243072184.db2.gz HOBSLRBTSYJISI-HNNXBMFYSA-N 1 1 333.392 2.064 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H]2C[C@H](O)CC[C@H]2C1 ZINC000451700925 243213147 /nfs/dbraw/zinc/21/31/47/243213147.db2.gz YSOUZBAQFDDHJH-QLFBSQMISA-N 1 1 347.415 2.325 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H]2C[C@H](O)CC[C@H]2C1 ZINC000451700925 243213152 /nfs/dbraw/zinc/21/31/52/243213152.db2.gz YSOUZBAQFDDHJH-QLFBSQMISA-N 1 1 347.415 2.325 20 5 EEBDMO C[C@@H]1C[C@@H](O)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000452065092 243340405 /nfs/dbraw/zinc/34/04/05/243340405.db2.gz BHWWJSZDPJWYMZ-IUODEOHRSA-N 1 1 331.372 2.495 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[N@@H+](C[C@H](C)O)[C@@H](C)C1 ZINC000247258691 243399901 /nfs/dbraw/zinc/39/99/01/243399901.db2.gz XNSQTNIBQNFAJA-KBPBESRZSA-N 1 1 349.431 2.047 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[N@H+](C[C@H](C)O)[C@@H](C)C1 ZINC000247258691 243399908 /nfs/dbraw/zinc/39/99/08/243399908.db2.gz XNSQTNIBQNFAJA-KBPBESRZSA-N 1 1 349.431 2.047 20 5 EEBDMO CCNS(=O)(=O)c1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000459651792 245199092 /nfs/dbraw/zinc/19/90/92/245199092.db2.gz VTEZHTVYSDKJDE-UHFFFAOYSA-N 1 1 349.412 2.183 20 5 EEBDMO O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1c1ccncc1 ZINC000423951661 296171525 /nfs/dbraw/zinc/17/15/25/296171525.db2.gz MJLXWYARZQCDKS-HNNXBMFYSA-N 1 1 346.774 2.430 20 5 EEBDMO CCOCC[NH+]1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000493821216 246819674 /nfs/dbraw/zinc/81/96/74/246819674.db2.gz PEZCKXSATGFCEK-UHFFFAOYSA-N 1 1 327.812 2.402 20 5 EEBDMO Cc1ccnc(NC2CCN(C3CC[NH+](C)CC3)CC2)c1[N+](=O)[O-] ZINC000265153717 247253090 /nfs/dbraw/zinc/25/30/90/247253090.db2.gz BVRXZVFXBDRXGI-UHFFFAOYSA-N 1 1 333.436 2.269 20 5 EEBDMO Cc1cccc([C@H]2CCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1 ZINC000266519629 248342336 /nfs/dbraw/zinc/34/23/36/248342336.db2.gz COCJKZXDCSQYFY-DLBZAZTESA-N 1 1 330.388 2.298 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@H]2Cc2ccccc2)c1 ZINC000266528400 248346521 /nfs/dbraw/zinc/34/65/21/248346521.db2.gz LEFPNSAJAPSSQG-WMZOPIPTSA-N 1 1 344.415 2.249 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[NH2+]C[C@@H]1c1ccccc1Cl ZINC000262025025 284666104 /nfs/dbraw/zinc/66/61/04/284666104.db2.gz RWQUDKWHWQGKSJ-CYBMUJFWSA-N 1 1 334.763 2.363 20 5 EEBDMO C[C@@H]1SCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1C ZINC000112645273 220362475 /nfs/dbraw/zinc/36/24/75/220362475.db2.gz YFMZUQWCTUSOLK-OBJOEFQTSA-N 1 1 326.418 2.160 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@@H+](CCc2ccccc2)[C@@H]2CCOC2)c1 ZINC000084134385 285189344 /nfs/dbraw/zinc/18/93/44/285189344.db2.gz MXFKPVFKYJHCNJ-MRXNPFEDSA-N 1 1 330.388 2.125 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1[C@@H](CO)CCC[C@@H]1C ZINC000270452446 256136919 /nfs/dbraw/zinc/13/69/19/256136919.db2.gz LEWFAHVBHJTDCS-DZGCQCFKSA-N 1 1 335.404 2.467 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000268141070 256118357 /nfs/dbraw/zinc/11/83/57/256118357.db2.gz DFDBIZPQNBUVSO-CXAGYDPISA-N 1 1 346.431 2.386 20 5 EEBDMO O=[N+]([O-])c1ccc(OCC[NH+]2CCN(c3cncc(F)c3)CC2)cc1 ZINC000270837957 256178011 /nfs/dbraw/zinc/17/80/11/256178011.db2.gz DRKHOXBWSRWJID-UHFFFAOYSA-N 1 1 346.362 2.330 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000273422950 256294967 /nfs/dbraw/zinc/29/49/67/256294967.db2.gz ZCHXXHBKHAHYRZ-UKRRQHHQSA-N 1 1 331.372 2.500 20 5 EEBDMO CC(C)OCCOC[C@@H](O)C[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000274265310 256369029 /nfs/dbraw/zinc/36/90/29/256369029.db2.gz YIYFMBCPMTYPIS-PBHICJAKSA-N 1 1 340.420 2.390 20 5 EEBDMO COc1cc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000154180251 533525288 /nfs/dbraw/zinc/52/52/88/533525288.db2.gz BAKPXEMOPWMBFA-KGLIPLIRSA-N 1 1 333.388 2.160 20 5 EEBDMO CN(CCCN1CC[NH+](C)CC1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000119573307 292246647 /nfs/dbraw/zinc/24/66/47/292246647.db2.gz UPCNIJNWROWENO-UHFFFAOYSA-N 1 1 340.855 2.318 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](N2CCNC2=O)C1 ZINC000368021471 292295987 /nfs/dbraw/zinc/29/59/87/292295987.db2.gz RJAAUZLUKSFAPS-ZFWWWQNUSA-N 1 1 332.404 2.454 20 5 EEBDMO Cc1nc(CC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cs1 ZINC000128780500 292347022 /nfs/dbraw/zinc/34/70/22/292347022.db2.gz WQWDPNMLBUYWQR-LBPRGKRZSA-N 1 1 333.417 2.484 20 5 EEBDMO O=c1c([N+](=O)[O-])cccn1Cc1cn2cc(Br)ccc2[nH+]1 ZINC000102204092 159262045 /nfs/dbraw/zinc/26/20/45/159262045.db2.gz UWVFRELIDPLYNK-UHFFFAOYSA-N 1 1 349.144 2.215 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(n2cccn2)CC1 ZINC000109007302 159346335 /nfs/dbraw/zinc/34/63/35/159346335.db2.gz WPPHPQWGNPGPGI-ZDUSSCGKSA-N 1 1 343.387 2.455 20 5 EEBDMO O=[N+]([O-])c1cnc(N[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2CO)s1 ZINC000192497787 160170871 /nfs/dbraw/zinc/17/08/71/160170871.db2.gz QXICHXSCVDZZCK-UONOGXRCSA-N 1 1 348.428 2.346 20 5 EEBDMO C[C@@H]1[C@@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCC[N@H+]1C ZINC000343607598 161150910 /nfs/dbraw/zinc/15/09/10/161150910.db2.gz VAJZXVZRNPZAHW-RISCZKNCSA-N 1 1 332.404 2.382 20 5 EEBDMO CO[C@@H]1C[C@H](CN(C)c2cc(C(F)(F)F)ncc2[N+](=O)[O-])[N@@H+](C)C1 ZINC000343875941 161176797 /nfs/dbraw/zinc/17/67/97/161176797.db2.gz LTVCEGUXKJFVCW-NXEZZACHSA-N 1 1 348.325 2.164 20 5 EEBDMO C[C@H]1[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCC[N@@H+]1C ZINC000343972741 161185884 /nfs/dbraw/zinc/18/58/84/161185884.db2.gz OSZFJQZBKOSFEP-JOYOIKCWSA-N 1 1 347.824 2.009 20 5 EEBDMO C[C@H]1[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCC[N@H+]1C ZINC000343972741 161185885 /nfs/dbraw/zinc/18/58/85/161185885.db2.gz OSZFJQZBKOSFEP-JOYOIKCWSA-N 1 1 347.824 2.009 20 5 EEBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCN1CCN(C)CC1 ZINC000344793738 161246283 /nfs/dbraw/zinc/24/62/83/161246283.db2.gz PCBHBQGSIOOWAG-DTQAZKPQSA-N 1 1 332.448 2.225 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](CO)c1ccc(F)cc1 ZINC000359630970 164141299 /nfs/dbraw/zinc/14/12/99/164141299.db2.gz YXIQNZODSXXHPW-AWEZNQCLSA-N 1 1 347.346 2.304 20 5 EEBDMO O=C(C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)NCC(F)F ZINC000360771367 164377688 /nfs/dbraw/zinc/37/76/88/164377688.db2.gz IBRBHFSBWBQDEJ-UHFFFAOYSA-N 1 1 339.298 2.326 20 5 EEBDMO CN(Cc1c([N+](=O)[O-])ncn1C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000360849446 164390226 /nfs/dbraw/zinc/39/02/26/164390226.db2.gz MBMRIWRKWMTIFC-INIZCTEOSA-N 1 1 343.431 2.425 20 5 EEBDMO C[NH+](C)CCN(Cc1ccco1)C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000272686954 269008806 /nfs/dbraw/zinc/00/88/06/269008806.db2.gz PIKNBIYLJGZWIW-UHFFFAOYSA-N 1 1 333.344 2.097 20 5 EEBDMO CSCC[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000274827396 269059065 /nfs/dbraw/zinc/05/90/65/269059065.db2.gz LFHGFOVKZOSZBG-UHFFFAOYSA-N 1 1 335.433 2.346 20 5 EEBDMO COC[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000275417939 269114883 /nfs/dbraw/zinc/11/48/83/269114883.db2.gz CDQGVZGZOYQKHV-LLVKDONJSA-N 1 1 325.340 2.031 20 5 EEBDMO COC[C@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@H]1CCCO1 ZINC000279110844 269262137 /nfs/dbraw/zinc/26/21/37/269262137.db2.gz SMKDFLZKVYHVIH-GXTWGEPZSA-N 1 1 328.340 2.026 20 5 EEBDMO CS(=O)(=O)C1(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCC1 ZINC000279822545 269309062 /nfs/dbraw/zinc/30/90/62/269309062.db2.gz POLPRJKNFCMCFF-UHFFFAOYSA-N 1 1 332.809 2.305 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CC1CCC1)[C@@H](C)CO ZINC000280487381 269366229 /nfs/dbraw/zinc/36/62/29/269366229.db2.gz LWWZSHHAPZGHHI-ZDUSSCGKSA-N 1 1 335.404 2.325 20 5 EEBDMO NC(=O)c1ccc(C[N@@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000289751975 275145445 /nfs/dbraw/zinc/14/54/45/275145445.db2.gz YSMHFJUMTPOTAV-JKSUJKDBSA-N 1 1 345.399 2.227 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000289751975 275145446 /nfs/dbraw/zinc/14/54/46/275145446.db2.gz YSMHFJUMTPOTAV-JKSUJKDBSA-N 1 1 345.399 2.227 20 5 EEBDMO Cn1cc(C[N@@H+]2CCC[C@](F)(CO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000289833169 275153037 /nfs/dbraw/zinc/15/30/37/275153037.db2.gz OWQXFYFJLIAJME-QGZVFWFLSA-N 1 1 348.378 2.292 20 5 EEBDMO Cn1cc(C[N@H+]2CCC[C@](F)(CO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000289833169 275153038 /nfs/dbraw/zinc/15/30/38/275153038.db2.gz OWQXFYFJLIAJME-QGZVFWFLSA-N 1 1 348.378 2.292 20 5 EEBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)C2 ZINC000291672071 275328419 /nfs/dbraw/zinc/32/84/19/275328419.db2.gz WJRVOLOGVAIFHY-HNNXBMFYSA-N 1 1 342.399 2.363 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](n2cccn2)C1 ZINC000291696304 275330953 /nfs/dbraw/zinc/33/09/53/275330953.db2.gz HSNIKLLKMAPWIB-IUODEOHRSA-N 1 1 329.360 2.065 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](n2cccn2)C1 ZINC000291696304 275330954 /nfs/dbraw/zinc/33/09/54/275330954.db2.gz HSNIKLLKMAPWIB-IUODEOHRSA-N 1 1 329.360 2.065 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](C3CCC3)CC2)c1 ZINC000283871751 293005791 /nfs/dbraw/zinc/00/57/91/293005791.db2.gz HXCZRCNOFFSVHI-UHFFFAOYSA-N 1 1 333.388 2.304 20 5 EEBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000293109109 293128271 /nfs/dbraw/zinc/12/82/71/293128271.db2.gz YILBICJHNRKTBD-KSSFIOAISA-N 1 1 346.431 2.340 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000293109113 293128320 /nfs/dbraw/zinc/12/83/20/293128320.db2.gz YILBICJHNRKTBD-RDTXWAMCSA-N 1 1 346.431 2.340 20 5 EEBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)C2)C1 ZINC000294006236 293348409 /nfs/dbraw/zinc/34/84/09/293348409.db2.gz XSZGQUQFBOKPFK-KRWDZBQOSA-N 1 1 328.372 2.244 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)[C@H]2C1 ZINC000296772848 294063847 /nfs/dbraw/zinc/06/38/47/294063847.db2.gz MUVAYTVOJJSYEH-CJNGLKHVSA-N 1 1 345.399 2.110 20 5 EEBDMO Cc1c([C@@H](C)NCCC[N@H+]2CCC[C@@H](C(N)=O)C2)cccc1[N+](=O)[O-] ZINC000346115432 312271904 /nfs/dbraw/zinc/27/19/04/312271904.db2.gz XEVJBKMAVLLYHI-HUUCEWRRSA-N 1 1 348.447 2.141 20 5 EEBDMO CCCC[N@@H+](CCCO)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000182155996 323366316 /nfs/dbraw/zinc/36/63/16/323366316.db2.gz UJSTXGCLFNUNTJ-INIZCTEOSA-N 1 1 335.404 2.185 20 5 EEBDMO CCOC(=O)C[C@H](C)[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000182660349 323382919 /nfs/dbraw/zinc/38/29/19/323382919.db2.gz MKSXITBWKWQCOH-NSHDSACASA-N 1 1 348.359 2.418 20 5 EEBDMO CCOC(=O)C[C@H](C)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000182660349 323382921 /nfs/dbraw/zinc/38/29/21/323382921.db2.gz MKSXITBWKWQCOH-NSHDSACASA-N 1 1 348.359 2.418 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCO)[C@H]1CC[C@H](C)C1 ZINC000351618483 465255576 /nfs/dbraw/zinc/25/55/76/465255576.db2.gz HLRVQURBVIEFPD-JSGCOSHPSA-N 1 1 335.404 2.325 20 5 EEBDMO COc1c(C(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000356323717 465312642 /nfs/dbraw/zinc/31/26/42/465312642.db2.gz YKPXASLTYVADEE-ZDUSSCGKSA-N 1 1 335.404 2.311 20 5 EEBDMO CCC[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2C)CC[N@@H+]1CCOC ZINC000127996760 462600944 /nfs/dbraw/zinc/60/09/44/462600944.db2.gz JGMGKDKWAUHDKQ-HNNXBMFYSA-N 1 1 349.431 2.476 20 5 EEBDMO CCC[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2C)CC[N@H+]1CCOC ZINC000127996760 462600949 /nfs/dbraw/zinc/60/09/49/462600949.db2.gz JGMGKDKWAUHDKQ-HNNXBMFYSA-N 1 1 349.431 2.476 20 5 EEBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000074764117 462632154 /nfs/dbraw/zinc/63/21/54/462632154.db2.gz AMDZKNZQXORIMW-INIZCTEOSA-N 1 1 334.420 2.119 20 5 EEBDMO CC1CC[NH+](CCNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])CC1 ZINC000089619899 462699190 /nfs/dbraw/zinc/69/91/90/462699190.db2.gz RPAPKSBTCIWLEP-UHFFFAOYSA-N 1 1 341.433 2.142 20 5 EEBDMO Cc1nc(NC[C@@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000089645233 462702353 /nfs/dbraw/zinc/70/23/53/462702353.db2.gz MBSPYIHKLPQORN-HOTGVXAUSA-N 1 1 342.399 2.346 20 5 EEBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000090550916 462797158 /nfs/dbraw/zinc/79/71/58/462797158.db2.gz HFNSNDFGNMLSGG-CQSZACIVSA-N 1 1 345.399 2.328 20 5 EEBDMO CCOCC[N@@H+](CC)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000117340500 462800231 /nfs/dbraw/zinc/80/02/31/462800231.db2.gz QQFHUZFKPFDSBX-UHFFFAOYSA-N 1 1 337.376 2.251 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000066138651 462854830 /nfs/dbraw/zinc/85/48/30/462854830.db2.gz AYEITCDZZAEIDH-NSHDSACASA-N 1 1 339.392 2.072 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000066176279 462859552 /nfs/dbraw/zinc/85/95/52/462859552.db2.gz KAIXFBWISHJFFK-ZDUSSCGKSA-N 1 1 337.424 2.036 20 5 EEBDMO CC(C)C(=O)NC1CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000048274471 462885030 /nfs/dbraw/zinc/88/50/30/462885030.db2.gz MXPABPPRDQIRKB-UHFFFAOYSA-N 1 1 345.403 2.139 20 5 EEBDMO CC(C)[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000066920852 462946743 /nfs/dbraw/zinc/94/67/43/462946743.db2.gz MWUSQVDYXOLEIL-VBQJREDUSA-N 1 1 349.431 2.345 20 5 EEBDMO CC(C)[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000066920852 462946746 /nfs/dbraw/zinc/94/67/46/462946746.db2.gz MWUSQVDYXOLEIL-VBQJREDUSA-N 1 1 349.431 2.345 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CCc1ccncc1 ZINC000121491032 463143999 /nfs/dbraw/zinc/14/39/99/463143999.db2.gz GWVGRCKNIVXZFZ-ZDUSSCGKSA-N 1 1 328.372 2.491 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1ccncc1 ZINC000121491032 463144005 /nfs/dbraw/zinc/14/40/05/463144005.db2.gz GWVGRCKNIVXZFZ-ZDUSSCGKSA-N 1 1 328.372 2.491 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 ZINC000122411490 463262186 /nfs/dbraw/zinc/26/21/86/463262186.db2.gz AQWZKHSBTDQAEA-KGLIPLIRSA-N 1 1 349.435 2.055 20 5 EEBDMO CC[C@@H]1CCC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000030143243 463286847 /nfs/dbraw/zinc/28/68/47/463286847.db2.gz HTXNQFYZSUUUFD-LLVKDONJSA-N 1 1 335.360 2.384 20 5 EEBDMO CC[C@@H]1CCC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000030143243 463286851 /nfs/dbraw/zinc/28/68/51/463286851.db2.gz HTXNQFYZSUUUFD-LLVKDONJSA-N 1 1 335.360 2.384 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCSC ZINC000138265374 463306895 /nfs/dbraw/zinc/30/68/95/463306895.db2.gz XITRFUSIUJDZLC-UHFFFAOYSA-N 1 1 327.406 2.227 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CCC(CC[NH+](C)C)CC2)c1[N+](=O)[O-] ZINC000160137423 463320197 /nfs/dbraw/zinc/32/01/97/463320197.db2.gz KOTVXPAQZKLRQA-UHFFFAOYSA-N 1 1 337.424 2.074 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](CN2CCOCC2)C1 ZINC000069857740 463341184 /nfs/dbraw/zinc/34/11/84/463341184.db2.gz YYBYSHVEXWUAHI-HNNXBMFYSA-N 1 1 349.431 2.148 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](CN2CCOCC2)C1 ZINC000069857740 463341188 /nfs/dbraw/zinc/34/11/88/463341188.db2.gz YYBYSHVEXWUAHI-HNNXBMFYSA-N 1 1 349.431 2.148 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000151972820 463624414 /nfs/dbraw/zinc/62/44/14/463624414.db2.gz AQYLEYPJLOXBAM-ZANVPECISA-N 1 1 327.331 2.285 20 5 EEBDMO CCCC[N@@H+](C)CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000112309658 463697727 /nfs/dbraw/zinc/69/77/27/463697727.db2.gz HYCUMTOTDWYBAQ-UHFFFAOYSA-N 1 1 345.403 2.242 20 5 EEBDMO CC[C@H]1CN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000255413646 463725115 /nfs/dbraw/zinc/72/51/15/463725115.db2.gz ZHKDYWVISQYTHI-QWGSZXSUSA-N 1 1 347.415 2.177 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(Cc3cc([N+](=O)[O-])ccc3OC(F)F)C[C@H]2C1 ZINC000194541416 463881325 /nfs/dbraw/zinc/88/13/25/463881325.db2.gz BXGPZMSWOHPFAL-TXEJJXNPSA-N 1 1 327.331 2.190 20 5 EEBDMO CN(CC[C@@H]1CCCC[N@H+]1C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000185851009 463890558 /nfs/dbraw/zinc/89/05/58/463890558.db2.gz KFKQERVGYBQKNO-ZDUSSCGKSA-N 1 1 341.433 2.090 20 5 EEBDMO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC([N@@H+](C)CCCO)CC1 ZINC000283782526 464008499 /nfs/dbraw/zinc/00/84/99/464008499.db2.gz QOYNZPKSCJVROH-UHFFFAOYSA-N 1 1 335.404 2.080 20 5 EEBDMO O=C(C[NH+]1CCC2(CCOCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000283918270 464041413 /nfs/dbraw/zinc/04/14/13/464041413.db2.gz AMIDRDYTONOURG-UHFFFAOYSA-N 1 1 333.388 2.426 20 5 EEBDMO CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1cnn(C)c1 ZINC000195518851 464067431 /nfs/dbraw/zinc/06/74/31/464067431.db2.gz MVSJFDXOUZJVQN-UHFFFAOYSA-N 1 1 345.403 2.487 20 5 EEBDMO COc1ccc(NC(=O)CC[N@@H+](C)CCCCCO)c([N+](=O)[O-])c1 ZINC000279710011 464130161 /nfs/dbraw/zinc/13/01/61/464130161.db2.gz KCYOCPCGIAECDE-UHFFFAOYSA-N 1 1 339.392 2.026 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@H](O)C(C)(C)C1 ZINC000279715464 464133835 /nfs/dbraw/zinc/13/38/35/464133835.db2.gz IIIDJCIEOOOFBU-MFKMUULPSA-N 1 1 332.360 2.409 20 5 EEBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@H](O)C(C)(C)C1 ZINC000279715464 464133839 /nfs/dbraw/zinc/13/38/39/464133839.db2.gz IIIDJCIEOOOFBU-MFKMUULPSA-N 1 1 332.360 2.409 20 5 EEBDMO O=C(CC[N@@H+]1CC[C@@H](O)C12CCCC2)Nc1ccccc1[N+](=O)[O-] ZINC000292624088 464291271 /nfs/dbraw/zinc/29/12/71/464291271.db2.gz GGCVETLTGUMFCG-OAHLLOKOSA-N 1 1 333.388 2.303 20 5 EEBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000281071478 464321528 /nfs/dbraw/zinc/32/15/28/464321528.db2.gz ZXCBGAYYQHEOPM-GFCCVEGCSA-N 1 1 333.388 2.208 20 5 EEBDMO CC(C)(CCC(=O)NCCC[N@H+]1CCc2ccccc2C1)[N+](=O)[O-] ZINC000294324844 464467620 /nfs/dbraw/zinc/46/76/20/464467620.db2.gz KGOURPALTXELJJ-UHFFFAOYSA-N 1 1 333.432 2.387 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)CCNc3ccccc3[N+](=O)[O-])C2)C1 ZINC000294364102 464479593 /nfs/dbraw/zinc/47/95/93/464479593.db2.gz 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CC[N@H+]1CCC[C@@H]1CNC(=S)NCCc1ccccc1[N+](=O)[O-] ZINC000741870422 578125440 /nfs/dbraw/zinc/12/54/40/578125440.db2.gz SXDMDMPRIDKDSH-CQSZACIVSA-N 1 1 336.461 2.086 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(-c2nn[nH]n2)s1 ZINC000821846696 606417402 /nfs/dbraw/zinc/41/74/02/606417402.db2.gz XPIPYVNOSBUMEJ-UHFFFAOYSA-N 1 1 346.372 2.135 20 5 EEBDMO COc1c(O)ccc(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)c1[N+](=O)[O-] ZINC000894113836 681343874 /nfs/dbraw/zinc/34/38/74/681343874.db2.gz SAAIPDRWANYMOM-CQSZACIVSA-N 1 1 345.355 2.357 20 5 EEBDMO COc1c(O)ccc(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)c1[N+](=O)[O-] ZINC000894113836 681343875 /nfs/dbraw/zinc/34/38/75/681343875.db2.gz SAAIPDRWANYMOM-CQSZACIVSA-N 1 1 345.355 2.357 20 5 EEBDMO CN1CC[N@@H+](C)C[C@@H]1CNc1cccc(Br)c1[N+](=O)[O-] ZINC000312360043 684497161 /nfs/dbraw/zinc/49/71/61/684497161.db2.gz LAIBCMRKKIPJEB-JTQLQIEISA-N 1 1 343.225 2.015 20 5 EEBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)OCCC[NH+]1CCOCC1 ZINC000909592955 686498504 /nfs/dbraw/zinc/49/85/04/686498504.db2.gz HYRGYHLYSDQCBT-UHFFFAOYSA-N 1 1 340.401 2.196 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000897298097 686636523 /nfs/dbraw/zinc/63/65/23/686636523.db2.gz WYZJSBSRNQQRCD-VXGBXAGGSA-N 1 1 342.399 2.495 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000897298097 686636526 /nfs/dbraw/zinc/63/65/26/686636526.db2.gz WYZJSBSRNQQRCD-VXGBXAGGSA-N 1 1 342.399 2.495 20 5 EEBDMO CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](CCCc2ccccc2)CC1 ZINC001005382135 1195316294 /nfs/dbraw/zinc/31/62/94/1195316294.db2.gz NIDQZHUIIGWHGS-QZTJIDSGSA-N 1 1 345.443 2.207 20 5 EEBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](CO)c1cnn(C)c1 ZINC000872052454 1198035361 /nfs/dbraw/zinc/03/53/61/1198035361.db2.gz SACHEJLVHSJHKG-YGRLFVJLSA-N 1 1 336.417 2.434 20 5 EEBDMO C[N@@H+](CC1CCOCC1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000124646269 1198696628 /nfs/dbraw/zinc/69/66/28/1198696628.db2.gz DBXRSSFTZAPDBI-UHFFFAOYSA-N 1 1 331.376 2.169 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@H](n2cc(CO)nn2)C1 ZINC000877551459 1199963641 /nfs/dbraw/zinc/96/36/41/1199963641.db2.gz AGVLLXVFLABVKN-HNNXBMFYSA-N 1 1 345.403 2.133 20 5 EEBDMO CC1(C)C(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)[C@@H]1C1CC1 ZINC000811769904 1200283654 /nfs/dbraw/zinc/28/36/54/1200283654.db2.gz IKQGJHQERVNKJB-OAHLLOKOSA-N 1 1 347.419 2.033 20 5 EEBDMO CC(C)[NH2+]CCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001133396275 1200855824 /nfs/dbraw/zinc/85/58/24/1200855824.db2.gz ZSZHCNOVCVGJHP-HUUCEWRRSA-N 1 1 339.823 2.332 20 5 EEBDMO COc1ccc(NC(=O)C[N@@H+]2C[C@@H]3CC=CC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000879529201 1201126216 /nfs/dbraw/zinc/12/62/16/1201126216.db2.gz JZEKCDSCOAHEDY-BETUJISGSA-N 1 1 331.372 2.440 20 5 EEBDMO CNC(=O)C[N@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000879753821 1201239766 /nfs/dbraw/zinc/23/97/66/1201239766.db2.gz ICJDRUFMBOVPQZ-UHFFFAOYSA-N 1 1 343.383 2.222 20 5 EEBDMO CNC(=O)C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000879753821 1201239769 /nfs/dbraw/zinc/23/97/69/1201239769.db2.gz ICJDRUFMBOVPQZ-UHFFFAOYSA-N 1 1 343.383 2.222 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@@H+]2Cc3ccccc3N3CCC[C@@H]3C2)n1 ZINC000880551878 1201519568 /nfs/dbraw/zinc/51/95/68/1201519568.db2.gz ULATZSKYEOMNDP-OAHLLOKOSA-N 1 1 327.388 2.276 20 5 EEBDMO C[C@@]([NH3+])(C(=O)N1CC[C@@H](C2CCOCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000867975732 1201718258 /nfs/dbraw/zinc/71/82/58/1201718258.db2.gz POWUTNXGNUTGLX-KDOFPFPSSA-N 1 1 347.415 2.044 20 5 EEBDMO CC(C)O[C@@H]1CCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1 ZINC000867982579 1201719687 /nfs/dbraw/zinc/71/96/87/1201719687.db2.gz UBIGBRRKVNENJZ-NVXWUHKLSA-N 1 1 335.404 2.185 20 5 EEBDMO COC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886216028 1202481215 /nfs/dbraw/zinc/48/12/15/1202481215.db2.gz VOCBMRQYVHTQDR-GOSISDBHSA-N 1 1 341.367 2.307 20 5 EEBDMO C[N@H+]1CCN(Cc2cccnc2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000886266853 1202486108 /nfs/dbraw/zinc/48/61/08/1202486108.db2.gz AFOYHAIHEQXORW-QGZVFWFLSA-N 1 1 326.400 2.349 20 5 EEBDMO C[C@@]1(C(N)=O)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000930297676 1205882454 /nfs/dbraw/zinc/88/24/54/1205882454.db2.gz IDCXZPFBSZYHTR-CYBMUJFWSA-N 1 1 342.193 2.055 20 5 EEBDMO Cc1noc(CN2C[C@@H]3C[C@H]2C[N@@H+]3Cc2ccccc2)c1[N+](=O)[O-] ZINC000931494158 1207397470 /nfs/dbraw/zinc/39/74/70/1207397470.db2.gz QWYBYNHJRRKGJP-GJZGRUSLSA-N 1 1 328.372 2.350 20 5 EEBDMO Cc1noc(CN2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)c1[N+](=O)[O-] ZINC000931494158 1207397473 /nfs/dbraw/zinc/39/74/73/1207397473.db2.gz QWYBYNHJRRKGJP-GJZGRUSLSA-N 1 1 328.372 2.350 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC1)CC[NH+](C/C=C/Cl)CC2 ZINC000957550373 1215202667 /nfs/dbraw/zinc/20/26/67/1215202667.db2.gz XRZADUCLXNODRI-BUUOGENGSA-N 1 1 341.839 2.109 20 5 EEBDMO Cc1cc(Cl)ccc1C[NH2+][C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC001020138899 1229505164 /nfs/dbraw/zinc/50/51/64/1229505164.db2.gz HBVZRHSQPCRXAF-KBUPBQIOSA-N 1 1 337.807 2.050 20 5 EEBDMO CCOC(=O)c1cn(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)nc1C ZINC000800865445 1234697413 /nfs/dbraw/zinc/69/74/13/1234697413.db2.gz CELHUMJXNLXVBW-UHFFFAOYSA-N 1 1 346.387 2.408 20 5 EEBDMO CCOC(=O)c1cn(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)nc1C ZINC000800865445 1234697417 /nfs/dbraw/zinc/69/74/17/1234697417.db2.gz CELHUMJXNLXVBW-UHFFFAOYSA-N 1 1 346.387 2.408 20 5 EEBDMO CC1(C(=O)N2C[C@@H]3C[N@H+](Cc4ccccc4[N+](=O)[O-])C[C@@H]3C2)CC1 ZINC001048831850 1238808834 /nfs/dbraw/zinc/80/88/34/1238808834.db2.gz IISRBMZPKYCAPG-GASCZTMLSA-N 1 1 329.400 2.285 20 5 EEBDMO Cc1cccc(C)c1C[NH+]1CCC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001001395069 1242188272 /nfs/dbraw/zinc/18/82/72/1242188272.db2.gz JEXIVSWWHVDIFZ-SJLPKXTDSA-N 1 1 345.443 2.297 20 5 EEBDMO Cc1ccc(C[NH+]2CCC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1C ZINC001001399249 1242195814 /nfs/dbraw/zinc/19/58/14/1242195814.db2.gz KVTVFECQDVFGEN-QZTJIDSGSA-N 1 1 345.443 2.297 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NCCN(c1ccccc1[N+](=O)[O-])C1CC1 ZINC001101406454 1245776188 /nfs/dbraw/zinc/77/61/88/1245776188.db2.gz RHPBHBITHYVEHE-UHFFFAOYSA-N 1 1 348.447 2.410 20 5 EEBDMO COC(=O)CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C1CCOCC1 ZINC000851792172 1291837220 /nfs/dbraw/zinc/83/72/20/1291837220.db2.gz IQKOZBCDQSUCPO-UHFFFAOYSA-N 1 1 340.351 2.278 20 5 EEBDMO Nc1ccc(C(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000856476358 1293539922 /nfs/dbraw/zinc/53/99/22/1293539922.db2.gz WGPVGUKXDWYOIR-CYBMUJFWSA-N 1 1 332.404 2.029 20 5 EEBDMO Cc1ccc(Nc2cnc(N3CC[NH+](C)CC3)nc2)cc1[N+](=O)[O-] ZINC001213661688 1296127888 /nfs/dbraw/zinc/12/78/88/1296127888.db2.gz TUICPUUOSNCDMC-UHFFFAOYSA-N 1 1 328.376 2.189 20 5 EEBDMO CC/C(C)=C/C(=O)NCC1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1 ZINC001223081449 1299973002 /nfs/dbraw/zinc/97/30/02/1299973002.db2.gz GWJHVFKCDAUJTD-UKTHLTGXSA-N 1 1 349.435 2.013 20 5 EEBDMO CO[C@@H]1CC[N@@H+](CCOc2ccc3c(C)cc(=O)oc3c2[N+](=O)[O-])C1 ZINC001229946487 1302994832 /nfs/dbraw/zinc/99/48/32/1302994832.db2.gz PAXYEHRZWAMDHE-GFCCVEGCSA-N 1 1 348.355 2.109 20 5 EEBDMO Cc1noc(C)c1C(=O)NCCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001233818157 1304602723 /nfs/dbraw/zinc/60/27/23/1304602723.db2.gz CVKVJONCYQLSFQ-UHFFFAOYSA-N 1 1 346.387 2.452 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CCOCC2)cc1O[C@@H]1CCc2[nH+]ccn2C1 ZINC001234364058 1304900766 /nfs/dbraw/zinc/90/07/66/1304900766.db2.gz NYBMAJFQPCPOEA-CQSZACIVSA-N 1 1 344.371 2.022 20 5 EEBDMO Cc1c(COC(=O)CCCC[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000798192526 1304942564 /nfs/dbraw/zinc/94/25/64/1304942564.db2.gz QCCLZSKTQPRINM-UHFFFAOYSA-N 1 1 336.388 2.449 20 5 EEBDMO C[C@@H]1C[C@H]2CC[C@H](C(=O)NCCc3cccc([N+](=O)[O-])c3)C[N@H+]2C1 ZINC001123677504 1310673225 /nfs/dbraw/zinc/67/32/25/1310673225.db2.gz KJLHQOZLSCLRLB-VNQPRFMTSA-N 1 1 331.416 2.374 20 5 EEBDMO COCC[N@@H+]1[C@H](C)CN(Cc2ccc([N+](=O)[O-])cc2OC)C[C@@H]1C ZINC000830074538 1314525432 /nfs/dbraw/zinc/52/54/32/1314525432.db2.gz KKWPOEDJTYQLIO-OKILXGFUSA-N 1 1 337.420 2.144 20 5 EEBDMO COc1ccc([C@H]2[C@H](COC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CCC[N@H+]2C)cc1 ZINC000842305754 1315685646 /nfs/dbraw/zinc/68/56/46/1315685646.db2.gz BMRHXCXLOUGUGF-SVGFKBNWSA-N 1 1 348.399 2.287 20 5 EEBDMO COc1ccc([C@H]2[C@H](COC(=O)[C@@H]3CC3[N+](=O)[O-])CCC[N@@H+]2C)cc1 ZINC000842305754 1315685647 /nfs/dbraw/zinc/68/56/47/1315685647.db2.gz BMRHXCXLOUGUGF-SVGFKBNWSA-N 1 1 348.399 2.287 20 5 EEBDMO COc1ccc([C@H]2[C@H](COC(=O)[C@@H]3CC3[N+](=O)[O-])CCC[N@H+]2C)cc1 ZINC000842305754 1315685650 /nfs/dbraw/zinc/68/56/50/1315685650.db2.gz BMRHXCXLOUGUGF-SVGFKBNWSA-N 1 1 348.399 2.287 20 5 EEBDMO COc1cc(N2CC[N@@H+]3CCc4ccccc4[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001155089244 1317451787 /nfs/dbraw/zinc/45/17/87/1317451787.db2.gz CCHPNSAEPIIRKX-INIZCTEOSA-N 1 1 340.383 2.418 20 5 EEBDMO COc1cc(N2CC[N@H+]3CCc4ccccc4[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001155089244 1317451792 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WDDKOPKDCUJUKO-UHFFFAOYSA-N 1 1 342.399 2.392 20 5 EEBDMO COc1ccc(OCCN2CC[N@@H+](C)C[C@H]2C(C)C)c([N+](=O)[O-])c1 ZINC000425490851 241146832 /nfs/dbraw/zinc/14/68/32/241146832.db2.gz ZGWAVVCZLFWHJM-INIZCTEOSA-N 1 1 337.420 2.254 20 5 EEBDMO CCO[C@@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1C ZINC000451542270 243151686 /nfs/dbraw/zinc/15/16/86/243151686.db2.gz NDWVEQCHVCIGRP-CXAGYDPISA-N 1 1 347.415 2.231 20 5 EEBDMO CCO[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1C ZINC000451542270 243151690 /nfs/dbraw/zinc/15/16/90/243151690.db2.gz NDWVEQCHVCIGRP-CXAGYDPISA-N 1 1 347.415 2.231 20 5 EEBDMO O=C(C[N@@H+]1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000451698049 243211686 /nfs/dbraw/zinc/21/16/86/243211686.db2.gz RPIMXIUXRUXHQJ-MCIONIFRSA-N 1 1 333.388 2.016 20 5 EEBDMO O=C(C[N@H+]1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000451698049 243211690 /nfs/dbraw/zinc/21/16/90/243211690.db2.gz RPIMXIUXRUXHQJ-MCIONIFRSA-N 1 1 333.388 2.016 20 5 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Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+]C[C@@H]2c2ccncc2)c1 ZINC000576148942 320145302 /nfs/dbraw/zinc/14/53/02/320145302.db2.gz BLSSDEJSINBDEG-MRXNPFEDSA-N 1 1 326.356 2.085 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 ZINC000576570905 320183931 /nfs/dbraw/zinc/18/39/31/320183931.db2.gz LQDUSEGTHMQZDK-ZDUSSCGKSA-N 1 1 349.435 2.435 20 5 EEBDMO CCOC(=O)C[C@@H](C)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000182662242 323383264 /nfs/dbraw/zinc/38/32/64/323383264.db2.gz FTEFKXVYVXHNOL-GFCCVEGCSA-N 1 1 337.376 2.115 20 5 EEBDMO CCOC(=O)C[C@@H](C)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000182662242 323383268 /nfs/dbraw/zinc/38/32/68/323383268.db2.gz FTEFKXVYVXHNOL-GFCCVEGCSA-N 1 1 337.376 2.115 20 5 EEBDMO COc1c(C(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000354591034 465041387 /nfs/dbraw/zinc/04/13/87/465041387.db2.gz BMLBQRIRDATVSB-STQMWFEESA-N 1 1 335.404 2.454 20 5 EEBDMO COc1c(C(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000354591030 465041503 /nfs/dbraw/zinc/04/15/03/465041503.db2.gz BMLBQRIRDATVSB-OLZOCXBDSA-N 1 1 335.404 2.454 20 5 EEBDMO Nc1c(C(=O)N2CCC[N@@H+](CC3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000339202106 465138795 /nfs/dbraw/zinc/13/87/95/465138795.db2.gz GVRFOVPQQPCIKC-UHFFFAOYSA-N 1 1 332.404 2.125 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCO)[C@H]1CC[C@@H](C)C1 ZINC000351618484 465254692 /nfs/dbraw/zinc/25/46/92/465254692.db2.gz HLRVQURBVIEFPD-OCCSQVGLSA-N 1 1 335.404 2.325 20 5 EEBDMO COc1ccc(OCC[N@@H+](CCO)[C@@H]2CC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000351638849 465266804 /nfs/dbraw/zinc/26/68/04/465266804.db2.gz YOBFDGRKOJAGEN-UONOGXRCSA-N 1 1 338.404 2.465 20 5 EEBDMO CC(C)(CNC(=O)c1cc([N+](=O)[O-])c[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000045313109 462576641 /nfs/dbraw/zinc/57/66/41/462576641.db2.gz FGIPPWCXCSDPKD-UHFFFAOYSA-N 1 1 342.399 2.490 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000074316436 462583716 /nfs/dbraw/zinc/58/37/16/462583716.db2.gz CJDMRRMUQDHCSK-CQSZACIVSA-N 1 1 347.415 2.407 20 5 EEBDMO COCCC[N@@H+](C)CCNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000127927852 462595434 /nfs/dbraw/zinc/59/54/34/462595434.db2.gz JVHYDZQTTGISFL-UHFFFAOYSA-N 1 1 338.408 2.301 20 5 EEBDMO C[C@@H](O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128574839 462654252 /nfs/dbraw/zinc/65/42/52/462654252.db2.gz GOCZKYUJFOPEOC-IAQYHMDHSA-N 1 1 339.367 2.298 20 5 EEBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000063660764 462660596 /nfs/dbraw/zinc/66/05/96/462660596.db2.gz GBWMGUSKSHRSIP-CYBMUJFWSA-N 1 1 346.387 2.321 20 5 EEBDMO C[N@@H+](CCOCC1CC1)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128882872 462678284 /nfs/dbraw/zinc/67/82/84/462678284.db2.gz BAUDHKGKBJPWOD-UHFFFAOYSA-N 1 1 339.367 2.421 20 5 EEBDMO Cc1cnc(NC[C@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000089643968 462702739 /nfs/dbraw/zinc/70/27/39/462702739.db2.gz MRLXZWXGTSTNHQ-HZPDHXFCSA-N 1 1 342.399 2.346 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000090553268 462797937 /nfs/dbraw/zinc/79/79/37/462797937.db2.gz IFDDGXRMRURLCH-INIZCTEOSA-N 1 1 329.356 2.299 20 5 EEBDMO Cn1ccnc1C[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000131214321 462798983 /nfs/dbraw/zinc/79/89/83/462798983.db2.gz GBDUSUFFBYCNEE-PBHICJAKSA-N 1 1 344.415 2.316 20 5 EEBDMO C[N@@H+](CCc1cccc(Nc2ncc([N+](=O)[O-])c(N)n2)c1)C1CC1 ZINC000091632241 462893986 /nfs/dbraw/zinc/89/39/86/462893986.db2.gz QOIHJSATFMFNFT-UHFFFAOYSA-N 1 1 328.376 2.347 20 5 EEBDMO C[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1O ZINC000093332891 463028461 /nfs/dbraw/zinc/02/84/61/463028461.db2.gz IPWGEADHUAIMHS-DOMZBBRYSA-N 1 1 331.372 2.495 20 5 EEBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000021054404 463031812 /nfs/dbraw/zinc/03/18/12/463031812.db2.gz RYOAZBLCIJGZKQ-CHWSQXEVSA-N 1 1 335.404 2.212 20 5 EEBDMO Cc1c([C@@H](C)[NH2+]C[C@@H](C)CN2CCN(C)CC2)cccc1[N+](=O)[O-] ZINC000120924964 463054881 /nfs/dbraw/zinc/05/48/81/463054881.db2.gz IISRQRZFRZYURS-GDBMZVCRSA-N 1 1 334.464 2.437 20 5 EEBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCN(Cc3ccccn3)CC2)cc1 ZINC000052280489 463074410 /nfs/dbraw/zinc/07/44/10/463074410.db2.gz YFMMQRUUFPQWNL-UHFFFAOYSA-N 1 1 326.400 2.350 20 5 EEBDMO C[N@H+]1CCC[C@@H](CNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000568471945 468340636 /nfs/dbraw/zinc/34/06/36/468340636.db2.gz DZMBJRDMGLWUKG-INIZCTEOSA-N 1 1 348.447 2.181 20 5 EEBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000054287019 463224073 /nfs/dbraw/zinc/22/40/73/463224073.db2.gz GWSVBUFTTAZTBF-GFCCVEGCSA-N 1 1 334.420 2.417 20 5 EEBDMO CC[C@@H](C)[N@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)OC(C)(C)C ZINC000136805705 463258954 /nfs/dbraw/zinc/25/89/54/463258954.db2.gz XSBHLQBLJOVDIC-GFCCVEGCSA-N 1 1 326.397 2.234 20 5 EEBDMO CC[C@@H](C)[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)OC(C)(C)C ZINC000136805705 463258960 /nfs/dbraw/zinc/25/89/60/463258960.db2.gz XSBHLQBLJOVDIC-GFCCVEGCSA-N 1 1 326.397 2.234 20 5 EEBDMO C[N@@H+](CCCn1ccnc1)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000124436032 463422483 /nfs/dbraw/zinc/42/24/83/463422483.db2.gz RTOWYJCIYFEPOZ-UHFFFAOYSA-N 1 1 342.359 2.363 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+](Cc2cccnc2)C2CC2)c1 ZINC000124708407 463455411 /nfs/dbraw/zinc/45/54/11/463455411.db2.gz RETIGXRPWOWVEK-KRWDZBQOSA-N 1 1 343.383 2.394 20 5 EEBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000124798760 463465738 /nfs/dbraw/zinc/46/57/38/463465738.db2.gz WOJVIZTVEDMJPW-CYBMUJFWSA-N 1 1 337.395 2.371 20 5 EEBDMO CCC1(O)CC[NH+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000072724949 463539913 /nfs/dbraw/zinc/53/99/13/463539913.db2.gz YRNKWAZEVOIQHH-UHFFFAOYSA-N 1 1 332.360 2.382 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000177771760 463787707 /nfs/dbraw/zinc/78/77/07/463787707.db2.gz ONVNIFGDXHMTNJ-OLZOCXBDSA-N 1 1 348.359 2.202 20 5 EEBDMO C[C@H]1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC[S@@]1=O ZINC000277300760 463907736 /nfs/dbraw/zinc/90/77/36/463907736.db2.gz UDDKTVMLUIRZHF-XMHCIUCPSA-N 1 1 326.418 2.207 20 5 EEBDMO C[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC[S@@]1=O ZINC000277300760 463907743 /nfs/dbraw/zinc/90/77/43/463907743.db2.gz UDDKTVMLUIRZHF-XMHCIUCPSA-N 1 1 326.418 2.207 20 5 EEBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1c1cccc(F)c1 ZINC000261953793 463909224 /nfs/dbraw/zinc/90/92/24/463909224.db2.gz LWDGWLFSYMRTJS-KRWDZBQOSA-N 1 1 343.358 2.450 20 5 EEBDMO CCOc1cc(C[N@H+]2CC[C@@H](C(=O)N3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000287546447 463923036 /nfs/dbraw/zinc/92/30/36/463923036.db2.gz WDCZIBOIOQNKHE-OAHLLOKOSA-N 1 1 347.415 2.438 20 5 EEBDMO Cc1ccc(NCCCNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])[nH+]c1 ZINC000269529249 464010698 /nfs/dbraw/zinc/01/06/98/464010698.db2.gz RTBFSTNSKORBJX-UHFFFAOYSA-N 1 1 346.391 2.377 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H]1C[C@@H](C)O ZINC000269783489 464092389 /nfs/dbraw/zinc/09/23/89/464092389.db2.gz HDAQIDQQBYGMTD-ZIAGYGMSSA-N 1 1 335.404 2.467 20 5 EEBDMO Cc1nn(C)c(NCc2cccc(C[NH+]3CCOCC3)c2)c1[N+](=O)[O-] ZINC000263671223 464147836 /nfs/dbraw/zinc/14/78/36/464147836.db2.gz GKWRLFBEBZKZOC-UHFFFAOYSA-N 1 1 345.403 2.081 20 5 EEBDMO COc1ccc(CNC(=O)[C@H](C)[N@@H+]2[C@H](C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000263715133 464164404 /nfs/dbraw/zinc/16/44/04/464164404.db2.gz VQMMADXNKJCFMO-XQQFMLRXSA-N 1 1 335.404 2.481 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)c1 ZINC000284424868 464187120 /nfs/dbraw/zinc/18/71/20/464187120.db2.gz OXTRISZEABWKPL-RYUDHWBXSA-N 1 1 333.388 2.349 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1 ZINC000281236186 464380940 /nfs/dbraw/zinc/38/09/40/464380940.db2.gz SPZCZBAQRRHNOK-NSHDSACASA-N 1 1 331.376 2.022 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](CO)CC1 ZINC000293029418 464382689 /nfs/dbraw/zinc/38/26/89/464382689.db2.gz GCYYRTHXTWBCFJ-AWEZNQCLSA-N 1 1 335.404 2.326 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](CO)CC3)o2)cc1 ZINC000293277259 464397898 /nfs/dbraw/zinc/39/78/98/464397898.db2.gz VFPNPCZCCFWYQS-GFCCVEGCSA-N 1 1 332.360 2.239 20 5 EEBDMO O=C(CCC(=O)N1CC[NH+](CC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000294329316 464468450 /nfs/dbraw/zinc/46/84/50/464468450.db2.gz FIVAMYBPEREYIQ-UHFFFAOYSA-N 1 1 345.399 2.112 20 5 EEBDMO Cc1cc(NC(=O)NCCN2CC[N@H+](C)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000281827647 464600515 /nfs/dbraw/zinc/60/05/15/464600515.db2.gz NHWFXGALYWEWAT-UHFFFAOYSA-N 1 1 349.435 2.051 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000265608725 464616216 /nfs/dbraw/zinc/61/62/16/464616216.db2.gz WOIAVIUWNXBMKK-UHFFFAOYSA-N 1 1 325.796 2.345 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272499949 464633989 /nfs/dbraw/zinc/63/39/89/464633989.db2.gz GREISIWGNBMNAH-DLBZAZTESA-N 1 1 343.431 2.492 20 5 EEBDMO O=[N+]([O-])c1cc2ccccc2nc1N[C@@H]1CCC[N@H+](CCCO)C1 ZINC000295029988 464683571 /nfs/dbraw/zinc/68/35/71/464683571.db2.gz VNMFHEDWXUDYTH-CQSZACIVSA-N 1 1 330.388 2.402 20 5 EEBDMO COc1cc(C[N@H+](C)[C@@H](C)CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000182657730 464703075 /nfs/dbraw/zinc/70/30/75/464703075.db2.gz JUOKTKFZZNWTFV-VIFPVBQESA-N 1 1 334.319 2.060 20 5 EEBDMO COc1cc(C[N@@H+](C)[C@@H](C)CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000182657730 464703077 /nfs/dbraw/zinc/70/30/77/464703077.db2.gz JUOKTKFZZNWTFV-VIFPVBQESA-N 1 1 334.319 2.060 20 5 EEBDMO C[C@@H]1C[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000295159825 464726665 /nfs/dbraw/zinc/72/66/65/464726665.db2.gz QLLRXWPJWDZESS-TZMCWYRMSA-N 1 1 345.399 2.299 20 5 EEBDMO COC(=O)[C@@H](C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCC1 ZINC000282229272 464745279 /nfs/dbraw/zinc/74/52/79/464745279.db2.gz ZFJMYGGIXZROKX-GFCCVEGCSA-N 1 1 349.387 2.339 20 5 EEBDMO CC(C)OCCOC[C@H](O)C[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000266759880 464812595 /nfs/dbraw/zinc/81/25/95/464812595.db2.gz SUODIWZHZOOYSS-LSDHHAIUSA-N 1 1 340.420 2.390 20 5 EEBDMO C[C@@H]1CSCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000248957105 464824096 /nfs/dbraw/zinc/82/40/96/464824096.db2.gz BQKCCGXXAMDJOS-WFASDCNBSA-N 1 1 335.429 2.385 20 5 EEBDMO C[C@@H]1C[N@H+](CCCCNC(=O)Cc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000176695364 464828522 /nfs/dbraw/zinc/82/85/22/464828522.db2.gz XHTDQCPZSDUCOB-GASCZTMLSA-N 1 1 349.431 2.143 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000266915599 464869509 /nfs/dbraw/zinc/86/95/09/464869509.db2.gz KDYMGBMILVCZFL-ZDUSSCGKSA-N 1 1 343.387 2.444 20 5 EEBDMO O=C(CN1CCC[C@@H](c2[nH]cc[nH+]2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000266920096 464872239 /nfs/dbraw/zinc/87/22/39/464872239.db2.gz LUCOONYQWSLSFN-GFCCVEGCSA-N 1 1 329.360 2.136 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC(=O)N(C)C ZINC000286460127 464926111 /nfs/dbraw/zinc/92/61/11/464926111.db2.gz SRDPFEXFWMTMNJ-GOOCMWNKSA-N 1 1 346.431 2.399 20 5 EEBDMO C[C@@H]([N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1(C)CC1 ZINC000177224528 464961912 /nfs/dbraw/zinc/96/19/12/464961912.db2.gz FKQNIJRLGNEIAR-SNVBAGLBSA-N 1 1 335.360 2.382 20 5 EEBDMO COC(=O)[C@]1(C)CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000177423410 465011599 /nfs/dbraw/zinc/01/15/99/465011599.db2.gz MDCRJWCVCCYHKK-MRXNPFEDSA-N 1 1 346.343 2.030 20 5 EEBDMO COC(=O)[C@]1(C)CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000177423410 465011603 /nfs/dbraw/zinc/01/16/03/465011603.db2.gz MDCRJWCVCCYHKK-MRXNPFEDSA-N 1 1 346.343 2.030 20 5 EEBDMO CC[C@H]1CN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000255051208 465023778 /nfs/dbraw/zinc/02/37/78/465023778.db2.gz BIMPXFORJKVIFX-PTZVLDCSSA-N 1 1 347.415 2.177 20 5 EEBDMO CCOC1(C)CC[NH+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000298332028 465366214 /nfs/dbraw/zinc/36/62/14/465366214.db2.gz ROARJAXGSCSDEA-UHFFFAOYSA-N 1 1 347.415 2.375 20 5 EEBDMO CC(C)[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CC[N@H+]1C ZINC000343217214 465491077 /nfs/dbraw/zinc/49/10/77/465491077.db2.gz QTZBPDSUFWNZQF-CQSZACIVSA-N 1 1 331.376 2.020 20 5 EEBDMO CC[N@@H+](CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C(C)C ZINC000360934889 465642704 /nfs/dbraw/zinc/64/27/04/465642704.db2.gz RPURZSQAUWHFFC-UHFFFAOYSA-N 1 1 335.451 2.202 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-] ZINC000344616992 465726090 /nfs/dbraw/zinc/72/60/90/465726090.db2.gz OFPYUDRABSTBJH-LLVKDONJSA-N 1 1 337.424 2.292 20 5 EEBDMO CNC(=O)c1ccc(N2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000299469317 465760262 /nfs/dbraw/zinc/76/02/62/465760262.db2.gz BIWBXGKEHNIIJT-UHFFFAOYSA-N 1 1 329.360 2.062 20 5 EEBDMO COc1c(C(=O)NCC[N@H+]2CCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000357153682 465816144 /nfs/dbraw/zinc/81/61/44/465816144.db2.gz VHBFPHMRGJKUTH-UHFFFAOYSA-N 1 1 335.404 2.455 20 5 EEBDMO Cn1ccnc1[C@@H](NCC[N@H+]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000353603607 466006253 /nfs/dbraw/zinc/00/62/53/466006253.db2.gz GZSDMJRSAQNBPD-KRWDZBQOSA-N 1 1 341.415 2.269 20 5 EEBDMO Cn1ccnc1[C@@H](NCC[N@@H+]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000353603607 466006259 /nfs/dbraw/zinc/00/62/59/466006259.db2.gz GZSDMJRSAQNBPD-KRWDZBQOSA-N 1 1 341.415 2.269 20 5 EEBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000346230210 466011093 /nfs/dbraw/zinc/01/10/93/466011093.db2.gz MEUSEROJOBDWHB-DCGLDWPTSA-N 1 1 349.406 2.465 20 5 EEBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCOC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1 ZINC000331365976 466050491 /nfs/dbraw/zinc/05/04/91/466050491.db2.gz CUHIDVMRRLFSCM-KURKYZTESA-N 1 1 334.416 2.389 20 5 EEBDMO CC(C)[N@@H+]1C[C@H](C)[C@H](Nc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000301899033 466057103 /nfs/dbraw/zinc/05/71/03/466057103.db2.gz SRHARSHIRLHFGE-WCQYABFASA-N 1 1 341.433 2.139 20 5 EEBDMO CC(C)[N@H+]1C[C@H](C)[C@H](Nc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000301899033 466057111 /nfs/dbraw/zinc/05/71/11/466057111.db2.gz SRHARSHIRLHFGE-WCQYABFASA-N 1 1 341.433 2.139 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000349643461 466171871 /nfs/dbraw/zinc/17/18/71/466171871.db2.gz XRVUGCGEUAMNHR-INIZCTEOSA-N 1 1 349.435 2.180 20 5 EEBDMO Cc1cc(C(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)c(N)c([N+](=O)[O-])c1 ZINC000372301771 466287338 /nfs/dbraw/zinc/28/73/38/466287338.db2.gz LHVJJWKABWLNQZ-HNNXBMFYSA-N 1 1 340.383 2.402 20 5 EEBDMO Cc1cc(C(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)c(N)c([N+](=O)[O-])c1 ZINC000372301771 466287340 /nfs/dbraw/zinc/28/73/40/466287340.db2.gz LHVJJWKABWLNQZ-HNNXBMFYSA-N 1 1 340.383 2.402 20 5 EEBDMO CC[N@@H+](CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(C)C ZINC000338716796 466330835 /nfs/dbraw/zinc/33/08/35/466330835.db2.gz DTAUTQPOWJJAPH-UHFFFAOYSA-N 1 1 329.422 2.141 20 5 EEBDMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[N@H+](CC(C)(C)O)[C@H](C)C1 ZINC000340866862 466397077 /nfs/dbraw/zinc/39/70/77/466397077.db2.gz KLBUFFROZLIKRO-GFCCVEGCSA-N 1 1 335.404 2.079 20 5 EEBDMO 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EEBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000434707392 467422095 /nfs/dbraw/zinc/42/20/95/467422095.db2.gz OSONMHOCJXKEMI-UHFFFAOYSA-N 1 1 347.419 2.014 20 5 EEBDMO CN(CC[N@H+]1CCOC(C)(C)C1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000434707392 467422098 /nfs/dbraw/zinc/42/20/98/467422098.db2.gz OSONMHOCJXKEMI-UHFFFAOYSA-N 1 1 347.419 2.014 20 5 EEBDMO C[C@H]1C[C@H](C[NH3+])CN1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000435372453 467463100 /nfs/dbraw/zinc/46/31/00/467463100.db2.gz RHEZVJROOACXFN-QWHCGFSZSA-N 1 1 329.404 2.164 20 5 EEBDMO C[C@@H]([NH3+])[C@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000435375926 467464141 /nfs/dbraw/zinc/46/41/41/467464141.db2.gz OXVRYZNRGSJPMH-OCCSQVGLSA-N 1 1 329.404 2.164 20 5 EEBDMO Cc1sc(S(=O)(=O)N[C@H]2CCC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000435436220 467469301 /nfs/dbraw/zinc/46/93/01/467469301.db2.gz FCJLLAURTHJJLG-NSHDSACASA-N 1 1 347.462 2.116 20 5 EEBDMO Cc1sc(S(=O)(=O)N[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000435436220 467469306 /nfs/dbraw/zinc/46/93/06/467469306.db2.gz FCJLLAURTHJJLG-NSHDSACASA-N 1 1 347.462 2.116 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-])C(C)C ZINC000448978457 467609867 /nfs/dbraw/zinc/60/98/67/467609867.db2.gz CJDGPHCJDXBLIZ-UHFFFAOYSA-N 1 1 327.356 2.203 20 5 EEBDMO CCC[N@@H+](CC)CCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000450027679 467764580 /nfs/dbraw/zinc/76/45/80/467764580.db2.gz PJHZWYCVRCKMOB-UHFFFAOYSA-N 1 1 345.403 2.242 20 5 EEBDMO Cc1cc(OCC(=O)NCC[C@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-] ZINC000458214315 467790288 /nfs/dbraw/zinc/79/02/88/467790288.db2.gz MLGCKJIHGRASLN-CQSZACIVSA-N 1 1 335.404 2.130 20 5 EEBDMO CCC(CC)[C@@H](CNc1ncc([N+](=O)[O-])c(C)n1)[NH+]1CCOCC1 ZINC000450244233 467807454 /nfs/dbraw/zinc/80/74/54/467807454.db2.gz OSUUUTNJGBZUSN-OAHLLOKOSA-N 1 1 337.424 2.242 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@@H+]2CCCO)c2ccncc21 ZINC000450597595 467877374 /nfs/dbraw/zinc/87/73/74/467877374.db2.gz PGJNRKMROIBWQE-ZDUSSCGKSA-N 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O=[N+]([O-])c1cc(Nc2ccc(CN3CC[NH2+]CC3)cc2)ccc1O ZINC001159567988 1319894347 /nfs/dbraw/zinc/89/43/47/1319894347.db2.gz WYICKBRRPHFFTF-UHFFFAOYSA-N 1 1 328.372 2.449 20 5 EEBDMO COc1nc(N2CCN(c3cccc(C)[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC001163659315 1321183622 /nfs/dbraw/zinc/18/36/22/1321183622.db2.gz DDXFZIBIGUKRHE-UHFFFAOYSA-N 1 1 329.360 2.028 20 5 EEBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2ccc([N+](=O)[O-])c(C)n2)CC1 ZINC001165109298 1321456326 /nfs/dbraw/zinc/45/63/26/1321456326.db2.gz SQSDHXORLYZQGO-OAHLLOKOSA-N 1 1 334.420 2.378 20 5 EEBDMO CC(C)[N@@H+](C)[C@@H]1CCN(c2cc(/C=C\N(C)C)c([N+](=O)[O-])cn2)C1 ZINC001165187352 1321469010 /nfs/dbraw/zinc/46/90/10/1321469010.db2.gz OJCGPXZVUMWONZ-DDJMYBDESA-N 1 1 333.436 2.441 20 5 EEBDMO Cc1cc(CN(C)c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)n(C)n1 ZINC001166598492 1321746862 /nfs/dbraw/zinc/74/68/62/1321746862.db2.gz RBCKEJUWNCWLRL-VOTSOKGWSA-N 1 1 330.392 2.200 20 5 EEBDMO CC[C@@H]1COCC[N@@H+]1CCNc1c2cc(F)ccc2ncc1[N+](=O)[O-] ZINC001307200035 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CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1 ZINC000839439570 1372902410 /nfs/dbraw/zinc/90/24/10/1372902410.db2.gz BEXAZXXZIRPKRO-SNVBAGLBSA-N 1 1 327.331 2.428 20 5 EEBDMO C[N@H+](CCNC(=O)/C=C/c1ccco1)Cc1cccc([N+](=O)[O-])c1 ZINC001753042501 1406627333 /nfs/dbraw/zinc/62/73/33/1406627333.db2.gz YDFZZCLNFJDBJP-BQYQJAHWSA-N 1 1 329.356 2.449 20 5 EEBDMO C[N@@H+](CCNC(=O)/C=C/c1ccco1)Cc1cccc([N+](=O)[O-])c1 ZINC001753042501 1406627342 /nfs/dbraw/zinc/62/73/42/1406627342.db2.gz YDFZZCLNFJDBJP-BQYQJAHWSA-N 1 1 329.356 2.449 20 5 EEBDMO CC[NH+](CC)CC[C@@H](C)NC(=O)[C@](C)(N)c1cccc([N+](=O)[O-])c1 ZINC001577684922 1403668976 /nfs/dbraw/zinc/66/89/76/1403668976.db2.gz PKIDYQYISJWIFY-CXAGYDPISA-N 1 1 336.436 2.005 20 5 EEBDMO O=[N+]([O-])c1cccc2ncnc(N3CC4(C3)CC[N@@H+](CC3CC3)C4)c21 ZINC001164775246 721301878 /nfs/dbraw/zinc/30/18/78/721301878.db2.gz UGDNVEWNMKNHKN-UHFFFAOYSA-N 1 1 339.399 2.460 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCC1(Nc2ncccc2[N+](=O)[O-])CCCC1 ZINC001104401152 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COc1cc([N+](=O)[O-])cnc1N1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000893745749 780149264 /nfs/dbraw/zinc/14/92/64/780149264.db2.gz YUWDLLZBLYWVMA-INIZCTEOSA-N 1 1 342.399 2.362 20 5 EEBDMO C[C@@H]1CN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO ZINC000894079793 780506955 /nfs/dbraw/zinc/50/69/55/780506955.db2.gz HRFKSVMYIFQDTR-TXEJJXNPSA-N 1 1 348.378 2.173 20 5 EEBDMO COc1cc(CNCc2ccc(CC[NH3+])cc2)c([N+](=O)[O-])cc1OC ZINC000841032226 783467147 /nfs/dbraw/zinc/46/71/47/783467147.db2.gz PLNOHKGIRUGNPT-UHFFFAOYSA-N 1 1 345.399 2.403 20 5 EEBDMO CCC[N@H+]1CCC[C@H](C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000906356489 783862747 /nfs/dbraw/zinc/86/27/47/783862747.db2.gz WGFWNFBTQBRDBN-AWEZNQCLSA-N 1 1 335.404 2.342 20 5 EEBDMO C[C@@H](OC(=O)C(C)(C)[NH+]1CCCC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000805614752 783913131 /nfs/dbraw/zinc/91/31/31/783913131.db2.gz LQWPIMUQXYUBBX-GFCCVEGCSA-N 1 1 349.387 2.339 20 5 EEBDMO CN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C[C@H]1CCC[N@H+]1C ZINC000817289671 784631978 /nfs/dbraw/zinc/63/19/78/784631978.db2.gz BOKQPLMVPUIUSJ-GFCCVEGCSA-N 1 1 340.811 2.213 20 5 EEBDMO Cc1cc(C(=O)NCC[N@H+](C)Cc2ccccc2)c(N)c([N+](=O)[O-])c1 ZINC000170903930 791134152 /nfs/dbraw/zinc/13/41/52/791134152.db2.gz KVOQBKTVWBGYOG-UHFFFAOYSA-N 1 1 342.399 2.347 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NC/C=C/CNc1ccc([N+](=O)[O-])cc1F ZINC001107232571 786546700 /nfs/dbraw/zinc/54/67/00/786546700.db2.gz CASXANYLHZUPQI-SNAWJCMRSA-N 1 1 338.383 2.158 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NC/C=C\CNc1nccc(C)c1[N+](=O)[O-] ZINC001107275243 786686663 /nfs/dbraw/zinc/68/66/63/786686663.db2.gz QZTYOLXLEAWPLQ-WAYWQWQTSA-N 1 1 349.435 2.114 20 5 EEBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@](C)(O)c1ccccc1 ZINC000823606202 787829236 /nfs/dbraw/zinc/82/92/36/787829236.db2.gz QZIUSXDUAACVCW-ROUUACIJSA-N 1 1 330.384 2.468 20 5 EEBDMO COc1cc(C(=O)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)ccc1[N+](=O)[O-] ZINC000913289717 788766262 /nfs/dbraw/zinc/76/62/62/788766262.db2.gz VPNPZPYLNIOVAQ-CALCHBBNSA-N 1 1 333.388 2.017 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H]1COC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000845737659 789930117 /nfs/dbraw/zinc/93/01/17/789930117.db2.gz IGZXQMDFWLLZRZ-JTQLQIEISA-N 1 1 336.344 2.353 20 5 EEBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@@H+]1Cc1ccccc1 ZINC000715696515 795482398 /nfs/dbraw/zinc/48/23/98/795482398.db2.gz LZCPJQZPILKDIB-OAHLLOKOSA-N 1 1 340.383 2.181 20 5 EEBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000715696515 795482399 /nfs/dbraw/zinc/48/23/99/795482399.db2.gz LZCPJQZPILKDIB-OAHLLOKOSA-N 1 1 340.383 2.181 20 5 EEBDMO CCCCCC[N@@H+](C)CC(=O)NCCNc1ccc([N+](=O)[O-])cn1 ZINC001093802619 795698344 /nfs/dbraw/zinc/69/83/44/795698344.db2.gz NUUDGJHAHNUATG-UHFFFAOYSA-N 1 1 337.424 2.030 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(NCCNC(=O)C[N@H+](C)CC(C)(C)C)c1 ZINC001094141335 795992058 /nfs/dbraw/zinc/99/20/58/795992058.db2.gz QHLBOUPOHIMPGE-UHFFFAOYSA-N 1 1 336.436 2.409 20 5 EEBDMO CC(=O)N1CC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@@H](C)C1 ZINC001172918285 797170661 /nfs/dbraw/zinc/17/06/61/797170661.db2.gz ANJPEULWDLCHQY-GUYCJALGSA-N 1 1 331.416 2.395 20 5 EEBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](S(C)(=O)=O)C1 ZINC001173232407 797312001 /nfs/dbraw/zinc/31/20/01/797312001.db2.gz FVWVDOJPQRRRDO-DOMZBBRYSA-N 1 1 326.418 2.035 20 5 EEBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](S(C)(=O)=O)C1 ZINC001173232407 797312006 /nfs/dbraw/zinc/31/20/06/797312006.db2.gz FVWVDOJPQRRRDO-DOMZBBRYSA-N 1 1 326.418 2.035 20 5 EEBDMO CCc1ccccc1CC[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001002787367 798609573 /nfs/dbraw/zinc/60/95/73/798609573.db2.gz JGQHPEOAINTEFF-QZTJIDSGSA-N 1 1 345.443 2.037 20 5 EEBDMO CC(C)(C)OC(=O)N[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC12CC2 ZINC001169007466 803568336 /nfs/dbraw/zinc/56/83/36/803568336.db2.gz OCRZHSKCRBBWJT-HZSPNIEDSA-N 1 1 339.436 2.421 20 5 EEBDMO CC(C)OCc1ncn2c1C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)CCC2 ZINC001169027412 803574872 /nfs/dbraw/zinc/57/48/72/803574872.db2.gz PIPJDLATMIMXTN-HUUCEWRRSA-N 1 1 336.436 2.459 20 5 EEBDMO C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC001169033631 803578647 /nfs/dbraw/zinc/57/86/47/803578647.db2.gz CQHYEWIASDLEQW-MJBXVCDLSA-N 1 1 327.425 2.373 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)C1 ZINC001169044669 803585045 /nfs/dbraw/zinc/58/50/45/803585045.db2.gz IPGCPYHSHPFUOL-INDMIFKZSA-N 1 1 329.444 2.496 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)C1 ZINC001169044669 803585050 /nfs/dbraw/zinc/58/50/50/803585050.db2.gz IPGCPYHSHPFUOL-INDMIFKZSA-N 1 1 329.444 2.496 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C[N@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169052483 803595849 /nfs/dbraw/zinc/59/58/49/803595849.db2.gz GFEYOFBYELCRDX-ZOBORPQBSA-N 1 1 327.425 2.419 20 5 EEBDMO CCOCCOCC[N@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000787237217 807062969 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EEBDMO Cc1c(NC(=O)CC[NH2+][C@@H]2[C@@H](C)CCN[C@H]2C)cccc1[N+](=O)[O-] ZINC000420381201 239794033 /nfs/dbraw/zinc/79/40/33/239794033.db2.gz ZAEHVLAUVVTJBI-PLQHRBFRSA-N 1 1 334.420 2.208 20 5 EEBDMO O=C(CC[N@@H+]1CCc2ncsc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000445869816 242136991 /nfs/dbraw/zinc/13/69/91/242136991.db2.gz SXYSMNMZJAXMGF-UHFFFAOYSA-N 1 1 332.385 2.438 20 5 EEBDMO O=C(CC[N@H+]1CCc2ncsc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000445869816 242136995 /nfs/dbraw/zinc/13/69/95/242136995.db2.gz SXYSMNMZJAXMGF-UHFFFAOYSA-N 1 1 332.385 2.438 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000447318581 242265388 /nfs/dbraw/zinc/26/53/88/242265388.db2.gz KQOMLOOWGFOKQN-HOTGVXAUSA-N 1 1 344.415 2.289 20 5 EEBDMO C[C@@H]1COCCN1CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549165 243153920 /nfs/dbraw/zinc/15/39/20/243153920.db2.gz PBLGVRACBIXSIF-WBVHZDCISA-N 1 1 333.432 2.495 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+]2CCCC[C@H]2C1 ZINC000246250111 243217820 /nfs/dbraw/zinc/21/78/20/243217820.db2.gz WMULTPHRWLAHTK-KBPBESRZSA-N 1 1 332.404 2.092 20 5 EEBDMO CNc1c(C(=O)N2CC[N@H+](C3CC3)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000452174624 243363148 /nfs/dbraw/zinc/36/31/48/243363148.db2.gz QOTBBFVVQNSCDB-GFCCVEGCSA-N 1 1 332.404 2.193 20 5 EEBDMO COC(=O)COc1ccc(C[NH2+]Cc2occc2C)cc1[N+](=O)[O-] ZINC000491398093 246017874 /nfs/dbraw/zinc/01/78/74/246017874.db2.gz FCNNIEMOWRRXBV-UHFFFAOYSA-N 1 1 334.328 2.338 20 5 EEBDMO CN1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1=O ZINC000264945692 247071927 /nfs/dbraw/zinc/07/19/27/247071927.db2.gz IOJUKOGSANDVME-LLVKDONJSA-N 1 1 332.385 2.039 20 5 EEBDMO O=[N+]([O-])c1ccc(NCCC[NH+]2CCOCC2)cc1OC(F)F ZINC000266159523 248139173 /nfs/dbraw/zinc/13/91/73/248139173.db2.gz NCMPTPFGSHHSJX-UHFFFAOYSA-N 1 1 331.319 2.330 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCc1ccncc1 ZINC000181459589 533138828 /nfs/dbraw/zinc/13/88/28/533138828.db2.gz DAXTXPDQDPLILR-UHFFFAOYSA-N 1 1 344.371 2.111 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCc1ccncc1 ZINC000181459589 533138830 /nfs/dbraw/zinc/13/88/30/533138830.db2.gz DAXTXPDQDPLILR-UHFFFAOYSA-N 1 1 344.371 2.111 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000270497422 256141472 /nfs/dbraw/zinc/14/14/72/256141472.db2.gz JXWBTEDZZWRKRQ-XJKSGUPXSA-N 1 1 334.420 2.119 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+](C)CCc2cnccn2)cccc1[N+](=O)[O-] ZINC000271324451 256233368 /nfs/dbraw/zinc/23/33/68/256233368.db2.gz KMXCDDGAIPKMAB-ZDUSSCGKSA-N 1 1 343.387 2.195 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)CCc2cnccn2)cccc1[N+](=O)[O-] ZINC000271324451 256233370 /nfs/dbraw/zinc/23/33/70/256233370.db2.gz KMXCDDGAIPKMAB-ZDUSSCGKSA-N 1 1 343.387 2.195 20 5 EEBDMO CC(C)(C)C[N@@H+](CCCO)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000273421646 256295077 /nfs/dbraw/zinc/29/50/77/256295077.db2.gz YYSLCBVGTGGYBB-CQSZACIVSA-N 1 1 340.420 2.065 20 5 EEBDMO COc1ccc(C[N@H+]2CCC[C@@H](Cn3ccnn3)C2)cc1[N+](=O)[O-] ZINC000119194334 221262501 /nfs/dbraw/zinc/26/25/01/221262501.db2.gz UMGFMDZZDXWBHF-CQSZACIVSA-N 1 1 331.376 2.107 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1cccnc1 ZINC000132282085 533224468 /nfs/dbraw/zinc/22/44/68/533224468.db2.gz YFZLSCNBRMLYAX-UHFFFAOYSA-N 1 1 344.371 2.459 20 5 EEBDMO CC(C)CO[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000119580633 221352567 /nfs/dbraw/zinc/35/25/67/221352567.db2.gz OOHRQWBCDIWUII-INIZCTEOSA-N 1 1 335.404 2.305 20 5 EEBDMO CC(C)CO[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000119580633 221352570 /nfs/dbraw/zinc/35/25/70/221352570.db2.gz OOHRQWBCDIWUII-INIZCTEOSA-N 1 1 335.404 2.305 20 5 EEBDMO C[C@H](CNC(=O)CN(C)c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000246138075 160263681 /nfs/dbraw/zinc/26/36/81/160263681.db2.gz DMMNEQLJZINYNA-HUUCEWRRSA-N 1 1 348.447 2.268 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000343641299 161153957 /nfs/dbraw/zinc/15/39/57/161153957.db2.gz FLXNVIWGKNMJTO-AWEZNQCLSA-N 1 1 334.420 2.022 20 5 EEBDMO C[N@H+](CCc1ccccc1O)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000344166278 161204175 /nfs/dbraw/zinc/20/41/75/161204175.db2.gz RKGVPMAIIMOXLI-UHFFFAOYSA-N 1 1 329.356 2.074 20 5 EEBDMO C[N@@H+](CCc1ccccc1O)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000344166278 161204176 /nfs/dbraw/zinc/20/41/76/161204176.db2.gz RKGVPMAIIMOXLI-UHFFFAOYSA-N 1 1 329.356 2.074 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3C[C@H](F)C[C@@H]3CO)o2)c1 ZINC000346394843 161369079 /nfs/dbraw/zinc/36/90/79/161369079.db2.gz HWZFBZJWXPNUOD-TZMCWYRMSA-N 1 1 335.335 2.197 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H](O)Cc1ccccc1)CCO2 ZINC000352707912 162252950 /nfs/dbraw/zinc/25/29/50/162252950.db2.gz DGCANRTVHWDIJN-KRWDZBQOSA-N 1 1 328.368 2.393 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H](O)Cc1ccccc1)CCO2 ZINC000352707912 162252954 /nfs/dbraw/zinc/25/29/54/162252954.db2.gz DGCANRTVHWDIJN-KRWDZBQOSA-N 1 1 328.368 2.393 20 5 EEBDMO COC(=O)COc1ccc(C[N@@H+]2CCS[C@H](C)C2)cc1[N+](=O)[O-] ZINC000355738642 163287071 /nfs/dbraw/zinc/28/70/71/163287071.db2.gz YUSDFVYHVGIDTF-LLVKDONJSA-N 1 1 340.401 2.084 20 5 EEBDMO COC(=O)COc1ccc(C[N@H+]2CCS[C@H](C)C2)cc1[N+](=O)[O-] ZINC000355738642 163287074 /nfs/dbraw/zinc/28/70/74/163287074.db2.gz YUSDFVYHVGIDTF-LLVKDONJSA-N 1 1 340.401 2.084 20 5 EEBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)s1 ZINC000364659796 165224620 /nfs/dbraw/zinc/22/46/20/165224620.db2.gz PXWMQSSKKKTPCU-VHSXEESVSA-N 1 1 345.446 2.099 20 5 EEBDMO O=C(C[NH+]1CCC(n2cccn2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000369120797 166194661 /nfs/dbraw/zinc/19/46/61/166194661.db2.gz YLZBLSMTCDMOMY-UHFFFAOYSA-N 1 1 329.360 2.067 20 5 EEBDMO CN(C(=O)C[N@H+]1CC[C@@H](C2CCOCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000374352747 167023609 /nfs/dbraw/zinc/02/36/09/167023609.db2.gz QDUNGQCOBMGSOH-OAHLLOKOSA-N 1 1 347.415 2.306 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C[C@H]1CCCOC1)c1ccc([N+](=O)[O-])cc1 ZINC000272584432 268994929 /nfs/dbraw/zinc/99/49/29/268994929.db2.gz YWGDELYRIBVXJR-CJNGLKHVSA-N 1 1 330.388 2.434 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)[C@H]2C1 ZINC000272674316 269006822 /nfs/dbraw/zinc/00/68/22/269006822.db2.gz UKDWBHQHQZZZDM-NHYWBVRUSA-N 1 1 337.807 2.343 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1N1CCC[C@@H]([N@@H+](C)Cc2ccccn2)CC1 ZINC000275630654 269132012 /nfs/dbraw/zinc/13/20/12/269132012.db2.gz JQMNAHPVXSCVRV-OAHLLOKOSA-N 1 1 344.419 2.214 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])[C@H](C)C1 ZINC000277764700 269180595 /nfs/dbraw/zinc/18/05/95/269180595.db2.gz KMONLRGLQAMXSI-OLZOCXBDSA-N 1 1 330.388 2.034 20 5 EEBDMO C[C@H]1C[N@@H+](CCCNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCCO1 ZINC000277912496 269197116 /nfs/dbraw/zinc/19/71/16/269197116.db2.gz GNJUEGTYFNHYTP-LBPRGKRZSA-N 1 1 338.364 2.416 20 5 EEBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1CCc1ccc([N+](=O)[O-])cc1 ZINC000278365937 269226559 /nfs/dbraw/zinc/22/65/59/269226559.db2.gz BNNYYZIPQPQUFS-OAHLLOKOSA-N 1 1 333.432 2.322 20 5 EEBDMO C[C@H]1C[N@@H+](CCCNC(=O)CCc2cccc([N+](=O)[O-])c2)CCCO1 ZINC000278444751 269232144 /nfs/dbraw/zinc/23/21/44/269232144.db2.gz HUQVTIUJJKLVSX-HNNXBMFYSA-N 1 1 349.431 2.145 20 5 EEBDMO Cn1cc([C@@H]2C[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@H]2CO)cn1 ZINC000278644333 269238642 /nfs/dbraw/zinc/23/86/42/269238642.db2.gz JFTMUPFBDWDZEB-XQTSXYSPSA-N 1 1 342.399 2.049 20 5 EEBDMO CO[C@@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1C ZINC000451558275 274064823 /nfs/dbraw/zinc/06/48/23/274064823.db2.gz FSWVELHISVDECK-APHBMKBZSA-N 1 1 333.388 2.057 20 5 EEBDMO CN(CC[N@@H+](C)C1CC1)C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000274532403 274204426 /nfs/dbraw/zinc/20/44/26/274204426.db2.gz BWFUFCIBQLHMPC-UHFFFAOYSA-N 1 1 327.331 2.239 20 5 EEBDMO C[C@@H]1C[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1CO ZINC000276880324 274273102 /nfs/dbraw/zinc/27/31/02/274273102.db2.gz ZYVAAOKPLZXDPG-KOLCDFICSA-N 1 1 329.194 2.418 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1CO ZINC000276880324 274273105 /nfs/dbraw/zinc/27/31/05/274273105.db2.gz ZYVAAOKPLZXDPG-KOLCDFICSA-N 1 1 329.194 2.418 20 5 EEBDMO CCOc1cc(C[N@H+]2CC[C@@H](CN3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000276917582 274273130 /nfs/dbraw/zinc/27/31/30/274273130.db2.gz ONOHTYQSPBUTLG-INIZCTEOSA-N 1 1 349.431 2.148 20 5 EEBDMO CCOc1cc(CN2CC[C@@H](C[NH+]3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000276917582 274273133 /nfs/dbraw/zinc/27/31/33/274273133.db2.gz ONOHTYQSPBUTLG-INIZCTEOSA-N 1 1 349.431 2.148 20 5 EEBDMO O=C(COc1cccc([N+](=O)[O-])c1)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000277404455 274290558 /nfs/dbraw/zinc/29/05/58/274290558.db2.gz BNYBNUGARWYVBA-OAHLLOKOSA-N 1 1 333.388 2.107 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](C[C@@H](O)Cn3cccn3)C2)cc1 ZINC000451542747 275037244 /nfs/dbraw/zinc/03/72/44/275037244.db2.gz ADBQANZBENUFCO-NVXWUHKLSA-N 1 1 330.388 2.032 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000288267362 275040796 /nfs/dbraw/zinc/04/07/96/275040796.db2.gz AWYOLGFRKCTDRH-ZDUSSCGKSA-N 1 1 343.449 2.135 20 5 EEBDMO CC[N@H+]1CCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000288480246 275062557 /nfs/dbraw/zinc/06/25/57/275062557.db2.gz PGNKLQLOMBLJRE-SNVBAGLBSA-N 1 1 343.786 2.482 20 5 EEBDMO Cc1cnn([C@@H]2CC[N@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)c1 ZINC000289855848 275155730 /nfs/dbraw/zinc/15/57/30/275155730.db2.gz KYFJCLKIVCDDAD-OAHLLOKOSA-N 1 1 344.371 2.413 20 5 EEBDMO Cc1cnn([C@@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)c1 ZINC000289855848 275155731 /nfs/dbraw/zinc/15/57/31/275155731.db2.gz KYFJCLKIVCDDAD-OAHLLOKOSA-N 1 1 344.371 2.413 20 5 EEBDMO C[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(=O)NCCF ZINC000291631027 275324736 /nfs/dbraw/zinc/32/47/36/275324736.db2.gz SHKXICOLRXRSDV-ZETCQYMHSA-N 1 1 338.166 2.465 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000170916501 276153248 /nfs/dbraw/zinc/15/32/48/276153248.db2.gz MZPPCVCSMZRJAC-QGZVFWFLSA-N 1 1 346.431 2.118 20 5 EEBDMO CCN1CCN(C[C@H](C)C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000293748283 293285699 /nfs/dbraw/zinc/28/56/99/293285699.db2.gz NZGFRRQBDCYQFS-CABCVRRESA-N 1 1 349.479 2.101 20 5 EEBDMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-] ZINC000491842218 297097299 /nfs/dbraw/zinc/09/72/99/297097299.db2.gz GLFXIYLWWJSOOH-BRDDXIKOSA-N 1 1 333.363 2.442 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000332419738 312004685 /nfs/dbraw/zinc/00/46/85/312004685.db2.gz PUNMJSUXDNVTOM-KRWDZBQOSA-N 1 1 346.431 2.118 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H](O)[C@H](CO)C3)o2)c1 ZINC000414559657 313041707 /nfs/dbraw/zinc/04/17/07/313041707.db2.gz PEKHBMUXXYOIIQ-BBRMVZONSA-N 1 1 332.356 2.030 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC([C@@H]2OCC[C@H]2[NH3+])CC1 ZINC000414792818 313090538 /nfs/dbraw/zinc/09/05/38/313090538.db2.gz SPRYFJVJURRBSU-AEFFLSMTSA-N 1 1 349.431 2.322 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420957499 314009622 /nfs/dbraw/zinc/00/96/22/314009622.db2.gz ZPMGXTGFLMZKIR-LLVKDONJSA-N 1 1 333.310 2.421 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H](CCO)CC1 ZINC000421007654 314022594 /nfs/dbraw/zinc/02/25/94/314022594.db2.gz CPJPUNYGMVZFKI-AWEZNQCLSA-N 1 1 335.404 2.326 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](CCO)CC1 ZINC000421007654 314022598 /nfs/dbraw/zinc/02/25/98/314022598.db2.gz CPJPUNYGMVZFKI-AWEZNQCLSA-N 1 1 335.404 2.326 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](CCO)CC1 ZINC000421019266 314027675 /nfs/dbraw/zinc/02/76/75/314027675.db2.gz PIUSHAANKWFVQX-KGLIPLIRSA-N 1 1 335.404 2.406 20 5 EEBDMO CCn1cc(C[N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])cn1 ZINC000525271584 317052534 /nfs/dbraw/zinc/05/25/34/317052534.db2.gz MBZLATMEFROSIV-UHFFFAOYSA-N 1 1 334.376 2.331 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000527044942 317145583 /nfs/dbraw/zinc/14/55/83/317145583.db2.gz TXWSMXYMIJUWLZ-GFCCVEGCSA-N 1 1 341.433 2.141 20 5 EEBDMO CNc1c(C(=O)NCc2c[nH+]c3n2CCCC3)cccc1[N+](=O)[O-] ZINC000552791531 318516162 /nfs/dbraw/zinc/51/61/62/318516162.db2.gz ATKPWVZAEFWEQW-UHFFFAOYSA-N 1 1 329.360 2.099 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@@H+]1Cc1ccccc1 ZINC000567092962 319347405 /nfs/dbraw/zinc/34/74/05/319347405.db2.gz UIZKABQWXFAGGX-CQSZACIVSA-N 1 1 342.399 2.280 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+]1Cc1ccccc1 ZINC000567092962 319347407 /nfs/dbraw/zinc/34/74/07/319347407.db2.gz UIZKABQWXFAGGX-CQSZACIVSA-N 1 1 342.399 2.280 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NCCc1c[nH+]cn1C ZINC000573173331 319909752 /nfs/dbraw/zinc/90/97/52/319909752.db2.gz UMOPIDAUUNCRMN-UHFFFAOYSA-N 1 1 338.751 2.423 20 5 EEBDMO C[C@@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)NCCF ZINC000337295187 465290638 /nfs/dbraw/zinc/29/06/38/465290638.db2.gz NRFQBVRTRFPXRL-LLVKDONJSA-N 1 1 335.335 2.419 20 5 EEBDMO C[C@@H](c1cnn(C)c1)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337329542 465309222 /nfs/dbraw/zinc/30/92/22/465309222.db2.gz ZSJSFAKQRMDRKP-LBPRGKRZSA-N 1 1 331.376 2.350 20 5 EEBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000347927496 465314134 /nfs/dbraw/zinc/31/41/34/465314134.db2.gz HZFGXNQKBVXWNI-NSHDSACASA-N 1 1 331.376 2.074 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c1 ZINC000154342073 462756572 /nfs/dbraw/zinc/75/65/72/462756572.db2.gz GKZZVHVYYXDBBW-WFASDCNBSA-N 1 1 333.388 2.160 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000047416176 462779653 /nfs/dbraw/zinc/77/96/53/462779653.db2.gz FAEZIQGWNQMQQN-GASCZTMLSA-N 1 1 349.431 2.458 20 5 EEBDMO C[N@H+]1CCC[C@H](CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000091482697 462883793 /nfs/dbraw/zinc/88/37/93/462883793.db2.gz UEHOGBOLVOKDOE-GFCCVEGCSA-N 1 1 332.404 2.241 20 5 EEBDMO CN(C(=O)c1ccc([N+](=O)[O-])c2cccnc12)[C@H]1CCC[N@@H+](C)C1 ZINC000156098342 462979768 /nfs/dbraw/zinc/97/97/68/462979768.db2.gz QGFIGHGHLYAKTA-LBPRGKRZSA-N 1 1 328.372 2.309 20 5 EEBDMO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H](CO)C(C)(C)C ZINC000134432212 463039542 /nfs/dbraw/zinc/03/95/42/463039542.db2.gz SIPNMYYGQZQXRU-ZDUSSCGKSA-N 1 1 334.376 2.484 20 5 EEBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H](CO)C(C)(C)C ZINC000134432212 463039544 /nfs/dbraw/zinc/03/95/44/463039544.db2.gz SIPNMYYGQZQXRU-ZDUSSCGKSA-N 1 1 334.376 2.484 20 5 EEBDMO CCOCC[N@H+](CC)[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000157550425 463143168 /nfs/dbraw/zinc/14/31/68/463143168.db2.gz ILXGDFIBAYFLNH-GFCCVEGCSA-N 1 1 339.392 2.289 20 5 EEBDMO CCOCC[N@@H+](CC)[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000157550425 463143174 /nfs/dbraw/zinc/14/31/74/463143174.db2.gz ILXGDFIBAYFLNH-GFCCVEGCSA-N 1 1 339.392 2.289 20 5 EEBDMO CCOc1ccc(C(=O)NC[C@@H]2CCC[N@@H+](CC)C2)cc1[N+](=O)[O-] ZINC000069138239 463211480 /nfs/dbraw/zinc/21/14/80/463211480.db2.gz PRIFNJPQMVUKEH-ZDUSSCGKSA-N 1 1 335.404 2.455 20 5 EEBDMO Cc1[nH+]ccn1CCCn1cc(Br)cc([N+](=O)[O-])c1=O ZINC000158245342 463218790 /nfs/dbraw/zinc/21/87/90/463218790.db2.gz YINFDSARNOOXBE-UHFFFAOYSA-N 1 1 341.165 2.114 20 5 EEBDMO CC(C)CN(CC[NH+](C)C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000104529099 463416538 /nfs/dbraw/zinc/41/65/38/463416538.db2.gz HPPRELLKWBIIGM-UHFFFAOYSA-N 1 1 333.392 2.131 20 5 EEBDMO Cc1[nH+]cc2n1C[C@H](C(=O)N1CCc3c1cccc3[N+](=O)[O-])CC2 ZINC000579482199 468365271 /nfs/dbraw/zinc/36/52/71/468365271.db2.gz KUCYBIBLAIZEAR-GFCCVEGCSA-N 1 1 326.356 2.251 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000059893805 463646595 /nfs/dbraw/zinc/64/65/95/463646595.db2.gz BNELZIGJBSDVGX-GFCCVEGCSA-N 1 1 341.433 2.141 20 5 EEBDMO O=C1CCCN1[C@H]1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000111294109 463674929 /nfs/dbraw/zinc/67/49/29/463674929.db2.gz HWYPVYUEOXXUAT-INIZCTEOSA-N 1 1 347.415 2.451 20 5 EEBDMO O=C1CCCN1[C@@H]1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000111294110 463676147 /nfs/dbraw/zinc/67/61/47/463676147.db2.gz HWYPVYUEOXXUAT-MRXNPFEDSA-N 1 1 347.415 2.451 20 5 EEBDMO C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCN(C)CC1 ZINC000127348176 463697321 /nfs/dbraw/zinc/69/73/21/463697321.db2.gz GCDYKCDHUNIFHK-YJBOKZPZSA-N 1 1 346.475 2.141 20 5 EEBDMO COC(=O)[C@@]1(C)CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000177460275 463709565 /nfs/dbraw/zinc/70/95/65/463709565.db2.gz FOBLWORKMVOKDE-INIZCTEOSA-N 1 1 346.343 2.030 20 5 EEBDMO COC(=O)[C@@]1(C)CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000177460275 463709571 /nfs/dbraw/zinc/70/95/71/463709571.db2.gz FOBLWORKMVOKDE-INIZCTEOSA-N 1 1 346.343 2.030 20 5 EEBDMO CCc1ccc(C(=O)N2CC[NH2+]C[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000261814761 463868006 /nfs/dbraw/zinc/86/80/06/463868006.db2.gz RUHMLHZNXGIHKH-KRWDZBQOSA-N 1 1 340.383 2.339 20 5 EEBDMO COC(=O)CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000269111652 463877655 /nfs/dbraw/zinc/87/76/55/463877655.db2.gz XDOOSACVGCCPBZ-UHFFFAOYSA-N 1 1 346.387 2.247 20 5 EEBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Cn3cncn3)CC2)c([N+](=O)[O-])c1 ZINC000194758229 463924103 /nfs/dbraw/zinc/92/41/03/463924103.db2.gz LOXYRSHVWGEYAK-UHFFFAOYSA-N 1 1 346.347 2.007 20 5 EEBDMO COC[C@@H](C)OC[C@@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000278809259 463990892 /nfs/dbraw/zinc/99/08/92/463990892.db2.gz ZNXOSXLSKHPERC-PBHICJAKSA-N 1 1 340.420 2.218 20 5 EEBDMO CCn1nc(C)c([N+](=O)[O-])c1NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000195342529 464044730 /nfs/dbraw/zinc/04/47/30/464044730.db2.gz FZSJTFYHNLRZCA-TXEJJXNPSA-N 1 1 339.440 2.419 20 5 EEBDMO CCn1nc(C)c([N+](=O)[O-])c1NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000195342529 464044734 /nfs/dbraw/zinc/04/47/34/464044734.db2.gz FZSJTFYHNLRZCA-TXEJJXNPSA-N 1 1 339.440 2.419 20 5 EEBDMO CCCCNC(=O)[C@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000269645938 464046202 /nfs/dbraw/zinc/04/62/02/464046202.db2.gz KZNIISJAZHWMSP-DOTOQJQBSA-N 1 1 349.431 2.257 20 5 EEBDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000269645951 464046425 /nfs/dbraw/zinc/04/64/25/464046425.db2.gz KZNIISJAZHWMSP-WBVHZDCISA-N 1 1 349.431 2.257 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H](CS(C)(=O)=O)C1 ZINC000292395687 464218058 /nfs/dbraw/zinc/21/80/58/464218058.db2.gz YJPWRTDWLKDWBI-CHWSQXEVSA-N 1 1 326.418 2.331 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](CS(C)(=O)=O)C1 ZINC000292395687 464218062 /nfs/dbraw/zinc/21/80/62/464218062.db2.gz YJPWRTDWLKDWBI-CHWSQXEVSA-N 1 1 326.418 2.331 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)c2cc([N+](=O)[O-])cnc2N)C1 ZINC000180533609 464331551 /nfs/dbraw/zinc/33/15/51/464331551.db2.gz SNBQKEGNRFUEPM-BETUJISGSA-N 1 1 349.435 2.060 20 5 EEBDMO C[C@@H](NC(=O)[C@H]1CCC[N@H+]1C1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000272146920 464496316 /nfs/dbraw/zinc/49/63/16/464496316.db2.gz WLGGWWJQKUTWIQ-CXAGYDPISA-N 1 1 347.415 2.415 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000175553728 464572948 /nfs/dbraw/zinc/57/29/48/464572948.db2.gz OVYBCFLFPLVTBY-JSGCOSHPSA-N 1 1 332.404 2.361 20 5 EEBDMO C[C@@H](C1CC1)[N@H+](Cc1ccccc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000246689416 464612243 /nfs/dbraw/zinc/61/22/43/464612243.db2.gz IJFKKTAAPXNTSJ-KBXCAEBGSA-N 1 1 344.415 2.453 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)CSc3ccc([N+](=O)[O-])cc3)[C@@H]2C1 ZINC000272540833 464652425 /nfs/dbraw/zinc/65/24/25/464652425.db2.gz BYOMHADDWNGOEY-IUODEOHRSA-N 1 1 335.429 2.240 20 5 EEBDMO O=C1NC[C@@H]2C[N@H+](Cc3cc(=O)oc4ccc5ccccc5c34)CCN12 ZINC000175919028 464659022 /nfs/dbraw/zinc/65/90/22/464659022.db2.gz UEBUNMSLFJUWSS-OAHLLOKOSA-N 1 1 349.390 2.156 20 5 EEBDMO O=C1NC[C@@H]2C[N@@H+](Cc3cc(=O)oc4ccc5ccccc5c34)CCN12 ZINC000175919028 464659025 /nfs/dbraw/zinc/65/90/25/464659025.db2.gz UEBUNMSLFJUWSS-OAHLLOKOSA-N 1 1 349.390 2.156 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1ccccn1 ZINC000295247296 464760183 /nfs/dbraw/zinc/76/01/83/464760183.db2.gz YVSBJCZYBMBRDY-UHFFFAOYSA-N 1 1 344.371 2.459 20 5 EEBDMO CCOC(=O)c1ccnc(N2[C@@H]3CC[C@H]2C[N@@H+](CC)CC3)c1[N+](=O)[O-] ZINC000176729442 464835533 /nfs/dbraw/zinc/83/55/33/464835533.db2.gz DALRRRHFUOGIGQ-OLZOCXBDSA-N 1 1 348.403 2.230 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCSCC[C@@H]1C ZINC000286253290 464854967 /nfs/dbraw/zinc/85/49/67/464854967.db2.gz SJNMDBKRGIVRIQ-NSHDSACASA-N 1 1 339.417 2.369 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCSCC[C@@H]1C ZINC000286253290 464854970 /nfs/dbraw/zinc/85/49/70/464854970.db2.gz SJNMDBKRGIVRIQ-NSHDSACASA-N 1 1 339.417 2.369 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](O)CC(C)(C)C1 ZINC000295617246 464904558 /nfs/dbraw/zinc/90/45/58/464904558.db2.gz YVKMLUSRNNPZTL-AWEZNQCLSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](O)CC(C)(C)C1 ZINC000295617246 464904566 /nfs/dbraw/zinc/90/45/66/464904566.db2.gz YVKMLUSRNNPZTL-AWEZNQCLSA-N 1 1 335.404 2.325 20 5 EEBDMO O=C(CCCC[NH+]1CCOCC1)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000352183280 465496768 /nfs/dbraw/zinc/49/67/68/465496768.db2.gz BMPNMSWKKYGKMH-UHFFFAOYSA-N 1 1 325.340 2.175 20 5 EEBDMO C[C@@]1(O)CCC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CC1 ZINC000348381883 465574938 /nfs/dbraw/zinc/57/49/38/465574938.db2.gz WTJNKUYNOFPBMJ-QGZVFWFLSA-N 1 1 349.387 2.130 20 5 EEBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000356870068 465589461 /nfs/dbraw/zinc/58/94/61/465589461.db2.gz CXIHTJGAAKBKPL-QWHCGFSZSA-N 1 1 330.388 2.101 20 5 EEBDMO Cc1c(NC(=O)CCN2CC[N@H+](C)CC2(C)C)cccc1[N+](=O)[O-] ZINC000330560904 465706397 /nfs/dbraw/zinc/70/63/97/465706397.db2.gz HZIRLNWXWSAOPO-UHFFFAOYSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCN(C)CC2(C)C)cccc1[N+](=O)[O-] ZINC000330560904 465706404 /nfs/dbraw/zinc/70/64/04/465706404.db2.gz HZIRLNWXWSAOPO-UHFFFAOYSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CCN(C)CC2(C)C)cccc1[N+](=O)[O-] ZINC000330560904 465706407 /nfs/dbraw/zinc/70/64/07/465706407.db2.gz HZIRLNWXWSAOPO-UHFFFAOYSA-N 1 1 334.420 2.258 20 5 EEBDMO Cc1[nH+]ccn1CCCNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000338092608 465814612 /nfs/dbraw/zinc/81/46/12/465814612.db2.gz WYFUCQMNWPEFBT-UHFFFAOYSA-N 1 1 331.376 2.331 20 5 EEBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000331028342 465903207 /nfs/dbraw/zinc/90/32/07/465903207.db2.gz CZRCEWBYVCVGMU-CYBMUJFWSA-N 1 1 341.433 2.054 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C[C@H](CO)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000353511427 465943508 /nfs/dbraw/zinc/94/35/08/465943508.db2.gz OXFYUSVHINOBIW-ZBFHGGJFSA-N 1 1 330.388 2.026 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@](C)(O)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000353521963 465951523 /nfs/dbraw/zinc/95/15/23/465951523.db2.gz SUUYVYDUEZCIPI-DOTOQJQBSA-N 1 1 330.388 2.168 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000331422194 466078181 /nfs/dbraw/zinc/07/81/81/466078181.db2.gz UNRMNWZYLLCSKS-VFZGTOFNSA-N 1 1 339.342 2.014 20 5 EEBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])n2C)C1 ZINC000340506295 466138034 /nfs/dbraw/zinc/13/80/34/466138034.db2.gz JNAHEVXNNDMYLM-MJBXVCDLSA-N 1 1 334.420 2.411 20 5 EEBDMO O=C([C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1)N1CCCC1 ZINC000331696109 466201300 /nfs/dbraw/zinc/20/13/00/466201300.db2.gz VLWYAAMUOGCUHU-INIZCTEOSA-N 1 1 331.416 2.472 20 5 EEBDMO CC(C)[N@@H+](C)C[C@H](C)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000349797496 466243825 /nfs/dbraw/zinc/24/38/25/466243825.db2.gz GAOBMEWNKFGVMM-JTQLQIEISA-N 1 1 349.840 2.255 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)c1 ZINC000338607525 466255780 /nfs/dbraw/zinc/25/57/80/466255780.db2.gz ORAKWUHARRYXIG-INIZCTEOSA-N 1 1 335.404 2.406 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000372327744 466304952 /nfs/dbraw/zinc/30/49/52/466304952.db2.gz XYQMJRXIHUAPQO-CHWSQXEVSA-N 1 1 340.383 2.500 20 5 EEBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@]1(CO)CCOC1 ZINC000600178243 468485735 /nfs/dbraw/zinc/48/57/35/468485735.db2.gz ITNDIPVNPVMXBG-QGZVFWFLSA-N 1 1 332.356 2.438 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@@H](Oc3ccncc3)C2)c1 ZINC000305204215 466377809 /nfs/dbraw/zinc/37/78/09/466377809.db2.gz XFWREHRFUGJWFE-SJORKVTESA-N 1 1 329.356 2.177 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000354223118 466393052 /nfs/dbraw/zinc/39/30/52/466393052.db2.gz NFTBRFOCUQEPTF-UONOGXRCSA-N 1 1 334.420 2.338 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000363798829 466622560 /nfs/dbraw/zinc/62/25/60/466622560.db2.gz DJORWKOXYOYAGA-UONOGXRCSA-N 1 1 348.403 2.196 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@](O)(C2CC2)C1 ZINC000373228834 466735562 /nfs/dbraw/zinc/73/55/62/466735562.db2.gz JGAQXSXMTHMLHM-QGZVFWFLSA-N 1 1 333.388 2.079 20 5 EEBDMO Cc1c(CC(=O)N2CC[NH2+]C[C@@H]2c2cccnc2)cccc1[N+](=O)[O-] ZINC000423616792 466787104 /nfs/dbraw/zinc/78/71/04/466787104.db2.gz SIOIEXBVOKRKSX-QGZVFWFLSA-N 1 1 340.383 2.014 20 5 EEBDMO Cc1cc(C(=O)N2CC[NH2+]C[C@H]2c2ccncc2)cc([N+](=O)[O-])c1 ZINC000423958792 466928489 /nfs/dbraw/zinc/92/84/89/466928489.db2.gz QUJJNXKMRKMJHN-INIZCTEOSA-N 1 1 326.356 2.085 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000412074533 466996393 /nfs/dbraw/zinc/99/63/93/466996393.db2.gz RDNBMHYJONQTMA-YVEFUNNKSA-N 1 1 349.387 2.197 20 5 EEBDMO COC(=O)[C@]1(C)CCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000412074533 466996399 /nfs/dbraw/zinc/99/63/99/466996399.db2.gz RDNBMHYJONQTMA-YVEFUNNKSA-N 1 1 349.387 2.197 20 5 EEBDMO CCOc1cc(C[N@@H+]2CCC[C@H](n3ccnn3)C2)ccc1[N+](=O)[O-] ZINC000425515162 467103726 /nfs/dbraw/zinc/10/37/26/467103726.db2.gz QKUWIFJBOGWCGP-AWEZNQCLSA-N 1 1 331.376 2.422 20 5 EEBDMO CCOc1cc(C[N@H+]2CCC[C@H](n3ccnn3)C2)ccc1[N+](=O)[O-] ZINC000425515162 467103727 /nfs/dbraw/zinc/10/37/27/467103727.db2.gz QKUWIFJBOGWCGP-AWEZNQCLSA-N 1 1 331.376 2.422 20 5 EEBDMO O=[N+]([O-])c1ccc2ccnc(NC[C@@H]3C[N@@H+](C4CC4)CCO3)c2c1 ZINC000413124380 467174401 /nfs/dbraw/zinc/17/44/01/467174401.db2.gz FPFNWUNMKBXUEC-OAHLLOKOSA-N 1 1 328.372 2.418 20 5 EEBDMO O=[N+]([O-])c1ccc2ccnc(NC[C@@H]3C[N@H+](C4CC4)CCO3)c2c1 ZINC000413124380 467174403 /nfs/dbraw/zinc/17/44/03/467174403.db2.gz FPFNWUNMKBXUEC-OAHLLOKOSA-N 1 1 328.372 2.418 20 5 EEBDMO C[N@@H+](CCCO)C1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413147827 467179022 /nfs/dbraw/zinc/17/90/22/467179022.db2.gz WMCWADOSNOZERA-UHFFFAOYSA-N 1 1 344.415 2.426 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCSC[C@H]2C2CCC2)c([N+](=O)[O-])c1 ZINC000419380853 467194912 /nfs/dbraw/zinc/19/49/12/467194912.db2.gz XSWDVAQVYAZMER-HNNXBMFYSA-N 1 1 335.429 2.411 20 5 EEBDMO CN(C)CC[N@@H+](C)CCCNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413303032 467211554 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CC[N@H+]1CCCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000736570052 578212038 /nfs/dbraw/zinc/21/20/38/578212038.db2.gz NBHFZJQNLIWCTK-GFCCVEGCSA-N 1 1 331.380 2.061 20 5 EEBDMO O=[N+]([O-])c1ccc(CCCC[NH2+]Cc2ccc(-c3nn[nH]n3)o2)cc1 ZINC000823635494 599450051 /nfs/dbraw/zinc/45/00/51/599450051.db2.gz YCGFLSRZXYBZQF-UHFFFAOYSA-N 1 1 342.359 2.480 20 5 EEBDMO COC(=O)C[C@H]1CCC[N@H+]1Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000179549004 679943625 /nfs/dbraw/zinc/94/36/25/679943625.db2.gz DDOUEPPWEGUNIN-GFCCVEGCSA-N 1 1 332.360 2.238 20 5 EEBDMO COc1c(O)ccc(CN2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1[N+](=O)[O-] ZINC000894622880 683001686 /nfs/dbraw/zinc/00/16/86/683001686.db2.gz LMKVICSFMVUFJA-KRWDZBQOSA-N 1 1 335.404 2.227 20 5 EEBDMO CCc1cccc(C[N@@H+](C)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c1 ZINC000985432153 686709018 /nfs/dbraw/zinc/70/90/18/686709018.db2.gz WSRNVDKQJSEAEZ-QZTJIDSGSA-N 1 1 345.443 2.337 20 5 EEBDMO CCc1cccc(C[N@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC000985432153 686709021 /nfs/dbraw/zinc/70/90/21/686709021.db2.gz WSRNVDKQJSEAEZ-QZTJIDSGSA-N 1 1 345.443 2.337 20 5 EEBDMO CCc1cccc(C[N@@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC000985432153 686709027 /nfs/dbraw/zinc/70/90/27/686709027.db2.gz WSRNVDKQJSEAEZ-QZTJIDSGSA-N 1 1 345.443 2.337 20 5 EEBDMO CN(C(=O)c1cocn1)C1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001005161846 1194637763 /nfs/dbraw/zinc/63/77/63/1194637763.db2.gz BAZBCLLJBAHTPD-UHFFFAOYSA-N 1 1 344.371 2.319 20 5 EEBDMO CCc1ccc(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001034644739 1196466430 /nfs/dbraw/zinc/46/64/30/1196466430.db2.gz LLXKJCAVMGUUDD-BRSBDYLESA-N 1 1 345.443 2.431 20 5 EEBDMO C[C@]1(C(N)=O)CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000794716473 1197910236 /nfs/dbraw/zinc/91/02/36/1197910236.db2.gz URAUVAJLYCEUNG-AWEZNQCLSA-N 1 1 336.373 2.027 20 5 EEBDMO C[C@]1(C(N)=O)CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000794716473 1197910239 /nfs/dbraw/zinc/91/02/39/1197910239.db2.gz URAUVAJLYCEUNG-AWEZNQCLSA-N 1 1 336.373 2.027 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1Cn1cc(C[NH+]2CCC(C)CC2)nn1 ZINC000883994984 1202193607 /nfs/dbraw/zinc/19/36/07/1202193607.db2.gz UDNWOBOSQPONPU-UHFFFAOYSA-N 1 1 345.403 2.475 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)NCCCN(C)c1cc(C)ccc1[N+](=O)[O-] ZINC001095680890 1205912744 /nfs/dbraw/zinc/91/27/44/1205912744.db2.gz WYYLJDVAXPRFHQ-UHFFFAOYSA-N 1 1 345.403 2.051 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CCn3cccc3C2)c([N+](=O)[O-])c1 ZINC000932527761 1207623633 /nfs/dbraw/zinc/62/36/33/1207623633.db2.gz HYEMVGYHWWUEMZ-UHFFFAOYSA-N 1 1 344.371 2.249 20 5 EEBDMO C[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cc(-c2ccccc2)n[nH]1 ZINC000934412524 1207956640 /nfs/dbraw/zinc/95/66/40/1207956640.db2.gz DRLRESBMLXYETM-UHFFFAOYSA-N 1 1 326.360 2.313 20 5 EEBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cc(-c2ccccc2)n[nH]1 ZINC000934412524 1207956644 /nfs/dbraw/zinc/95/66/44/1207956644.db2.gz DRLRESBMLXYETM-UHFFFAOYSA-N 1 1 326.360 2.313 20 5 EEBDMO COC(=O)CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCOCC1 ZINC000076144644 1209071266 /nfs/dbraw/zinc/07/12/66/1209071266.db2.gz XZKRNAKPGLXPPY-UHFFFAOYSA-N 1 1 336.388 2.181 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(Cn3ncc4cc([N+](=O)[O-])ccc43)CC[C@H]21 ZINC000247093714 1213632634 /nfs/dbraw/zinc/63/26/34/1213632634.db2.gz PNYKMYZMUMGSDG-CZUORRHYSA-N 1 1 329.404 2.318 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)N[C@H]1C[C@@H](Nc2cccc(F)c2[N+](=O)[O-])C1 ZINC001097189932 1243827281 /nfs/dbraw/zinc/82/72/81/1243827281.db2.gz JWRUTNSUEHAKPX-TXEJJXNPSA-N 1 1 338.383 2.133 20 5 EEBDMO CC(C)CC[N@H+]1CCc2c(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cccc2C1 ZINC001051291322 1245487510 /nfs/dbraw/zinc/48/75/10/1245487510.db2.gz PKRGUVOXBGWRKN-QZTJIDSGSA-N 1 1 345.443 2.372 20 5 EEBDMO CC(C)CC[N@@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001051291322 1245487516 /nfs/dbraw/zinc/48/75/16/1245487516.db2.gz PKRGUVOXBGWRKN-QZTJIDSGSA-N 1 1 345.443 2.372 20 5 EEBDMO CC(C)CC[N@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001051291322 1245487523 /nfs/dbraw/zinc/48/75/23/1245487523.db2.gz PKRGUVOXBGWRKN-QZTJIDSGSA-N 1 1 345.443 2.372 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)N(C)CCNc1cccc(F)c1[N+](=O)[O-] ZINC001101830156 1246218792 /nfs/dbraw/zinc/21/87/92/1246218792.db2.gz LNWAHTHBASQTOS-UHFFFAOYSA-N 1 1 340.399 2.335 20 5 EEBDMO CCCCOCC(=O)N1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001195410730 1283558150 /nfs/dbraw/zinc/55/81/50/1283558150.db2.gz FIWSGYCINCLJRL-UHFFFAOYSA-N 1 1 349.431 2.446 20 5 EEBDMO CCCCOCC(=O)N1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001195410730 1283558159 /nfs/dbraw/zinc/55/81/59/1283558159.db2.gz FIWSGYCINCLJRL-UHFFFAOYSA-N 1 1 349.431 2.446 20 5 EEBDMO C[N@@H+](CC1=CCCOC1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000853561727 1292416494 /nfs/dbraw/zinc/41/64/94/1292416494.db2.gz OXPYPYXTUUNQBG-UHFFFAOYSA-N 1 1 329.360 2.089 20 5 EEBDMO C[N@H+](CC1=CCCOC1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000853561727 1292416501 /nfs/dbraw/zinc/41/65/01/1292416501.db2.gz OXPYPYXTUUNQBG-UHFFFAOYSA-N 1 1 329.360 2.089 20 5 EEBDMO Cc1ccc(Nc2cnc(N3CC[NH+](C)CC3)nc2)c([N+](=O)[O-])c1 ZINC001214167603 1296328966 /nfs/dbraw/zinc/32/89/66/1296328966.db2.gz OZDYBCPRFWIZGS-UHFFFAOYSA-N 1 1 328.376 2.189 20 5 EEBDMO C[C@@]1(O)CCC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000794666066 1296505972 /nfs/dbraw/zinc/50/59/72/1296505972.db2.gz IUUSTUVUDNWNSA-MRXNPFEDSA-N 1 1 331.376 2.048 20 5 EEBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCN(Cc3cncs3)CC2)cc1 ZINC000931361345 1297158664 /nfs/dbraw/zinc/15/86/64/1297158664.db2.gz FXZIHUNDBQQLLR-UHFFFAOYSA-N 1 1 332.429 2.412 20 5 EEBDMO Cc1cc(NCCN(C)C(=O)C[N@@H+](C)C2CCC2)ccc1[N+](=O)[O-] ZINC001102017067 1300145681 /nfs/dbraw/zinc/14/56/81/1300145681.db2.gz CDVLXEOYAVKKRK-UHFFFAOYSA-N 1 1 334.420 2.258 20 5 EEBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3ccc(C)c([N+](=O)[O-])c3)C[C@H]1[N@H+]2C ZINC001226953240 1301623764 /nfs/dbraw/zinc/62/37/64/1301623764.db2.gz WTPFNGRBOYJPFP-GUDXXQAFSA-N 1 1 334.372 2.449 20 5 EEBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1Oc1nc[nH]c(=O)c1[N+](=O)[O-] ZINC001228143177 1302123812 /nfs/dbraw/zinc/12/38/12/1302123812.db2.gz JXHNYRVZFQHYOG-TZMCWYRMSA-N 1 1 344.371 2.380 20 5 EEBDMO CC(=O)Nc1cc(O[C@@H]2C[NH+]3CCC2CC3)c(C(C)=O)cc1[N+](=O)[O-] ZINC001229128182 1302632582 /nfs/dbraw/zinc/63/25/82/1302632582.db2.gz NKPCWRKPGRIHOJ-QGZVFWFLSA-N 1 1 347.371 2.229 20 5 EEBDMO C[C@H](Oc1[nH+][nH]cc2nncc1-2)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC001230896938 1303531598 /nfs/dbraw/zinc/53/15/98/1303531598.db2.gz WJLMURMPQASZCU-ZETCQYMHSA-N 1 1 329.272 2.130 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCC1(Nc2ccccc2[N+](=O)[O-])CCC1 ZINC001111827994 1303957352 /nfs/dbraw/zinc/95/73/52/1303957352.db2.gz LPBHLEOVODXUNZ-UHFFFAOYSA-N 1 1 334.420 2.387 20 5 EEBDMO O=C1NCC[C@@]12CC[N@@H+](Cc1ccc3ccc4cccnc4c3n1)C2 ZINC001232221029 1304042743 /nfs/dbraw/zinc/04/27/43/1304042743.db2.gz VWYRBCQNJLWTOZ-FQEVSTJZSA-N 1 1 332.407 2.495 20 5 EEBDMO Cn1cccc1C(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001234034433 1304699435 /nfs/dbraw/zinc/69/94/35/1304699435.db2.gz DJXFGHLEJCVGNB-UHFFFAOYSA-N 1 1 330.388 2.185 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000839706627 1315235555 /nfs/dbraw/zinc/23/55/55/1315235555.db2.gz YMRPZYWEAZFERT-BRSBDYLESA-N 1 1 343.427 2.165 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000839706627 1315235558 /nfs/dbraw/zinc/23/55/58/1315235558.db2.gz YMRPZYWEAZFERT-BRSBDYLESA-N 1 1 343.427 2.165 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000839706627 1315235562 /nfs/dbraw/zinc/23/55/62/1315235562.db2.gz YMRPZYWEAZFERT-BRSBDYLESA-N 1 1 343.427 2.165 20 5 EEBDMO COC[C@H]1C[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2ncn(C)c21 ZINC001254596912 1318138132 /nfs/dbraw/zinc/13/81/32/1318138132.db2.gz QUHUEVUQLNEDPQ-ZBFHGGJFSA-N 1 1 342.399 2.041 20 5 EEBDMO COC[C@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2ncn(C)c21 ZINC001254596912 1318138143 /nfs/dbraw/zinc/13/81/43/1318138143.db2.gz QUHUEVUQLNEDPQ-ZBFHGGJFSA-N 1 1 342.399 2.041 20 5 EEBDMO Cc1c(C)c(N2CCN(CC3CC[NH+](C)CC3)CC2)ncc1[N+](=O)[O-] ZINC001157837695 1318897691 /nfs/dbraw/zinc/89/76/91/1318897691.db2.gz FTHOFHOTGCNSEY-UHFFFAOYSA-N 1 1 347.463 2.070 20 5 EEBDMO [NH3+][C@@H]1CN(c2cc3ncnc(Cl)c3cc2[N+](=O)[O-])CCC1(F)F ZINC001164319152 1321350762 /nfs/dbraw/zinc/35/07/62/1321350762.db2.gz ALQDVWMXFOXDKP-LLVKDONJSA-N 1 1 343.721 2.364 20 5 EEBDMO Cc1ncc2n1CCN(c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C2 ZINC001165385857 1321512913 /nfs/dbraw/zinc/51/29/13/1321512913.db2.gz XUSDDGNFVBDTJF-SNAWJCMRSA-N 1 1 328.376 2.047 20 5 EEBDMO COC(=O)c1cc(C)nc(NCC[N@H+]2CCC(C)(C)C2)c1[N+](=O)[O-] ZINC001307230366 1329955030 /nfs/dbraw/zinc/95/50/30/1329955030.db2.gz UBQWHRNPZMHKCJ-UHFFFAOYSA-N 1 1 336.392 2.229 20 5 EEBDMO CC[N@H+]1CC[C@H]1CNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC001311046471 1331748011 /nfs/dbraw/zinc/74/80/11/1331748011.db2.gz UWDCDPMNZBQXHD-VIFPVBQESA-N 1 1 327.772 2.046 20 5 EEBDMO O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCC[N@H+]2CCC[C@H]2C1 ZINC001319579720 1332724338 /nfs/dbraw/zinc/72/43/38/1332724338.db2.gz PYNCUPDLOIYMEG-LBPRGKRZSA-N 1 1 328.372 2.386 20 5 EEBDMO C[N@@H+](CCNc1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1)C1CCCCC1 ZINC001609276224 1351918431 /nfs/dbraw/zinc/91/84/31/1351918431.db2.gz ULZGONPCOVPQGI-UHFFFAOYSA-N 1 1 345.407 2.451 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NCCN(C)c1cccc(F)c1[N+](=O)[O-] ZINC001100203739 1338156722 /nfs/dbraw/zinc/15/67/22/1338156722.db2.gz DCLQHQOALZEKND-UHFFFAOYSA-N 1 1 340.399 2.017 20 5 EEBDMO C[C@@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@H]1C[NH3+] ZINC001576811223 1344064703 /nfs/dbraw/zinc/06/47/03/1344064703.db2.gz CRZJFWYKJBVTLA-YPMHNXCESA-N 1 1 331.376 2.062 20 5 EEBDMO CCN(Cc1ccncc1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC001577740012 1344189091 /nfs/dbraw/zinc/18/90/91/1344189091.db2.gz ATJIYLBKWXUKIP-QGZVFWFLSA-N 1 1 328.372 2.212 20 5 EEBDMO C[S@](=O)c1cccc(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)c1 ZINC001579357642 1344374324 /nfs/dbraw/zinc/37/43/24/1344374324.db2.gz JNBSUIRBFVSLMU-GYCJOSAFSA-N 1 1 347.396 2.145 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H](CNc2ccc(-c3nn[nH]n3)c([N+](=O)[O-])c2)C1 ZINC001589715498 1349023547 /nfs/dbraw/zinc/02/35/47/1349023547.db2.gz WCJLCDZBXKTKRF-LBPRGKRZSA-N 1 1 345.407 2.307 20 5 EEBDMO Cc1[nH+]ccn1CCCC[NH2+][C@@](C)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001600756914 1350130087 /nfs/dbraw/zinc/13/00/87/1350130087.db2.gz OBSBVSVGJRSOOK-QGZVFWFLSA-N 1 1 346.387 2.470 20 5 EEBDMO Cc1cccc(NCCNc2ccc(-c3nn[nH]n3)c([N+](=O)[O-])c2)[nH+]1 ZINC001605919563 1351253737 /nfs/dbraw/zinc/25/37/37/1351253737.db2.gz GQMPIHMPXARWKE-UHFFFAOYSA-N 1 1 340.347 2.002 20 5 EEBDMO CC(C)(C)OCC(=O)N1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001195563028 1368558912 /nfs/dbraw/zinc/55/89/12/1368558912.db2.gz RWEPMZJFQTXAMS-UHFFFAOYSA-N 1 1 349.431 2.444 20 5 EEBDMO CC(C)(C)OCC(=O)N1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001195563028 1368558919 /nfs/dbraw/zinc/55/89/19/1368558919.db2.gz RWEPMZJFQTXAMS-UHFFFAOYSA-N 1 1 349.431 2.444 20 5 EEBDMO [NH3+][C@@H]1C[C@@H](NCCc2ccc(Cl)cc2[N+](=O)[O-])C12CCOCC2 ZINC001580162778 1403840589 /nfs/dbraw/zinc/84/05/89/1403840589.db2.gz FPICKKIEKGRUCA-HUUCEWRRSA-N 1 1 339.823 2.277 20 5 EEBDMO N[C@@H]1C[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C12CCOCC2 ZINC001580162778 1403840599 /nfs/dbraw/zinc/84/05/99/1403840599.db2.gz FPICKKIEKGRUCA-HUUCEWRRSA-N 1 1 339.823 2.277 20 5 EEBDMO CC(C)(C)CCC[N@H+]1CCCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1 ZINC001755455579 1407479348 /nfs/dbraw/zinc/47/93/48/1407479348.db2.gz RCNZCLIQDKGGKO-HUUCEWRRSA-N 1 1 337.464 2.402 20 5 EEBDMO CC(C)(C)CCC[N@@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC001755455579 1407479353 /nfs/dbraw/zinc/47/93/53/1407479353.db2.gz RCNZCLIQDKGGKO-HUUCEWRRSA-N 1 1 337.464 2.402 20 5 EEBDMO CC(C)(C)CCC[N@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC001755455579 1407479357 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338.404 2.465 20 5 EEBDMO O=C1CC[C@H]([NH2+]Cc2c(F)cc([N+](=O)[O-])cc2F)[C@H](C2CC2)N1 ZINC000352372614 162109618 /nfs/dbraw/zinc/10/96/18/162109618.db2.gz UQHNZXWKNMEFSH-ZFWWWQNUSA-N 1 1 325.315 2.020 20 5 EEBDMO C[C@H]1C[NH+](CCN(C)Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@H](C)O1 ZINC000352403789 162123043 /nfs/dbraw/zinc/12/30/43/162123043.db2.gz YCNYLOMXAXZEBV-RYUDHWBXSA-N 1 1 343.374 2.414 20 5 EEBDMO CCC[N@@H+](CC)C[C@H](C)NS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000352587179 162201026 /nfs/dbraw/zinc/20/10/26/162201026.db2.gz ZXNUYRXYOPYRCT-ZDUSSCGKSA-N 1 1 343.449 2.302 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000367839580 166008929 /nfs/dbraw/zinc/00/89/29/166008929.db2.gz BJWWJJVRJJUQCB-LBPRGKRZSA-N 1 1 344.371 2.417 20 5 EEBDMO Cc1cccc(NCCNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[nH+]1 ZINC000359751161 164165081 /nfs/dbraw/zinc/16/50/81/164165081.db2.gz JOWKXTATSOJMJA-UHFFFAOYSA-N 1 1 340.343 2.016 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)cc1OC(F)F ZINC000364293651 165084490 /nfs/dbraw/zinc/08/44/90/165084490.db2.gz ZBLPAYQRVRBRSG-NWDGAFQWSA-N 1 1 343.330 2.471 20 5 EEBDMO CC(C)c1ccc(C(=O)NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)cc1[N+](=O)[O-] ZINC000364801834 165279419 /nfs/dbraw/zinc/27/94/19/165279419.db2.gz PVBUPLYGXGCTBA-CABCVRRESA-N 1 1 347.415 2.311 20 5 EEBDMO COc1ccc(C[NH+]2CCC([C@H](O)c3ncc[nH]3)CC2)cc1[N+](=O)[O-] ZINC000369140425 166197997 /nfs/dbraw/zinc/19/79/97/166197997.db2.gz SBZUABIBAJAOMZ-INIZCTEOSA-N 1 1 346.387 2.272 20 5 EEBDMO O=C(/C=C/c1ccccc1[N+](=O)[O-])NCc1c[nH+]c2n1CCCC2 ZINC000376769350 167389574 /nfs/dbraw/zinc/38/95/74/167389574.db2.gz QZLQXSBDYVSERU-CMDGGOBGSA-N 1 1 326.356 2.457 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C2OCCO2)C1 ZINC000171377765 227048665 /nfs/dbraw/zinc/04/86/65/227048665.db2.gz CWIJOHCYJDSUHI-OLZOCXBDSA-N 1 1 349.387 2.007 20 5 EEBDMO CC(C)Oc1cccc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1 ZINC000120572424 221615412 /nfs/dbraw/zinc/61/54/12/221615412.db2.gz GAVRHUKVVCBOJZ-INIZCTEOSA-N 1 1 348.403 2.071 20 5 EEBDMO CC1(C)C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@H]1O ZINC000275533185 269122115 /nfs/dbraw/zinc/12/21/15/269122115.db2.gz XKAAIHCIRLNLRG-CQSZACIVSA-N 1 1 339.367 2.155 20 5 EEBDMO O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000277626773 269164956 /nfs/dbraw/zinc/16/49/56/269164956.db2.gz WWMFROJMQYAOOR-HNNXBMFYSA-N 1 1 333.388 2.107 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000277747770 269178190 /nfs/dbraw/zinc/17/81/90/269178190.db2.gz BURCILHIRBPQJC-CQSZACIVSA-N 1 1 333.388 2.350 20 5 EEBDMO COC[C@H](C)OC[C@H](O)C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000278139181 269210969 /nfs/dbraw/zinc/21/09/69/269210969.db2.gz WGWQWWREFKNOLS-SMDDNHRTSA-N 1 1 346.811 2.092 20 5 EEBDMO COC[C@H](C)OC[C@H](O)C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000278139181 269210970 /nfs/dbraw/zinc/21/09/70/269210970.db2.gz WGWQWWREFKNOLS-SMDDNHRTSA-N 1 1 346.811 2.092 20 5 EEBDMO CCC(=O)c1ccc(N2CC[NH+](C3CCOCC3)CC2)c([N+](=O)[O-])c1 ZINC000280155611 269333109 /nfs/dbraw/zinc/33/31/09/269333109.db2.gz BOUJYCDJGWIXIE-UHFFFAOYSA-N 1 1 347.415 2.489 20 5 EEBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](CC(N)=O)c1ccccc1 ZINC000280656282 269383089 /nfs/dbraw/zinc/38/30/89/269383089.db2.gz ZODRLKYIBKMQCB-IRXDYDNUSA-N 1 1 343.383 2.177 20 5 EEBDMO C[C@H](C(=O)N(C)CCc1ccccc1[N+](=O)[O-])[NH+]1CCSCC1 ZINC000288154219 275029626 /nfs/dbraw/zinc/02/96/26/275029626.db2.gz DLUUTSOKLLKUPV-CYBMUJFWSA-N 1 1 337.445 2.033 20 5 EEBDMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000288417586 275056134 /nfs/dbraw/zinc/05/61/34/275056134.db2.gz NQFRKJBYPUIXPV-UHFFFAOYSA-N 1 1 340.383 2.133 20 5 EEBDMO C[C@@H]1[C@H]([NH+]2CCOCC2)CCN1c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000291206573 275282005 /nfs/dbraw/zinc/28/20/05/275282005.db2.gz UYCQLOVGAYRBCZ-CXAGYDPISA-N 1 1 342.399 2.442 20 5 EEBDMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000291727857 275334187 /nfs/dbraw/zinc/33/41/87/275334187.db2.gz AHTNIFZTPGYSKR-CYBMUJFWSA-N 1 1 345.403 2.239 20 5 EEBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)C2)C1 ZINC000292121905 275379698 /nfs/dbraw/zinc/37/96/98/275379698.db2.gz GPXKVIRRPWMUPN-SFHVURJKSA-N 1 1 344.415 2.337 20 5 EEBDMO C[N@H+]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C(C)(C)C1 ZINC000271042701 277109816 /nfs/dbraw/zinc/10/98/16/277109816.db2.gz NJVYHGQTLQURBD-UHFFFAOYSA-N 1 1 331.376 2.171 20 5 EEBDMO Cc1cc(N2CCC(NC(=O)CCC(C)(C)[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000295380585 293700769 /nfs/dbraw/zinc/70/07/69/293700769.db2.gz SHEFODBXQSGQJK-UHFFFAOYSA-N 1 1 349.435 2.014 20 5 EEBDMO C[N@@H+](Cc1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1)[C@H]1CCSC1 ZINC000350606618 312334272 /nfs/dbraw/zinc/33/42/72/312334272.db2.gz MPKVSAGCYKZIFB-JTQLQIEISA-N 1 1 335.389 2.164 20 5 EEBDMO C[N@H+](Cc1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1)[C@H]1CCSC1 ZINC000350606618 312334271 /nfs/dbraw/zinc/33/42/71/312334271.db2.gz MPKVSAGCYKZIFB-JTQLQIEISA-N 1 1 335.389 2.164 20 5 EEBDMO CCc1n[nH]c(C(=O)NC[C@@H]2CCCC[N@H+]2CC(C)C)c1[N+](=O)[O-] ZINC000440317942 315123780 /nfs/dbraw/zinc/12/37/80/315123780.db2.gz QUSSNFHCHAYTRA-LBPRGKRZSA-N 1 1 337.424 2.121 20 5 EEBDMO CCC[C@@H]1C[NH2+]CCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000440834479 315153808 /nfs/dbraw/zinc/15/38/08/315153808.db2.gz RAFHRLKEKLNVDA-LLVKDONJSA-N 1 1 347.824 2.011 20 5 EEBDMO CC(C)[C@H](C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])N1CCN(C)CC1 ZINC000563417304 319008967 /nfs/dbraw/zinc/00/89/67/319008967.db2.gz LMMSKYNRNNTDIS-HKUYNNGSSA-N 1 1 346.475 2.444 20 5 EEBDMO Cc1[nH+]c2cc(Nc3nccc(C(N)=O)c3[N+](=O)[O-])ccc2n1C ZINC000573415375 319931674 /nfs/dbraw/zinc/93/16/74/319931674.db2.gz XQQFPKYCAWYCNL-UHFFFAOYSA-N 1 1 326.316 2.027 20 5 EEBDMO O=[N+]([O-])c1ccccc1OCC[NH+]1CCN(c2cncc(F)c2)CC1 ZINC000341193679 465045282 /nfs/dbraw/zinc/04/52/82/465045282.db2.gz QSZTXALHFHWNKH-UHFFFAOYSA-N 1 1 346.362 2.330 20 5 EEBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](Cc2ccc3c[nH]nc3c2)CC1 ZINC000296102165 465081384 /nfs/dbraw/zinc/08/13/84/465081384.db2.gz UHLDSEJZFBJVDP-UHFFFAOYSA-N 1 1 338.371 2.188 20 5 EEBDMO CCOC(=O)c1ccnc(N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c1[N+](=O)[O-] ZINC000152557123 462546627 /nfs/dbraw/zinc/54/66/27/462546627.db2.gz YHFDGWLOKZOOTK-OCCSQVGLSA-N 1 1 348.403 2.087 20 5 EEBDMO CC[NH+]1CCN(CCCCNC(=O)c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000074137539 462561032 /nfs/dbraw/zinc/56/10/32/462561032.db2.gz KNSKRQGJHPBFTC-UHFFFAOYSA-N 1 1 348.447 2.051 20 5 EEBDMO COC(=O)CC[N@@H+]1CCN(c2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000089265528 462660142 /nfs/dbraw/zinc/66/01/42/462660142.db2.gz JATMCGXDLGCOTB-NSHDSACASA-N 1 1 341.795 2.322 20 5 EEBDMO COC(=O)CC[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000089265528 462660144 /nfs/dbraw/zinc/66/01/44/462660144.db2.gz JATMCGXDLGCOTB-NSHDSACASA-N 1 1 341.795 2.322 20 5 EEBDMO COC(=O)[C@H](C)C[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000153728012 462683539 /nfs/dbraw/zinc/68/35/39/462683539.db2.gz VGJPXERDDGTKEA-GFCCVEGCSA-N 1 1 349.387 2.115 20 5 EEBDMO COC(=O)[C@H](C)C[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000153728012 462683542 /nfs/dbraw/zinc/68/35/42/462683542.db2.gz VGJPXERDDGTKEA-GFCCVEGCSA-N 1 1 349.387 2.115 20 5 EEBDMO Cn1ccnc1[C@H](O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000089925487 462743550 /nfs/dbraw/zinc/74/35/50/462743550.db2.gz YKARDYAMWDCMNY-MRXNPFEDSA-N 1 1 348.378 2.413 20 5 EEBDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000075745813 462756018 /nfs/dbraw/zinc/75/60/18/462756018.db2.gz BAPHQTBYPSUEKM-QRTARXTBSA-N 1 1 330.388 2.030 20 5 EEBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 ZINC000075843360 462764376 /nfs/dbraw/zinc/76/43/76/462764376.db2.gz KWXIJOVVCKPDSZ-DQYPLSBCSA-N 1 1 348.378 2.374 20 5 EEBDMO C[N@@H+](CCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CC1 ZINC000065434355 462770193 /nfs/dbraw/zinc/77/01/93/462770193.db2.gz CWMAZDZDRLCYEO-UHFFFAOYSA-N 1 1 346.431 2.022 20 5 EEBDMO Cc1ccc(NC(=O)NC2CC[NH+](CCN(C)C)CC2)cc1[N+](=O)[O-] ZINC000075954772 462776736 /nfs/dbraw/zinc/77/67/36/462776736.db2.gz RZLUVCPMJJZMEU-UHFFFAOYSA-N 1 1 349.435 2.051 20 5 EEBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000065760321 462825162 /nfs/dbraw/zinc/82/51/62/462825162.db2.gz JMLSBHHQTIQDLK-ZNMIVQPWSA-N 1 1 349.431 2.456 20 5 EEBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1 ZINC000076268838 462833145 /nfs/dbraw/zinc/83/31/45/462833145.db2.gz VLRAQTLTJMTWPU-AAEUAGOBSA-N 1 1 328.376 2.214 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCc3n[nH]cc3C2)cccc1[N+](=O)[O-] ZINC000118852788 462857711 /nfs/dbraw/zinc/85/77/11/462857711.db2.gz UEUDUQPVQOUHCQ-UHFFFAOYSA-N 1 1 329.360 2.013 20 5 EEBDMO CCc1nn(C)c(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000091669617 462897253 /nfs/dbraw/zinc/89/72/53/462897253.db2.gz YUBPTDNWNGJWEH-IUODEOHRSA-N 1 1 333.436 2.344 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 ZINC000155985384 462965497 /nfs/dbraw/zinc/96/54/97/462965497.db2.gz NVGPBYFYUUAAHZ-CYBMUJFWSA-N 1 1 349.435 2.435 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2ccccc2)[C@@H](CO)C2CC2)n1 ZINC000156019179 462969411 /nfs/dbraw/zinc/96/94/11/462969411.db2.gz UEEZLJJHCGMHTN-INIZCTEOSA-N 1 1 330.388 2.064 20 5 EEBDMO NC(=O)C[NH+]1CCC(Nc2c(Cl)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000121080741 463076544 /nfs/dbraw/zinc/07/65/44/463076544.db2.gz PEGWXSHPXQFCGO-UHFFFAOYSA-N 1 1 347.202 2.263 20 5 EEBDMO COc1cccc([C@@H](C)[NH+]2CCN(c3ncc([N+](=O)[O-])cn3)CC2)c1 ZINC000095940391 463109711 /nfs/dbraw/zinc/10/97/11/463109711.db2.gz FWUXOUCTLMBDAC-CYBMUJFWSA-N 1 1 343.387 2.277 20 5 EEBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCN(Cc3ccncc3)CC2)cc1 ZINC000095977231 463122168 /nfs/dbraw/zinc/12/21/68/463122168.db2.gz QVOCJBBHXKHJQY-UHFFFAOYSA-N 1 1 326.400 2.350 20 5 EEBDMO C[C@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000157441363 463132662 /nfs/dbraw/zinc/13/26/62/463132662.db2.gz GQWQANLKKLWKMO-CYBMUJFWSA-N 1 1 341.375 2.065 20 5 EEBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000053265828 463144156 /nfs/dbraw/zinc/14/41/56/463144156.db2.gz XPFHROXAYXXLLS-UHFFFAOYSA-N 1 1 331.397 2.444 20 5 EEBDMO O=C(NCC[N@H+]1CCc2sccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000053265828 463144161 /nfs/dbraw/zinc/14/41/61/463144161.db2.gz XPFHROXAYXXLLS-UHFFFAOYSA-N 1 1 331.397 2.444 20 5 EEBDMO CN(C(=O)C[N@H+](C)CCc1ccncc1)c1ccc([N+](=O)[O-])cc1 ZINC000121528703 463151233 /nfs/dbraw/zinc/15/12/33/463151233.db2.gz QBKDMOBHAPIHQT-UHFFFAOYSA-N 1 1 328.372 2.127 20 5 EEBDMO CN(C(=O)C[N@@H+](C)CCc1ccncc1)c1ccc([N+](=O)[O-])cc1 ZINC000121528703 463151240 /nfs/dbraw/zinc/15/12/40/463151240.db2.gz QBKDMOBHAPIHQT-UHFFFAOYSA-N 1 1 328.372 2.127 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(NC(=O)C2CC2)CC1 ZINC000030280097 463292677 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OMVVWEGSLOGSDM-AWEZNQCLSA-N 1 1 335.404 2.282 20 5 EEBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000299055057 465579348 /nfs/dbraw/zinc/57/93/48/465579348.db2.gz TUUMWNOEGRGHMF-LLVKDONJSA-N 1 1 328.372 2.290 20 5 EEBDMO C[N@@H+](CCNc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)C1CC1 ZINC000360647478 465588999 /nfs/dbraw/zinc/58/89/99/465588999.db2.gz OVMCDMOYZJOAKJ-UHFFFAOYSA-N 1 1 342.399 3.075 20 5 EEBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000356891858 465606228 /nfs/dbraw/zinc/60/62/28/465606228.db2.gz WNODDYSJFSRQPO-KBPBESRZSA-N 1 1 334.420 2.338 20 5 EEBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000371261654 465674749 /nfs/dbraw/zinc/67/47/49/465674749.db2.gz ZOSWMVFABRONTN-LJQANCHMSA-N 1 1 346.475 2.238 20 5 EEBDMO COc1cc(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)ccc1[N+](=O)[O-] ZINC000344609551 465720078 /nfs/dbraw/zinc/72/00/78/465720078.db2.gz GYBAHLVBFBLQAL-HNNXBMFYSA-N 1 1 335.404 2.454 20 5 EEBDMO 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332.360 2.409 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1C ZINC000332188835 466435672 /nfs/dbraw/zinc/43/56/72/466435672.db2.gz BVRTWTZZASBNQV-STQMWFEESA-N 1 1 335.404 2.376 20 5 EEBDMO CC(C)[C@H]1CN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C ZINC000332264208 466478002 /nfs/dbraw/zinc/47/80/02/466478002.db2.gz OESNYSGSXZYQMV-QGZVFWFLSA-N 1 1 344.415 2.348 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000354354854 466500683 /nfs/dbraw/zinc/50/06/83/466500683.db2.gz RNPGPXVJUJACQE-GXTWGEPZSA-N 1 1 334.420 2.263 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000354420030 466555192 /nfs/dbraw/zinc/55/51/92/466555192.db2.gz DHCULPOVDQQXIY-UONOGXRCSA-N 1 1 335.404 2.305 20 5 EEBDMO Cn1c(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000408449648 466653372 /nfs/dbraw/zinc/65/33/72/466653372.db2.gz ATNMYDMLSABSQI-JSGCOSHPSA-N 1 1 332.404 2.022 20 5 EEBDMO C[C@@H](NC[C@H](N1CC[NH2+]CC1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000423382272 466733632 /nfs/dbraw/zinc/73/36/32/466733632.db2.gz IJUYLDMCDYQUCH-RISCZKNCSA-N 1 1 346.353 2.082 20 5 EEBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@@](C)(F)C1 ZINC000423667505 466798040 /nfs/dbraw/zinc/79/80/40/466798040.db2.gz BBIITUFCOGFJSP-OAHLLOKOSA-N 1 1 341.408 2.480 20 5 EEBDMO C[C@H]1CC[C@H]([N@@H+](CCO)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000411654482 466867782 /nfs/dbraw/zinc/86/77/82/466867782.db2.gz XVWHFNFJCGFRCH-BBRMVZONSA-N 1 1 335.404 2.406 20 5 EEBDMO CCOc1ccc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000373932265 466973957 /nfs/dbraw/zinc/97/39/57/466973957.db2.gz GVJWDTMADCWGAV-KGLIPLIRSA-N 1 1 333.388 2.350 20 5 EEBDMO [NH3+]CC(F)(F)CNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000418512509 467122502 /nfs/dbraw/zinc/12/25/02/467122502.db2.gz LLKNUQXUTSGGBB-LBPRGKRZSA-N 1 1 342.346 2.078 20 5 EEBDMO C[C@H](C[NH+]1CCN(C)CC1)Nc1nccc2ccc([N+](=O)[O-])cc21 ZINC000413134011 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346.431 2.361 20 5 EEBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000420827522 467492711 /nfs/dbraw/zinc/49/27/11/467492711.db2.gz CFOREQVLMLXPFO-CYBMUJFWSA-N 1 1 340.811 2.484 20 5 EEBDMO CCC[NH+]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000448895780 467604327 /nfs/dbraw/zinc/60/43/27/467604327.db2.gz LVACAYNDBAJSEH-UHFFFAOYSA-N 1 1 333.388 2.112 20 5 EEBDMO CN(CC(=O)NCC[N@H+]1CCCC1(C)C)c1ccccc1[N+](=O)[O-] ZINC000457050562 467740215 /nfs/dbraw/zinc/74/02/15/467740215.db2.gz GMZRCHBZHUWHES-UHFFFAOYSA-N 1 1 334.420 2.022 20 5 EEBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2N[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000450351787 467833728 /nfs/dbraw/zinc/83/37/28/467833728.db2.gz ABSIFOOKRVNYAR-NEPJUHHUSA-N 1 1 330.388 2.468 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCNC(=O)/C=C/c2cccc([N+](=O)[O-])c2)CCCO1 ZINC000493352099 467892775 /nfs/dbraw/zinc/89/27/75/467892775.db2.gz MIHMKKAZVVSWMZ-MVGZEHJDSA-N 1 1 347.415 2.225 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])C[C@@H]1C 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SHEWWGJHVHBWRC-MRXNPFEDSA-N 1 1 332.448 2.198 20 5 EEBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594598711 468631450 /nfs/dbraw/zinc/63/14/50/468631450.db2.gz HQEZMEYAVPPOIY-CVEARBPZSA-N 1 1 332.404 2.383 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c1[N+](=O)[O-] ZINC000592255456 468666278 /nfs/dbraw/zinc/66/62/78/468666278.db2.gz PSQMWIVZOJPAPI-OLZOCXBDSA-N 1 1 349.435 2.122 20 5 EEBDMO Cc1noc(C[N@@H+]2CCC[C@@H](CNC(=O)C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000595320344 468811420 /nfs/dbraw/zinc/81/14/20/468811420.db2.gz UIYXGNXOPTUEBC-LBPRGKRZSA-N 1 1 338.408 2.266 20 5 EEBDMO Cc1noc(C[N@H+]2CCC[C@@H](CNC(=O)C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000595320344 468811424 /nfs/dbraw/zinc/81/14/24/468811424.db2.gz UIYXGNXOPTUEBC-LBPRGKRZSA-N 1 1 338.408 2.266 20 5 EEBDMO CCO[C@@H]1C[C@H](O)C12CC[NH+](Cc1ccc(F)cc1[N+](=O)[O-])CC2 ZINC000595334835 468815551 /nfs/dbraw/zinc/81/55/51/468815551.db2.gz WISFPUWMUCHMGF-JKSUJKDBSA-N 1 1 338.379 2.486 20 5 EEBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000598342810 468837709 /nfs/dbraw/zinc/83/77/09/468837709.db2.gz NHPQLOPHTZUEEG-OAHLLOKOSA-N 1 1 346.431 2.409 20 5 EEBDMO Cc1noc(CN2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595474155 468867532 /nfs/dbraw/zinc/86/75/32/468867532.db2.gz CLLKBWOKZLDZOB-OAHLLOKOSA-N 1 1 330.388 2.250 20 5 EEBDMO Cc1noc(CN2CC[N@H+](C)[C@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595474155 468867537 /nfs/dbraw/zinc/86/75/37/468867537.db2.gz CLLKBWOKZLDZOB-OAHLLOKOSA-N 1 1 330.388 2.250 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC000595504817 468879095 /nfs/dbraw/zinc/87/90/95/468879095.db2.gz MXWIWHILNFOAPV-GOSISDBHSA-N 1 1 346.431 2.259 20 5 EEBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C[C@H]1C1CC1 ZINC000593131691 468881733 /nfs/dbraw/zinc/88/17/33/468881733.db2.gz SLNLBUKDPCTKIH-LSDHHAIUSA-N 1 1 334.372 2.234 20 5 EEBDMO C[N@H+]1CC[C@@]2(C1)CCCN(Cc1cc([N+](=O)[O-])cc3c1OCOC3)C2 ZINC000595507383 468882158 /nfs/dbraw/zinc/88/21/58/468882158.db2.gz MFYVOKPORQMBPQ-GOSISDBHSA-N 1 1 347.415 2.379 20 5 EEBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+](C)CC2=CCCOC2)c([N+](=O)[O-])c1 ZINC000595752572 468988953 /nfs/dbraw/zinc/98/89/53/468988953.db2.gz NAAZKCOEYHEACX-GFCCVEGCSA-N 1 1 349.387 2.209 20 5 EEBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CC2=CCCOC2)c([N+](=O)[O-])c1 ZINC000595752572 468988958 /nfs/dbraw/zinc/98/89/58/468988958.db2.gz NAAZKCOEYHEACX-GFCCVEGCSA-N 1 1 349.387 2.209 20 5 EEBDMO CC[NH+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000598955852 469065040 /nfs/dbraw/zinc/06/50/40/469065040.db2.gz NPSRFHKAAMQHGP-UHFFFAOYSA-N 1 1 342.193 2.135 20 5 EEBDMO O=[N+]([O-])c1cn(C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)nc1C1CC1 ZINC000601958894 469112022 /nfs/dbraw/zinc/11/20/22/469112022.db2.gz OWMMIUALLUKYAN-GOSISDBHSA-N 1 1 342.399 2.306 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCOC2)c([N+](=O)[O-])c1 ZINC000563066364 469157870 /nfs/dbraw/zinc/15/78/70/469157870.db2.gz NJCPSYXAKNAEMN-CABCVRRESA-N 1 1 333.388 2.085 20 5 EEBDMO CC[N@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000611092503 469160042 /nfs/dbraw/zinc/16/00/42/469160042.db2.gz WJPQXKDNFIBCAI-AWEZNQCLSA-N 1 1 334.420 2.258 20 5 EEBDMO CCN1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000611092503 469160047 /nfs/dbraw/zinc/16/00/47/469160047.db2.gz WJPQXKDNFIBCAI-AWEZNQCLSA-N 1 1 334.420 2.258 20 5 EEBDMO CCN1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000611092503 469160050 /nfs/dbraw/zinc/16/00/50/469160050.db2.gz WJPQXKDNFIBCAI-AWEZNQCLSA-N 1 1 334.420 2.258 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)Cn1cc[nH+]c1C(C)C ZINC000602071807 469174094 /nfs/dbraw/zinc/17/40/94/469174094.db2.gz GQUDPZLOJGZOOB-UHFFFAOYSA-N 1 1 332.360 2.240 20 5 EEBDMO CC[C@@]1(O)CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000602983154 469203493 /nfs/dbraw/zinc/20/34/93/469203493.db2.gz CQVZQPCYZHHSGJ-SUMWQHHRSA-N 1 1 335.404 2.467 20 5 EEBDMO CC[C@@]1(O)CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000602983154 469203496 /nfs/dbraw/zinc/20/34/96/469203496.db2.gz CQVZQPCYZHHSGJ-SUMWQHHRSA-N 1 1 335.404 2.467 20 5 EEBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC([N@H+]2CCC[C@H]2C(N)=O)CC1 ZINC000611244105 469207414 /nfs/dbraw/zinc/20/74/14/469207414.db2.gz AXGLRTQEFNGFKB-DYVFJYSZSA-N 1 1 346.431 2.070 20 5 EEBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(N2CCC[C@H]2C(N)=O)CC1 ZINC000611244105 469207417 /nfs/dbraw/zinc/20/74/17/469207417.db2.gz AXGLRTQEFNGFKB-DYVFJYSZSA-N 1 1 346.431 2.070 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@H](c3ncc[nH]3)C1)OCCO2 ZINC000611261828 469212591 /nfs/dbraw/zinc/21/25/91/469212591.db2.gz HLIMKYHXVNOFHJ-LBPRGKRZSA-N 1 1 344.371 2.469 20 5 EEBDMO C[N@H+]1CCC[C@@H](N2CCN(C/C=C\c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000611270937 469215480 /nfs/dbraw/zinc/21/54/80/469215480.db2.gz UREYHTSPRSQEDE-NCRRVARUSA-N 1 1 344.459 2.320 20 5 EEBDMO C[C@@H]1CO[C@@H](C)C[N@@H+]1CCNc1nccc2cc([N+](=O)[O-])ccc21 ZINC000596433942 469264639 /nfs/dbraw/zinc/26/46/39/469264639.db2.gz VUKBYBWPJPVZKV-OLZOCXBDSA-N 1 1 330.388 2.664 20 5 EEBDMO C[C@@H]1CO[C@@H](C)C[N@H+]1CCNc1nccc2cc([N+](=O)[O-])ccc21 ZINC000596433942 469264640 /nfs/dbraw/zinc/26/46/40/469264640.db2.gz VUKBYBWPJPVZKV-OLZOCXBDSA-N 1 1 330.388 2.664 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H](C)C1(F)F ZINC000599514739 469281735 /nfs/dbraw/zinc/28/17/35/469281735.db2.gz ZGGDOWUNLLPYOY-AOOOYVTPSA-N 1 1 327.331 2.417 20 5 EEBDMO C[C@@H]1C[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H](C)C1(F)F ZINC000599514739 469281738 /nfs/dbraw/zinc/28/17/38/469281738.db2.gz ZGGDOWUNLLPYOY-AOOOYVTPSA-N 1 1 327.331 2.417 20 5 EEBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000604499112 469484219 /nfs/dbraw/zinc/48/42/19/469484219.db2.gz FKCKMHQHCARHHL-UHFFFAOYSA-N 1 1 325.328 2.347 20 5 EEBDMO CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[N@@H+](CC)[C@H](C)C1 ZINC000619816759 469685513 /nfs/dbraw/zinc/68/55/13/469685513.db2.gz CMVLUWJKBYGCQB-CYBMUJFWSA-N 1 1 344.419 2.404 20 5 EEBDMO O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000609290158 469912767 /nfs/dbraw/zinc/91/27/67/469912767.db2.gz DOABZJWFRJHAFI-CQSZACIVSA-N 1 1 332.404 2.411 20 5 EEBDMO CC[C@H](C[NH+]1CCCC1)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000609833420 469964306 /nfs/dbraw/zinc/96/43/06/469964306.db2.gz IGIKRGJHOJRKKW-LLVKDONJSA-N 1 1 331.376 2.075 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](CCO)C2)cccc1[N+](=O)[O-] ZINC000610213607 469988312 /nfs/dbraw/zinc/98/83/12/469988312.db2.gz ITXZBUPWTQBDRL-ZIAGYGMSSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](CCO)C2)cccc1[N+](=O)[O-] ZINC000610213607 469988313 /nfs/dbraw/zinc/98/83/13/469988313.db2.gz ITXZBUPWTQBDRL-ZIAGYGMSSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1ncc2c(n1)CC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000532470644 485544983 /nfs/dbraw/zinc/54/49/83/485544983.db2.gz KKKJBHLXYNJADS-UHFFFAOYSA-N 1 1 341.371 2.080 20 5 EEBDMO 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CC[N@@H+]([C@H]1CCOC1)C1CCN(c2ncc([N+](=O)[O-])cc2F)CC1 ZINC001165109314 1321456615 /nfs/dbraw/zinc/45/66/15/1321456615.db2.gz SZQTXTQNWPPUEE-ZDUSSCGKSA-N 1 1 338.383 2.209 20 5 EEBDMO COc1cc2ncnc(N3CC[N@@H+](C(C)C)[C@H](C)C3)c2cc1[N+](=O)[O-] ZINC001165199288 1321469955 /nfs/dbraw/zinc/46/99/55/1321469955.db2.gz OEEMUNGRWFFWSD-GFCCVEGCSA-N 1 1 345.403 2.466 20 5 EEBDMO COC(=O)[C@H]1CCC[C@@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001324859271 1333775458 /nfs/dbraw/zinc/77/54/58/1333775458.db2.gz SRJSLHFIPIGEBV-STQMWFEESA-N 1 1 346.343 2.076 20 5 EEBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-] ZINC001609163195 1351871060 /nfs/dbraw/zinc/87/10/60/1351871060.db2.gz UJAANMCEXPDJFZ-TXEJJXNPSA-N 1 1 345.407 2.450 20 5 EEBDMO C[N@@H+](Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC001609277233 1351919038 /nfs/dbraw/zinc/91/90/38/1351919038.db2.gz OMNATOHVJUZIBW-UHFFFAOYSA-N 1 1 328.376 2.395 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C[N@H+]1C1CC1 ZINC001331680146 1335057307 /nfs/dbraw/zinc/05/73/07/1335057307.db2.gz MQRKZLBKRGPFJY-SMDDNHRTSA-N 1 1 330.388 2.245 20 5 EEBDMO C[C@@H]1CCC[N@@H+](CCNc2cc(F)c(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001590261978 1349238003 /nfs/dbraw/zinc/23/80/03/1349238003.db2.gz RVFAPPPKPGPTRI-SNVBAGLBSA-N 1 1 349.370 2.058 20 5 EEBDMO O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1C[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC001607077387 1351406999 /nfs/dbraw/zinc/40/69/99/1351406999.db2.gz MKQHFPOPRPTERT-SNVBAGLBSA-N 1 1 342.281 2.159 20 5 EEBDMO O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1C[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC001607077387 1351407001 /nfs/dbraw/zinc/40/70/01/1351407001.db2.gz MKQHFPOPRPTERT-SNVBAGLBSA-N 1 1 342.281 2.159 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC1(C)CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC001110598417 1369129561 /nfs/dbraw/zinc/12/95/61/1369129561.db2.gz UNGOVXJMGSAVNS-UHFFFAOYSA-N 1 1 348.447 2.412 20 5 EEBDMO COC(=O)NC1CC[NH+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)CC1 ZINC000853626349 1369361017 /nfs/dbraw/zinc/36/10/17/1369361017.db2.gz SCMORLZBCVODAD-UHFFFAOYSA-N 1 1 347.375 2.031 20 5 EEBDMO CC1(C)CN(c2nc3ccc([N+](=O)[O-])cc3s2)CC[N@H+]1CCO ZINC000780630944 1371168108 /nfs/dbraw/zinc/16/81/08/1371168108.db2.gz YARMATOUVZYSGU-UHFFFAOYSA-N 1 1 336.417 2.097 20 5 EEBDMO C[C@H](CNc1cc(N)c([N+](=O)[O-])cn1)[N@H+]1CCc2sccc2C1 ZINC001347905454 1372975918 /nfs/dbraw/zinc/97/59/18/1372975918.db2.gz GWTAQJJWYIKROW-SNVBAGLBSA-N 1 1 333.417 2.492 20 5 EEBDMO CCOc1cccc(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)n1 ZINC001578194626 1403723650 /nfs/dbraw/zinc/72/36/50/1403723650.db2.gz UHXRVRMGSQRYMA-MRXNPFEDSA-N 1 1 330.344 2.201 20 5 EEBDMO Cc1nc(C(=O)NCCC[N@@H+](C)Cc2csc([N+](=O)[O-])c2)co1 ZINC001751966558 1406153830 /nfs/dbraw/zinc/15/38/30/1406153830.db2.gz KHELLYNPIAAPFD-UHFFFAOYSA-N 1 1 338.389 2.205 20 5 EEBDMO Cc1nc(C(=O)NCCC[N@H+](C)Cc2csc([N+](=O)[O-])c2)co1 ZINC001751966558 1406153835 /nfs/dbraw/zinc/15/38/35/1406153835.db2.gz KHELLYNPIAAPFD-UHFFFAOYSA-N 1 1 338.389 2.205 20 5 EEBDMO Cc1c(C)c(N2CC[NH+](CCc3ccccn3)CC2)ncc1[N+](=O)[O-] ZINC001165055078 722013462 /nfs/dbraw/zinc/01/34/62/722013462.db2.gz BZPVDUGXYOIQRY-UHFFFAOYSA-N 1 1 341.415 2.366 20 5 EEBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)Cn1nccc1[N+](=O)[O-] ZINC000173516122 765586713 /nfs/dbraw/zinc/58/67/13/765586713.db2.gz PHLXWJRNCIMKAZ-INIZCTEOSA-N 1 1 329.404 2.203 20 5 EEBDMO Cc1ccc(C(=O)NCC2C[NH+](Cc3ccccc3[N+](=O)[O-])C2)n1C ZINC001031547156 769523111 /nfs/dbraw/zinc/52/31/11/769523111.db2.gz HAIYYADSVHLAKF-UHFFFAOYSA-N 1 1 342.399 2.104 20 5 EEBDMO Cc1cnccc1C(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001031652936 770648014 /nfs/dbraw/zinc/64/80/14/770648014.db2.gz XYELRTHKZMOBIP-UHFFFAOYSA-N 1 1 340.383 2.160 20 5 EEBDMO O=C(NCC1C[NH+](Cc2cccc3ccccc32)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001031661760 770721884 /nfs/dbraw/zinc/72/18/84/770721884.db2.gz HVACXNIGNKRTQL-QZTJIDSGSA-N 1 1 339.395 2.053 20 5 EEBDMO Cc1cccc(CCC[N@H+]2CCCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c1 ZINC000981137093 776581196 /nfs/dbraw/zinc/58/11/96/776581196.db2.gz MLFGJIDEOCKZPQ-QZTJIDSGSA-N 1 1 345.443 2.127 20 5 EEBDMO Cc1cccc(CCC[N@@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC000981137093 776581202 /nfs/dbraw/zinc/58/12/02/776581202.db2.gz MLFGJIDEOCKZPQ-QZTJIDSGSA-N 1 1 345.443 2.127 20 5 EEBDMO Cc1cccc(CCC[N@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC000981137093 776581208 /nfs/dbraw/zinc/58/12/08/776581208.db2.gz MLFGJIDEOCKZPQ-QZTJIDSGSA-N 1 1 345.443 2.127 20 5 EEBDMO COc1c(O)ccc(CNC[C@H]2CCCC[N@@H+]2C2CC2)c1[N+](=O)[O-] ZINC000894046787 780459931 /nfs/dbraw/zinc/45/99/31/780459931.db2.gz QQXSICAUJVPCBE-CQSZACIVSA-N 1 1 335.404 2.416 20 5 EEBDMO COc1c(O)ccc(CNC[C@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-] ZINC000894046787 780459939 /nfs/dbraw/zinc/45/99/39/780459939.db2.gz QQXSICAUJVPCBE-CQSZACIVSA-N 1 1 335.404 2.416 20 5 EEBDMO COc1nccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1F ZINC000894078251 780506182 /nfs/dbraw/zinc/50/61/82/780506182.db2.gz ILFRKCBKKDGUBJ-UHFFFAOYSA-N 1 1 335.339 2.171 20 5 EEBDMO C[N@H+]1CC[C@@H](Oc2ccc([N+](=O)[O-])c(I)c2)C1 ZINC001227993929 783450238 /nfs/dbraw/zinc/45/02/38/783450238.db2.gz IRYWMZGXTGQXNS-SECBINFHSA-N 1 1 348.140 2.282 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)NC/C=C\CNc1cc(C)ccc1[N+](=O)[O-] ZINC001107200347 786371089 /nfs/dbraw/zinc/37/10/89/786371089.db2.gz MAKXZCKPLSFFKM-ARJAWSKDSA-N 1 1 343.387 2.193 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NC/C=C/CNc1ccc(F)cc1[N+](=O)[O-] ZINC001107233223 786549518 /nfs/dbraw/zinc/54/95/18/786549518.db2.gz MRUDGLQMHWTLEP-SNAWJCMRSA-N 1 1 338.383 2.158 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NC/C=C/CNc1ncc(C)cc1[N+](=O)[O-] ZINC001107392108 787106763 /nfs/dbraw/zinc/10/67/63/787106763.db2.gz UOEOQXDESQWFEM-BQYQJAHWSA-N 1 1 349.435 2.113 20 5 EEBDMO C[N@@H+](CC(=O)NC/C=C\CNc1ccc([N+](=O)[O-])cn1)CC(C)(C)C ZINC001107513891 787470825 /nfs/dbraw/zinc/47/08/25/787470825.db2.gz QCASRNKOBRAAAR-WAYWQWQTSA-N 1 1 349.435 2.052 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NCCC1(CNc2ccc([N+](=O)[O-])cn2)CC1 ZINC001089951076 795387279 /nfs/dbraw/zinc/38/72/79/795387279.db2.gz XKYBQYBNWYUCDF-UHFFFAOYSA-N 1 1 349.435 2.030 20 5 EEBDMO CC(C)[C@@H](C)[N@@H+](C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000915208568 795736586 /nfs/dbraw/zinc/73/65/86/795736586.db2.gz GKWPEMZBJXNZDT-PXAZEXFGSA-N 1 1 348.403 2.296 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)C[N@H+]1[C@H](C)CC[C@@H]1C ZINC000785729281 806559097 /nfs/dbraw/zinc/55/90/97/806559097.db2.gz DZFPNUZFPJLBMD-BETUJISGSA-N 1 1 349.387 2.258 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000785729281 806559106 /nfs/dbraw/zinc/55/91/06/806559106.db2.gz DZFPNUZFPJLBMD-BETUJISGSA-N 1 1 349.387 2.258 20 5 EEBDMO CCOC(=O)C1=C(O)CC[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173227119 797311029 /nfs/dbraw/zinc/31/10/29/797311029.db2.gz OFRBZEVGOBRFQD-CJNGLKHVSA-N 1 1 348.399 2.370 20 5 EEBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)OCCC[NH+]1CCOCC1 ZINC000785949806 806639874 /nfs/dbraw/zinc/63/98/74/806639874.db2.gz WGAOHFKRAGHGIV-UHFFFAOYSA-N 1 1 342.779 2.056 20 5 EEBDMO CO[C@@H]1CC[N@@H+](CCOc2cccc(Br)c2[N+](=O)[O-])C1 ZINC001230326298 798525814 /nfs/dbraw/zinc/52/58/14/798525814.db2.gz KZSTXXATBKDWRA-SNVBAGLBSA-N 1 1 345.193 2.457 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C[C@@H](F)C1 ZINC001169011822 803571275 /nfs/dbraw/zinc/57/12/75/803571275.db2.gz MPGUVWUCWXIFJN-MGPQQGTHSA-N 1 1 345.415 2.323 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C[C@@H](F)C1 ZINC001169011822 803571279 /nfs/dbraw/zinc/57/12/79/803571279.db2.gz MPGUVWUCWXIFJN-MGPQQGTHSA-N 1 1 345.415 2.323 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C[C@H](F)C1 ZINC001169011821 803571463 /nfs/dbraw/zinc/57/14/63/803571463.db2.gz MPGUVWUCWXIFJN-MELADBBJSA-N 1 1 345.415 2.323 20 5 EEBDMO CC(C)(C)OC(=O)N1CC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C[C@H](F)C1 ZINC001169011821 803571466 /nfs/dbraw/zinc/57/14/66/803571466.db2.gz MPGUVWUCWXIFJN-MELADBBJSA-N 1 1 345.415 2.323 20 5 EEBDMO CC(C)(C)OC(=O)N1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169018022 803586479 /nfs/dbraw/zinc/58/64/79/803586479.db2.gz BIOFWDBLZKTWDB-KBPBESRZSA-N 1 1 327.425 2.375 20 5 EEBDMO CC(C)Oc1ncnc2c1CC[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2 ZINC001169022263 803588742 /nfs/dbraw/zinc/58/87/42/803588742.db2.gz RKALXKPOUXIZLG-KGLIPLIRSA-N 1 1 334.420 2.110 20 5 EEBDMO COC[C@@H]1C[N@@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nn(CC3CC3)cc21 ZINC001169023998 803589994 /nfs/dbraw/zinc/58/99/94/803589994.db2.gz WPKFNSFIRJEMJI-PMPSAXMXSA-N 1 1 348.447 2.284 20 5 EEBDMO COC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nn(CC3CC3)cc21 ZINC001169023998 803589997 /nfs/dbraw/zinc/58/99/97/803589997.db2.gz WPKFNSFIRJEMJI-PMPSAXMXSA-N 1 1 348.447 2.284 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(c3nc(Cl)nc(Cl)c3[N+](=O)[O-])C[C@H]21 ZINC001157265581 807196962 /nfs/dbraw/zinc/19/69/62/807196962.db2.gz JPVQEFLKCPAQLX-JGVFFNPUSA-N 1 1 332.191 2.222 20 5 EEBDMO C[C@]1(C(N)=O)CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000793391506 810315095 /nfs/dbraw/zinc/31/50/95/810315095.db2.gz YTAPPWMRSDWVKQ-ZDUSSCGKSA-N 1 1 342.193 2.055 20 5 EEBDMO C[C@@]([NH2+]CCC[NH+]1CCCCC1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593268444 994593399 /nfs/dbraw/zinc/59/33/99/994593399.db2.gz UYVFTUBNWCPSST-KRWDZBQOSA-N 1 1 335.404 2.360 20 5 EEBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000066137364 215015169 /nfs/dbraw/zinc/01/51/69/215015169.db2.gz YEBQPBAPPCCWRN-SNVBAGLBSA-N 1 1 338.364 2.272 20 5 EEBDMO CC[C@H](C)[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000067118772 215114077 /nfs/dbraw/zinc/11/40/77/215114077.db2.gz DYYQJAAHKALOHO-JTQLQIEISA-N 1 1 349.840 2.257 20 5 EEBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CCCC[C@H]1O ZINC000426228444 241238888 /nfs/dbraw/zinc/23/88/88/241238888.db2.gz RFDXSGSPHBPARK-ZIAGYGMSSA-N 1 1 332.360 2.380 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000442772856 242110961 /nfs/dbraw/zinc/11/09/61/242110961.db2.gz WMJIPVLBTQTHIT-MZBDJJRSSA-N 1 1 346.431 2.447 20 5 EEBDMO CNC(=O)c1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000446840611 242223804 /nfs/dbraw/zinc/22/38/04/242223804.db2.gz HEGNLINSNCERJA-UHFFFAOYSA-N 1 1 339.355 2.121 20 5 EEBDMO CCO[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000451524366 243144352 /nfs/dbraw/zinc/14/43/52/243144352.db2.gz DVUKVUSULHGYQW-CJNGLKHVSA-N 1 1 335.404 2.305 20 5 EEBDMO CCO[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000451524366 243144355 /nfs/dbraw/zinc/14/43/55/243144355.db2.gz DVUKVUSULHGYQW-CJNGLKHVSA-N 1 1 335.404 2.305 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H]2C[C@@H](O)CC[C@H]2C1 ZINC000451700923 243213482 /nfs/dbraw/zinc/21/34/82/243213482.db2.gz YSOUZBAQFDDHJH-ILXRZTDVSA-N 1 1 347.415 2.325 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H]2C[C@@H](O)CC[C@H]2C1 ZINC000451700923 243213484 /nfs/dbraw/zinc/21/34/84/243213484.db2.gz YSOUZBAQFDDHJH-ILXRZTDVSA-N 1 1 347.415 2.325 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@H]2CCC[C@@H]21 ZINC000265150996 247251289 /nfs/dbraw/zinc/25/12/89/247251289.db2.gz STFMGVXFKOZBBP-HOCLYGCPSA-N 1 1 349.387 2.185 20 5 EEBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000265282026 247369511 /nfs/dbraw/zinc/36/95/11/247369511.db2.gz ZLFUEVWPONMXFD-DOTOQJQBSA-N 1 1 347.415 2.109 20 5 EEBDMO Cc1cnc(N2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000266181142 248153549 /nfs/dbraw/zinc/15/35/49/248153549.db2.gz CDCARAQRBGABLW-IYBDPMFKSA-N 1 1 347.463 2.293 20 5 EEBDMO CCOC(=O)c1ccnc(N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000268140437 256117908 /nfs/dbraw/zinc/11/79/08/256117908.db2.gz KEKSSDATBGCSBG-GXFFZTMASA-N 1 1 334.376 2.061 20 5 EEBDMO CCOC(=O)[C@@H](C)[C@H](C)[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000273955533 256341033 /nfs/dbraw/zinc/34/10/33/256341033.db2.gz FWLAOZTXLABHKU-QWRGUYRKSA-N 1 1 348.359 2.322 20 5 EEBDMO CC[N@@H+](CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CC1 ZINC000128814384 292347517 /nfs/dbraw/zinc/34/75/17/292347517.db2.gz PESBBECAUWPMFK-UHFFFAOYSA-N 1 1 330.388 2.219 20 5 EEBDMO C[N@H+]1CCC[C@H](CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000132219989 292398630 /nfs/dbraw/zinc/39/86/30/292398630.db2.gz ACOFDBZIWQMDDS-GFCCVEGCSA-N 1 1 330.388 2.077 20 5 EEBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000188484284 160124379 /nfs/dbraw/zinc/12/43/79/160124379.db2.gz USZSCKOYPXAMTN-YVEFUNNKSA-N 1 1 344.415 2.266 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC[C@H]21 ZINC000247972689 160334798 /nfs/dbraw/zinc/33/47/98/160334798.db2.gz HMLUDYPYGCZJIM-DOTOQJQBSA-N 1 1 331.416 2.470 20 5 EEBDMO CCOC[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000248373099 160342432 /nfs/dbraw/zinc/34/24/32/160342432.db2.gz GGLVZAUHKZEUGD-HUUCEWRRSA-N 1 1 338.404 2.083 20 5 EEBDMO C[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(-n2cccn2)cc1 ZINC000342050152 161035330 /nfs/dbraw/zinc/03/53/30/161035330.db2.gz SWZMKFKIFKLEGT-GFCCVEGCSA-N 1 1 326.360 2.365 20 5 EEBDMO C[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)[N@H+]1CCCC[C@@H]1C ZINC000342850818 161095707 /nfs/dbraw/zinc/09/57/07/161095707.db2.gz CBAUJZLYYJOQPV-WDEREUQCSA-N 1 1 338.383 2.309 20 5 EEBDMO C[N@@H+](CCc1ccccc1O)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000344163802 161203722 /nfs/dbraw/zinc/20/37/22/161203722.db2.gz NMVWVFWCGFNVMP-HNNXBMFYSA-N 1 1 346.383 2.215 20 5 EEBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000344408809 161224483 /nfs/dbraw/zinc/22/44/83/161224483.db2.gz BFJMQQOOTUVGDO-OKILXGFUSA-N 1 1 335.404 2.305 20 5 EEBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)COc1ccccc1[N+](=O)[O-] ZINC000344737068 161241456 /nfs/dbraw/zinc/24/14/56/161241456.db2.gz XZKYOTXINJTZGD-OAHLLOKOSA-N 1 1 335.404 2.210 20 5 EEBDMO Cn1c(C(=O)NCCC[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000345003927 161263366 /nfs/dbraw/zinc/26/33/66/161263366.db2.gz GNMXGQXMRYQHIG-UHFFFAOYSA-N 1 1 330.388 2.185 20 5 EEBDMO C[C@@H]1[C@@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CCC[N@H+]1C ZINC000345318003 161291275 /nfs/dbraw/zinc/29/12/75/161291275.db2.gz LJSTYAPYKCNZCM-YGRLFVJLSA-N 1 1 344.371 2.061 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000352635523 162221772 /nfs/dbraw/zinc/22/17/72/162221772.db2.gz CPUIZONKFLKITK-NXEZZACHSA-N 1 1 343.330 2.361 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000352635523 162221775 /nfs/dbraw/zinc/22/17/75/162221775.db2.gz CPUIZONKFLKITK-NXEZZACHSA-N 1 1 343.330 2.361 20 5 EEBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](CC(=O)Nc4cc([N+](=O)[O-])ccc4C)[C@H]1[C@H]3C2 ZINC000352679034 162242043 /nfs/dbraw/zinc/24/20/43/162242043.db2.gz YXSNGCYAZBRICK-VCMWWZGJSA-N 1 1 345.399 2.197 20 5 EEBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1)c1ccc([N+](=O)[O-])s1 ZINC000355352198 163157355 /nfs/dbraw/zinc/15/73/55/163157355.db2.gz ZXYXOUXFRQXNTP-ZDUSSCGKSA-N 1 1 347.396 2.475 20 5 EEBDMO CC(C)[C@]1(CO)CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000368067823 166045297 /nfs/dbraw/zinc/04/52/97/166045297.db2.gz BFFXDFVFERNOJT-QGZVFWFLSA-N 1 1 346.387 2.485 20 5 EEBDMO CC(C)[C@]1(CO)CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000368067823 166045299 /nfs/dbraw/zinc/04/52/99/166045299.db2.gz BFFXDFVFERNOJT-QGZVFWFLSA-N 1 1 346.387 2.485 20 5 EEBDMO O=C(NCc1c[nH+]c2n1CCCC2)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000375550673 167157744 /nfs/dbraw/zinc/15/77/44/167157744.db2.gz FHISWAMNDMNWIC-UHFFFAOYSA-N 1 1 336.298 2.336 20 5 EEBDMO CCOC1CC2(C1)CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000375738750 167182246 /nfs/dbraw/zinc/18/22/46/167182246.db2.gz RSORLTFXOMTIHI-UHFFFAOYSA-N 1 1 347.415 2.449 20 5 EEBDMO CCOC1CC2(C1)CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000375738750 167182248 /nfs/dbraw/zinc/18/22/48/167182248.db2.gz RSORLTFXOMTIHI-UHFFFAOYSA-N 1 1 347.415 2.449 20 5 EEBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H](OCc3ccncc3)C2)c1 ZINC000376511097 167340745 /nfs/dbraw/zinc/34/07/45/167340745.db2.gz JOLWPTGZMKXQTJ-ZWKOTPCHSA-N 1 1 343.383 2.314 20 5 EEBDMO COCCC[N@@H+](CCO)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000275510040 269120311 /nfs/dbraw/zinc/12/03/11/269120311.db2.gz SKZFZSPBPWGQJV-UHFFFAOYSA-N 1 1 326.393 2.213 20 5 EEBDMO CNC(=O)c1ccc(NC[C@H]2CCCC[N@H+]2C2CC2)c([N+](=O)[O-])c1 ZINC000277473079 269158488 /nfs/dbraw/zinc/15/84/88/269158488.db2.gz QDNXKNFSBLTXBZ-CQSZACIVSA-N 1 1 332.404 2.383 20 5 EEBDMO CCC[C@@]1(CO)CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000277678780 269171130 /nfs/dbraw/zinc/17/11/30/269171130.db2.gz GFXJZLYMJISLOO-KRWDZBQOSA-N 1 1 335.404 2.469 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCNc2ccc([N+](=O)[O-])c3nonc32)CCCO1 ZINC000277794923 269183662 /nfs/dbraw/zinc/18/36/62/269183662.db2.gz XKZMCXBTODWOJE-LLVKDONJSA-N 1 1 335.364 2.044 20 5 EEBDMO COC[C@@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@@H]1CCCO1 ZINC000279110851 269262212 /nfs/dbraw/zinc/26/22/12/269262212.db2.gz SMKDFLZKVYHVIH-OCCSQVGLSA-N 1 1 328.340 2.026 20 5 EEBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000279361753 269274164 /nfs/dbraw/zinc/27/41/64/269274164.db2.gz GECWEKVSGOFBLA-NSHDSACASA-N 1 1 338.383 2.310 20 5 EEBDMO COc1cc(C(=O)NCC[N@H+]2CCC[C@H](C)C2)cc([N+](=O)[O-])c1C ZINC000188731074 274032741 /nfs/dbraw/zinc/03/27/41/274032741.db2.gz BDOKVVGFGWFVJV-LBPRGKRZSA-N 1 1 335.404 2.374 20 5 EEBDMO C[C@@H](O)C[NH+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000065547823 274270850 /nfs/dbraw/zinc/27/08/50/274270850.db2.gz VYORBZIPTACOIR-SNVBAGLBSA-N 1 1 333.310 2.116 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCCc3occc3C2)c1 ZINC000288750137 275083781 /nfs/dbraw/zinc/08/37/81/275083781.db2.gz HYVSUMXVTCPETK-OAHLLOKOSA-N 1 1 332.356 2.376 20 5 EEBDMO C[C@@H]1[C@H](N2CCOCC2)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000289788765 275148918 /nfs/dbraw/zinc/14/89/18/275148918.db2.gz MGLDJWCBUVYDEE-IUODEOHRSA-N 1 1 346.387 2.031 20 5 EEBDMO C[C@@H]1[C@H](N2CCOCC2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000289788765 275148919 /nfs/dbraw/zinc/14/89/19/275148919.db2.gz MGLDJWCBUVYDEE-IUODEOHRSA-N 1 1 346.387 2.031 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](n2cccn2)C1 ZINC000291977709 275360026 /nfs/dbraw/zinc/36/00/26/275360026.db2.gz WBCGIDOMITWYBA-OLZOCXBDSA-N 1 1 329.360 2.065 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](n2cccn2)C1 ZINC000291977709 275360028 /nfs/dbraw/zinc/36/00/28/275360028.db2.gz WBCGIDOMITWYBA-OLZOCXBDSA-N 1 1 329.360 2.065 20 5 EEBDMO Cn1ccnc1[C@H](N[C@H]1CC[C@H](C[NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000423511385 279379005 /nfs/dbraw/zinc/37/90/05/279379005.db2.gz QEKKUWZIQZVBIX-DUVNUKRYSA-N 1 1 329.404 2.135 20 5 EEBDMO O=C(C[N@H+]1CCC[C@@H](O)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000293285398 293170882 /nfs/dbraw/zinc/17/08/82/293170882.db2.gz VOZAHAAEGUPNJO-LLVKDONJSA-N 1 1 327.768 2.034 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@@H](O)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000293285398 293170883 /nfs/dbraw/zinc/17/08/83/293170883.db2.gz VOZAHAAEGUPNJO-LLVKDONJSA-N 1 1 327.768 2.034 20 5 EEBDMO COc1cccc(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000346258672 295285086 /nfs/dbraw/zinc/28/50/86/295285086.db2.gz IQOHHUKRDYWKMP-UMVBOHGHSA-N 1 1 347.415 2.406 20 5 EEBDMO C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1nccc2ccc([N+](=O)[O-])cc21 ZINC000413277429 312836196 /nfs/dbraw/zinc/83/61/96/312836196.db2.gz DUXCRYULTYHVFC-BBRMVZONSA-N 1 1 342.399 2.442 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)N(C)C[C@@H]2CCC[N@H+]2C)cccc1[N+](=O)[O-] ZINC000421004628 314020892 /nfs/dbraw/zinc/02/08/92/314020892.db2.gz OKKHSYOOOWSONX-KGLIPLIRSA-N 1 1 334.420 2.256 20 5 EEBDMO CN(C(=O)C[N@H+]1CCC[C@@H](CCO)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000421015967 314026274 /nfs/dbraw/zinc/02/62/74/314026274.db2.gz LWPMYTSWSPWWKG-CQSZACIVSA-N 1 1 335.404 2.042 20 5 EEBDMO Cc1[nH+]cc2n1C[C@H](C(=O)NCCc1ccccc1[N+](=O)[O-])CC2 ZINC000517378026 316664699 /nfs/dbraw/zinc/66/46/99/316664699.db2.gz FFMKYTILOIQRBG-CQSZACIVSA-N 1 1 328.372 2.021 20 5 EEBDMO C[N@H+]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC12CCCCC2 ZINC000575427631 320105553 /nfs/dbraw/zinc/10/55/53/320105553.db2.gz WZQDMLCNUOGIEP-UHFFFAOYSA-N 1 1 346.431 2.144 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH2+]Cc2nc(C3CC3)cs2)c1 ZINC000578186745 320299220 /nfs/dbraw/zinc/29/92/20/320299220.db2.gz ANDSTZAIVNNYPO-ZDUSSCGKSA-N 1 1 349.412 2.458 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000341962898 465279626 /nfs/dbraw/zinc/27/96/26/465279626.db2.gz VJUNSOMTIRALNT-ZDUSSCGKSA-N 1 1 343.449 2.302 20 5 EEBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000074326564 462587060 /nfs/dbraw/zinc/58/70/60/462587060.db2.gz XRGGEKDTZDPNQN-HNNXBMFYSA-N 1 1 347.415 2.164 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000063665469 462661034 /nfs/dbraw/zinc/66/10/34/462661034.db2.gz BNISKMIILBSUSZ-AWEZNQCLSA-N 1 1 335.404 2.354 20 5 EEBDMO O=[N+]([O-])c1cccnc1NC[C@H]1C[C@@H](O)C[N@@H+]1Cc1ccccc1 ZINC000089643988 462702939 /nfs/dbraw/zinc/70/29/39/462702939.db2.gz RXMANGRYBOYDFI-HUUCEWRRSA-N 1 1 328.372 2.037 20 5 EEBDMO Cc1nc(NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000089645236 462703527 /nfs/dbraw/zinc/70/35/27/462703527.db2.gz MBSPYIHKLPQORN-CVEARBPZSA-N 1 1 342.399 2.346 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@]2(CCOC2)C1 ZINC000154066496 462726273 /nfs/dbraw/zinc/72/62/73/462726273.db2.gz JNTDQPWFLXGMKR-QGZVFWFLSA-N 1 1 347.371 2.005 20 5 EEBDMO Cn1ccnc1[C@@H](O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000089925488 462743686 /nfs/dbraw/zinc/74/36/86/462743686.db2.gz YKARDYAMWDCMNY-INIZCTEOSA-N 1 1 348.378 2.413 20 5 EEBDMO CC[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)c1cccc(OC)c1 ZINC000075645679 462744798 /nfs/dbraw/zinc/74/47/98/462744798.db2.gz KMDAJWGFZZEVDY-BBRMVZONSA-N 1 1 348.403 2.244 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H]([C@@H](C)O)C1 ZINC000089932619 462746562 /nfs/dbraw/zinc/74/65/62/462746562.db2.gz ZDITZVNBGYSTKY-ZIAGYGMSSA-N 1 1 335.404 2.325 20 5 EEBDMO CC[C@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000117341099 462800830 /nfs/dbraw/zinc/80/08/30/462800830.db2.gz UGFIWLCOKJNJSQ-JSGCOSHPSA-N 1 1 349.387 2.392 20 5 EEBDMO CC[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000117341099 462800835 /nfs/dbraw/zinc/80/08/35/462800835.db2.gz UGFIWLCOKJNJSQ-JSGCOSHPSA-N 1 1 349.387 2.392 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000065868068 462834950 /nfs/dbraw/zinc/83/49/50/462834950.db2.gz LFQRGEXAKLZVCI-GASCZTMLSA-N 1 1 348.447 2.491 20 5 EEBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000076651108 462891020 /nfs/dbraw/zinc/89/10/20/462891020.db2.gz CSBZVEXXVBDBTL-ZDUSSCGKSA-N 1 1 328.372 2.269 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000076651108 462891023 /nfs/dbraw/zinc/89/10/23/462891023.db2.gz CSBZVEXXVBDBTL-ZDUSSCGKSA-N 1 1 328.372 2.269 20 5 EEBDMO Cc1c(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000049992644 462983222 /nfs/dbraw/zinc/98/32/22/462983222.db2.gz KQMJVNKJXKKVMT-GFCCVEGCSA-N 1 1 348.359 2.122 20 5 EEBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000021054371 463032068 /nfs/dbraw/zinc/03/20/68/463032068.db2.gz VBKXWAUEAATONQ-STQMWFEESA-N 1 1 335.404 2.212 20 5 EEBDMO Cc1ccccc1C[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)CC1 ZINC000022231046 463047304 /nfs/dbraw/zinc/04/73/04/463047304.db2.gz JVPPWIXTQAYMEO-UHFFFAOYSA-N 1 1 342.399 2.200 20 5 EEBDMO C[C@@H]1CCN(c2c([N+](=O)[O-])ncn2C)CC[N@H+]1Cc1ccccc1 ZINC000078689169 463141822 /nfs/dbraw/zinc/14/18/22/463141822.db2.gz KLFKBCQDDBOLJW-CQSZACIVSA-N 1 1 329.404 2.429 20 5 EEBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])o1)[N@@H+]1CCc2ccccc2C1 ZINC000025939029 463145350 /nfs/dbraw/zinc/14/53/50/463145350.db2.gz QRTODQIRIHPTHB-LBPRGKRZSA-N 1 1 329.356 2.364 20 5 EEBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])o1)[N@H+]1CCc2ccccc2C1 ZINC000025939029 463145357 /nfs/dbraw/zinc/14/53/57/463145357.db2.gz QRTODQIRIHPTHB-LBPRGKRZSA-N 1 1 329.356 2.364 20 5 EEBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](CN3CCOCC3)C2)c1 ZINC000069803475 463328058 /nfs/dbraw/zinc/32/80/58/463328058.db2.gz UMXOTARKKICIKQ-MRXNPFEDSA-N 1 1 349.431 2.018 20 5 EEBDMO C[N@H+]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C2(CCCCC2)C1 ZINC000081597700 463467723 /nfs/dbraw/zinc/46/77/23/463467723.db2.gz UEZDWAYDQNAVQE-UHFFFAOYSA-N 1 1 346.431 2.144 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2[C@H](C)CCC[C@@H]2CO)cccc1[N+](=O)[O-] ZINC000162368358 463504025 /nfs/dbraw/zinc/50/40/25/463504025.db2.gz ZOGKDFBHFUOBDA-TZMCWYRMSA-N 1 1 335.404 2.467 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC2(C1)CCOCC2 ZINC000072898854 463561174 /nfs/dbraw/zinc/56/11/74/463561174.db2.gz AAIZCBIQFLFMIW-UHFFFAOYSA-N 1 1 349.387 2.044 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC2(C1)CCOCC2 ZINC000072898854 463561180 /nfs/dbraw/zinc/56/11/80/463561180.db2.gz AAIZCBIQFLFMIW-UHFFFAOYSA-N 1 1 349.387 2.044 20 5 EEBDMO Cc1nc(NC[C@H](O)C[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000268427515 463740325 /nfs/dbraw/zinc/74/03/25/463740325.db2.gz AJPQETBTJGBTDI-INIZCTEOSA-N 1 1 342.399 2.129 20 5 EEBDMO C[C@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000193896383 463756161 /nfs/dbraw/zinc/75/61/61/463756161.db2.gz PPJABOGLQRBWLE-NWDGAFQWSA-N 1 1 348.403 2.078 20 5 EEBDMO CCc1ccc(C(=O)N2CC[NH2+]C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000261814764 463867370 /nfs/dbraw/zinc/86/73/70/463867370.db2.gz RUHMLHZNXGIHKH-QGZVFWFLSA-N 1 1 340.383 2.339 20 5 EEBDMO C[N@@H+](CCCCCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000278821179 463995443 /nfs/dbraw/zinc/99/54/43/463995443.db2.gz HOUHNAKGBUYTSE-UHFFFAOYSA-N 1 1 329.784 2.281 20 5 EEBDMO CC(C)[C@H](C(=O)NCc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000195719788 464083223 /nfs/dbraw/zinc/08/32/23/464083223.db2.gz LUILOBRYLKNYKI-JKIFEVAISA-N 1 1 349.431 2.345 20 5 EEBDMO CC(C)[C@H](C(=O)NCc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000195719788 464083227 /nfs/dbraw/zinc/08/32/27/464083227.db2.gz LUILOBRYLKNYKI-JKIFEVAISA-N 1 1 349.431 2.345 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C1CC1 ZINC000263744157 464175509 /nfs/dbraw/zinc/17/55/09/464175509.db2.gz OWFVCVHBCWENMU-UHFFFAOYSA-N 1 1 332.404 2.383 20 5 EEBDMO C[C@H]1CN(C(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000292333077 464199762 /nfs/dbraw/zinc/19/97/62/464199762.db2.gz JYKPWNWYXUYEHJ-CQSZACIVSA-N 1 1 347.415 2.306 20 5 EEBDMO C[C@@H]1CN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000292457014 464238116 /nfs/dbraw/zinc/23/81/16/464238116.db2.gz YMEYUEPOBVZDLB-CQSZACIVSA-N 1 1 346.431 2.340 20 5 EEBDMO Cc1cc(OCC(=O)NC[C@H]2CCCC[N@H+]2C2CC2)ccc1[N+](=O)[O-] ZINC000281009864 464297768 /nfs/dbraw/zinc/29/77/68/464297768.db2.gz LOOZJEHGLCWPFE-OAHLLOKOSA-N 1 1 347.415 2.415 20 5 EEBDMO C[N@H+]1CC[C@H]2OCCN(Cc3ccc([N+](=O)[O-])cc3Cl)[C@@H]2C1 ZINC000284747462 464321893 /nfs/dbraw/zinc/32/18/93/464321893.db2.gz XFIJYLVMAOFEJQ-HUUCEWRRSA-N 1 1 325.796 2.153 20 5 EEBDMO C[N@H+]1CC[C@@H]2OCCN(Cc3ccc([N+](=O)[O-])cc3Cl)[C@@H]2C1 ZINC000284747454 464322527 /nfs/dbraw/zinc/32/25/27/464322527.db2.gz XFIJYLVMAOFEJQ-CABCVRRESA-N 1 1 325.796 2.153 20 5 EEBDMO O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000264626217 464399938 /nfs/dbraw/zinc/39/99/38/464399938.db2.gz KNAREBIRVODMIH-LBPRGKRZSA-N 1 1 335.429 2.287 20 5 EEBDMO CN1CC[N@@H+](C)C[C@H]1CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000264701456 464429816 /nfs/dbraw/zinc/42/98/16/464429816.db2.gz FBHPOKQFMUJDID-LLVKDONJSA-N 1 1 332.326 2.271 20 5 EEBDMO CC[N@H+](Cc1ccccc1Cl)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174730330 464443774 /nfs/dbraw/zinc/44/37/74/464443774.db2.gz ASYNEILLDGKWSJ-AWEZNQCLSA-N 1 1 338.795 2.328 20 5 EEBDMO CCC(=O)c1ccc(N2CC[N@H+](C[C@@H](C)O)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000281421023 464448822 /nfs/dbraw/zinc/44/88/22/464448822.db2.gz IPJURKGMSWLCPY-QWHCGFSZSA-N 1 1 335.404 2.079 20 5 EEBDMO CCC(=O)c1ccc(N2CC[N@@H+](C[C@@H](C)O)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000281421023 464448828 /nfs/dbraw/zinc/44/88/28/464448828.db2.gz IPJURKGMSWLCPY-QWHCGFSZSA-N 1 1 335.404 2.079 20 5 EEBDMO COC(=O)c1cnc(N(C)CC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC000189326792 464476658 /nfs/dbraw/zinc/47/66/58/464476658.db2.gz SWVDHYZVXLPXOT-CYBMUJFWSA-N 1 1 336.392 2.087 20 5 EEBDMO COC(=O)c1cnc(NC[C@@H]2CC[N@@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000189349718 464482079 /nfs/dbraw/zinc/48/20/79/464482079.db2.gz NNMWYQAXZROAQT-LBPRGKRZSA-N 1 1 336.392 2.166 20 5 EEBDMO CC[NH+]1CCN(C[C@@H](C)CNc2cccc(OC)c2[N+](=O)[O-])CC1 ZINC000189447781 464506342 /nfs/dbraw/zinc/50/63/42/464506342.db2.gz MSJKQEFKMWKMFM-AWEZNQCLSA-N 1 1 336.436 2.289 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCO[C@@H]2CC[N@H+](C)C[C@H]21 ZINC000285295347 464514209 /nfs/dbraw/zinc/51/42/09/464514209.db2.gz PCKFBCLHEHXAHP-HUUCEWRRSA-N 1 1 347.415 2.065 20 5 EEBDMO CN(CC(=O)Nc1ccccc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000285362856 464537995 /nfs/dbraw/zinc/53/79/95/464537995.db2.gz BPBPNIWWOHZVEU-PBWFPOADSA-N 1 1 332.404 2.090 20 5 EEBDMO C[C@@H](O)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H](C)CO ZINC000294616068 464554818 /nfs/dbraw/zinc/55/48/18/464554818.db2.gz OKELFBXGXPLLOY-VHSXEESVSA-N 1 1 336.310 2.177 20 5 EEBDMO C[C@@H](C[NH+]1CCN(c2ccccn2)CC1)Nc1ccc([N+](=O)[O-])cn1 ZINC000265489661 464579028 /nfs/dbraw/zinc/57/90/28/464579028.db2.gz VPZJGWUFHRIEQV-AWEZNQCLSA-N 1 1 342.403 2.007 20 5 EEBDMO C[C@@H](c1ccccn1)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182288253 464620717 /nfs/dbraw/zinc/62/07/17/464620717.db2.gz WHGWUOFHXJKUIT-KBPBESRZSA-N 1 1 331.372 2.423 20 5 EEBDMO C[C@@H](C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C[C@H](C)O ZINC000272517561 464640664 /nfs/dbraw/zinc/64/06/64/464640664.db2.gz KMEFBNLJFBTHRX-DVOMOZLQSA-N 1 1 332.404 2.414 20 5 EEBDMO CC[C@H](CSC)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182383820 464640950 /nfs/dbraw/zinc/64/09/50/464640950.db2.gz CILNNGYMHAGBKT-OLZOCXBDSA-N 1 1 328.434 2.408 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000295159823 464727423 /nfs/dbraw/zinc/72/74/23/464727423.db2.gz QLLRXWPJWDZESS-OCCSQVGLSA-N 1 1 345.399 2.299 20 5 EEBDMO Cc1c(CC(=O)N2CC[N@H+](C3CC3)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000295301237 464781545 /nfs/dbraw/zinc/78/15/45/464781545.db2.gz JJTHHXWTBDDHKR-CYBMUJFWSA-N 1 1 331.416 2.388 20 5 EEBDMO CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000286126082 464812838 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1 1 344.415 2.249 20 5 EEBDMO C[C@@H](O)C[C@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000269771090 464087649 /nfs/dbraw/zinc/08/76/49/464087649.db2.gz BAFNBXHMBKCXOF-BXUZGUMPSA-N 1 1 332.360 2.380 20 5 EEBDMO COC(=O)[C@]12C[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@H]1CCCC2 ZINC000284315177 464147326 /nfs/dbraw/zinc/14/73/26/464147326.db2.gz ASJMSQSJLSODNZ-QGPMSJSTSA-N 1 1 348.399 2.293 20 5 EEBDMO COc1ccc(CNC(=O)[C@@H](C)[N@@H+]2[C@H](C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000263715121 464164951 /nfs/dbraw/zinc/16/49/51/464164951.db2.gz VQMMADXNKJCFMO-FRRDWIJNSA-N 1 1 335.404 2.481 20 5 EEBDMO C[N@@H+]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C(C)(C)C1 ZINC000270931754 464271482 /nfs/dbraw/zinc/27/14/82/464271482.db2.gz QJDQUUOMFJCTDG-UHFFFAOYSA-N 1 1 346.431 2.361 20 5 EEBDMO C[N@H+]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C(C)(C)C1 ZINC000270931754 464271487 /nfs/dbraw/zinc/27/14/87/464271487.db2.gz QJDQUUOMFJCTDG-UHFFFAOYSA-N 1 1 346.431 2.361 20 5 EEBDMO CC[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1O ZINC000271358237 464293516 /nfs/dbraw/zinc/29/35/16/464293516.db2.gz QOKDFPSHQGHLPM-BLLLJJGKSA-N 1 1 330.388 2.198 20 5 EEBDMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284762341 464328045 /nfs/dbraw/zinc/32/80/45/464328045.db2.gz MDOQSSDIEUFBCK-ZBFHGGJFSA-N 1 1 349.387 2.185 20 5 EEBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284762341 464328052 /nfs/dbraw/zinc/32/80/52/464328052.db2.gz MDOQSSDIEUFBCK-ZBFHGGJFSA-N 1 1 349.387 2.185 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000292752191 464330525 /nfs/dbraw/zinc/33/05/25/464330525.db2.gz JVZFNFBNJGSWJQ-MRXNPFEDSA-N 1 1 334.376 2.163 20 5 EEBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2N2CCOC2=O)C[C@H](C)[N@@H+]1C ZINC000292861464 464368672 /nfs/dbraw/zinc/36/86/72/464368672.db2.gz SESMEHHYVKNDKM-TXEJJXNPSA-N 1 1 334.376 2.080 20 5 EEBDMO CCC[C@H](C(=O)OCC)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245450086 464483356 /nfs/dbraw/zinc/48/33/56/464483356.db2.gz OHDLGHPYDMJQRU-TZMCWYRMSA-N 1 1 336.392 2.208 20 5 EEBDMO CCC[C@H](C(=O)OCC)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245450086 464483362 /nfs/dbraw/zinc/48/33/62/464483362.db2.gz OHDLGHPYDMJQRU-TZMCWYRMSA-N 1 1 336.392 2.208 20 5 EEBDMO C[N@H+]1CCC[C@@H]1CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000265370256 464533670 /nfs/dbraw/zinc/53/36/70/464533670.db2.gz NZWUZRWXEYACOO-GFCCVEGCSA-N 1 1 341.795 2.228 20 5 EEBDMO NC(=O)c1ccc(N2CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000265386423 464539750 /nfs/dbraw/zinc/53/97/50/464539750.db2.gz FANJXFIVFFOPPH-UHFFFAOYSA-N 1 1 340.383 2.016 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(C)CC[N@@H+](C)C2CC2)c1 ZINC000281721919 464559915 /nfs/dbraw/zinc/55/99/15/464559915.db2.gz XAQHJUVZKQYIOT-UHFFFAOYSA-N 1 1 335.404 2.225 20 5 EEBDMO O=[N+]([O-])c1cc(C[NH2+]C[C@H](N2CCOCC2)C(F)(F)F)cs1 ZINC000285579587 464616026 /nfs/dbraw/zinc/61/60/26/464616026.db2.gz UZVCKWDPADADJO-JTQLQIEISA-N 1 1 339.339 2.009 20 5 EEBDMO C[C@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1CC(C)(C)O ZINC000295021374 464680797 /nfs/dbraw/zinc/68/07/97/464680797.db2.gz MEGDXGFMMHZRDN-ZDUSSCGKSA-N 1 1 344.415 2.424 20 5 EEBDMO C[N@@H+](CCNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000265824618 464700526 /nfs/dbraw/zinc/70/05/26/464700526.db2.gz NJRKUALSKUEOHU-UHFFFAOYSA-N 1 1 334.420 2.311 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@H+](CCO)[C@H]2CCCc3ccccc32)n1 ZINC000176242662 464730032 /nfs/dbraw/zinc/73/00/32/464730032.db2.gz VSRSNTVBWKHYQF-INIZCTEOSA-N 1 1 330.388 2.163 20 5 EEBDMO COc1cc(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1F ZINC000295170202 464731149 /nfs/dbraw/zinc/73/11/49/464731149.db2.gz RPPITLUZRLEWNY-VHSXEESVSA-N 1 1 337.351 2.098 20 5 EEBDMO C[C@@H]1CCN(CCn2ccc([N+](=O)[O-])n2)CC[N@H+]1Cc1ccccc1 ZINC000176286375 464739967 /nfs/dbraw/zinc/73/99/67/464739967.db2.gz CDDKPMMOKNBXIW-MRXNPFEDSA-N 1 1 343.431 2.388 20 5 EEBDMO C[N@@H+]1CCN(CCNCc2cc(Cl)ccc2[N+](=O)[O-])CC1(C)C ZINC000282393817 464801432 /nfs/dbraw/zinc/80/14/32/464801432.db2.gz PEBIGLPWEPOGAT-UHFFFAOYSA-N 1 1 340.855 2.364 20 5 EEBDMO C[N@H+]1CCN(CCNCc2cc(Cl)ccc2[N+](=O)[O-])CC1(C)C ZINC000282393817 464801436 /nfs/dbraw/zinc/80/14/36/464801436.db2.gz PEBIGLPWEPOGAT-UHFFFAOYSA-N 1 1 340.855 2.364 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000249305807 464862170 /nfs/dbraw/zinc/86/21/70/464862170.db2.gz TVAKKWQLRKPXFL-RYUDHWBXSA-N 1 1 327.812 2.135 20 5 EEBDMO O=[N+]([O-])c1ccccc1C[NH2+]CCS(=O)(=O)CCc1ccccc1 ZINC000282551324 464862459 /nfs/dbraw/zinc/86/24/59/464862459.db2.gz CXJQFTVJLRIZEQ-UHFFFAOYSA-N 1 1 348.424 2.342 20 5 EEBDMO COCC[N@@H+](CCCc1ccccc1)CCn1cc([N+](=O)[O-])cn1 ZINC000266896705 464863419 /nfs/dbraw/zinc/86/34/19/464863419.db2.gz GVKMZJBNTYRUAL-UHFFFAOYSA-N 1 1 332.404 2.373 20 5 EEBDMO COCCOCCOCC[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000276253104 464863672 /nfs/dbraw/zinc/86/36/72/464863672.db2.gz NRYFJNOFGLWETC-AWEZNQCLSA-N 1 1 326.393 2.267 20 5 EEBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCN(CCO)CC2)s1 ZINC000266905962 464865639 /nfs/dbraw/zinc/86/56/39/464865639.db2.gz YRXSRBYYTKAMDL-UHFFFAOYSA-N 1 1 347.440 2.433 20 5 EEBDMO CC(=O)c1cc([N+](=O)[O-])ccc1N1CC[N@H+](CC(C)(C)O)[C@@H](C)C1 ZINC000286618128 464979667 /nfs/dbraw/zinc/97/96/67/464979667.db2.gz JKKYGECKNIWIHL-LBPRGKRZSA-N 1 1 335.404 2.079 20 5 EEBDMO CC(=O)c1cc([N+](=O)[O-])ccc1N1CC[N@@H+](CC(C)(C)O)[C@@H](C)C1 ZINC000286618128 464979674 /nfs/dbraw/zinc/97/96/74/464979674.db2.gz JKKYGECKNIWIHL-LBPRGKRZSA-N 1 1 335.404 2.079 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1C[C@H](C)N(C)[C@@H](C)C1 ZINC000339623976 465398413 /nfs/dbraw/zinc/39/84/13/465398413.db2.gz UTFSSOTXOAZKCT-KBPBESRZSA-N 1 1 334.420 2.256 20 5 EEBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000356841243 465568820 /nfs/dbraw/zinc/56/88/20/465568820.db2.gz FBDJIRLLHUUXJG-QWRGUYRKSA-N 1 1 325.796 2.342 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000356891861 465606076 /nfs/dbraw/zinc/60/60/76/465606076.db2.gz WNODDYSJFSRQPO-ZIAGYGMSSA-N 1 1 334.420 2.338 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c1 ZINC000299223654 465653432 /nfs/dbraw/zinc/65/34/32/465653432.db2.gz ONUXGASVHANPGU-STQMWFEESA-N 1 1 335.404 2.454 20 5 EEBDMO CNc1c(C(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000360953109 465659375 /nfs/dbraw/zinc/65/93/75/465659375.db2.gz FLOFKDDDKGMBDQ-CYBMUJFWSA-N 1 1 334.420 2.344 20 5 EEBDMO CNc1c(C(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000360953110 465659393 /nfs/dbraw/zinc/65/93/93/465659393.db2.gz FLOFKDDDKGMBDQ-ZDUSSCGKSA-N 1 1 334.420 2.344 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+](C)[C@H](C)[C@H]1C ZINC000356973133 465669414 /nfs/dbraw/zinc/66/94/14/465669414.db2.gz IGCUHCDYTVYRGP-ZIAGYGMSSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN(C)[C@H](C)[C@H]1C ZINC000356973133 465669424 /nfs/dbraw/zinc/66/94/24/465669424.db2.gz IGCUHCDYTVYRGP-ZIAGYGMSSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCN(C)[C@H](C)[C@H]1C ZINC000356973133 465669430 /nfs/dbraw/zinc/66/94/30/465669430.db2.gz IGCUHCDYTVYRGP-ZIAGYGMSSA-N 1 1 334.420 2.256 20 5 EEBDMO COC(=O)COc1ccc(C[NH2+][C@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000353183361 465699571 /nfs/dbraw/zinc/69/95/71/465699571.db2.gz QAEOBOUABVOAJX-GFCCVEGCSA-N 1 1 345.355 2.392 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1[N@@H+](C)CCCC1(C)C ZINC000344628757 465733021 /nfs/dbraw/zinc/73/30/21/465733021.db2.gz ATHOGDNVOOEKDY-OAHLLOKOSA-N 1 1 335.404 2.454 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2NC)C1 ZINC000361218904 465844492 /nfs/dbraw/zinc/84/44/92/465844492.db2.gz AEUSBHGUTQSQRP-CYBMUJFWSA-N 1 1 334.420 2.440 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H]3C[N@@H+](C)C[C@@H]3C)n2)c1 ZINC000361252296 465863388 /nfs/dbraw/zinc/86/33/88/465863388.db2.gz OPMUUHKGVBGSSY-GXFFZTMASA-N 1 1 332.360 2.242 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2F)[C@@H](C)C1 ZINC000357296131 465921743 /nfs/dbraw/zinc/92/17/43/465921743.db2.gz DTPXUXDAAPLCNF-BLLLJJGKSA-N 1 1 337.395 2.465 20 5 EEBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000580120139 468469020 /nfs/dbraw/zinc/46/90/20/468469020.db2.gz QZQPABQCARCMCC-CYBMUJFWSA-N 1 1 330.388 2.184 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]C[C@H]1CC[C@H](O)C1)c1cccc([N+](=O)[O-])c1 ZINC000353681759 466063764 /nfs/dbraw/zinc/06/37/64/466063764.db2.gz BOGJYJGHZLACBK-VBNZEHGJSA-N 1 1 330.388 2.168 20 5 EEBDMO Cc1ccc([C@H]2CCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000363049626 466194506 /nfs/dbraw/zinc/19/45/06/466194506.db2.gz OCWZDUDPFRXXPW-DLBZAZTESA-N 1 1 330.388 2.298 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@](O)(Cn2ccnn2)C1 ZINC000331727298 466221176 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CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C[C@H]1C ZINC000754226872 577802732 /nfs/dbraw/zinc/80/27/32/577802732.db2.gz VETZVAYFQNWPDG-CQSZACIVSA-N 1 1 346.431 2.361 20 5 EEBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C[C@H]1C ZINC000754226872 577802733 /nfs/dbraw/zinc/80/27/33/577802733.db2.gz VETZVAYFQNWPDG-CQSZACIVSA-N 1 1 346.431 2.361 20 5 EEBDMO C[N@H+]1CCC[C@@H](CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000756950459 577853715 /nfs/dbraw/zinc/85/37/15/577853715.db2.gz DSCDUBCDMAEDKD-NSHDSACASA-N 1 1 340.811 2.389 20 5 EEBDMO C[C@H]1CN=C(N2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)S1 ZINC000748046847 577954144 /nfs/dbraw/zinc/95/41/44/577954144.db2.gz RVHIBIRHQJPOBJ-ZDUSSCGKSA-N 1 1 334.445 2.246 20 5 EEBDMO CC(C)(C)[N@H+]1CCCN(Cn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000748084304 577954698 /nfs/dbraw/zinc/95/46/98/577954698.db2.gz YMVIAMANMVWNPR-UHFFFAOYSA-N 1 1 348.403 2.266 20 5 EEBDMO Cc1c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000748713187 577965992 /nfs/dbraw/zinc/96/59/92/577965992.db2.gz QXJRSSOJCGAIDQ-KGLIPLIRSA-N 1 1 348.359 2.168 20 5 EEBDMO CC[C@@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000736398519 578200888 /nfs/dbraw/zinc/20/08/88/578200888.db2.gz BAAMTZUCHZWQEN-GFCCVEGCSA-N 1 1 345.407 2.451 20 5 EEBDMO CCO[C@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000932972478 676385373 /nfs/dbraw/zinc/38/53/73/676385373.db2.gz SOFMDWHQFMSOOD-ZDUSSCGKSA-N 1 1 337.376 2.043 20 5 EEBDMO O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccc(C3CCC3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001022064061 676628614 /nfs/dbraw/zinc/62/86/14/676628614.db2.gz TTWRULHWHMMYSJ-XMTFNYHQSA-N 1 1 343.427 2.356 20 5 EEBDMO COC(=O)C[C@@H]1CCC[N@H+]1Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000179549015 679943835 /nfs/dbraw/zinc/94/38/35/679943835.db2.gz DDOUEPPWEGUNIN-LBPRGKRZSA-N 1 1 332.360 2.238 20 5 EEBDMO Cc1c(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000108300841 681654611 /nfs/dbraw/zinc/65/46/11/681654611.db2.gz SAMDDEFPQPMNRL-GFCCVEGCSA-N 1 1 348.359 2.026 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)OCCC[N@@H+]2CCO[C@H](C)C2)c1C ZINC000893387979 685201090 /nfs/dbraw/zinc/20/10/90/685201090.db2.gz WBOZVWQATHEVRW-CYBMUJFWSA-N 1 1 336.388 2.479 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)OCCC[N@H+]2CCO[C@H](C)C2)c1C ZINC000893387979 685201091 /nfs/dbraw/zinc/20/10/91/685201091.db2.gz WBOZVWQATHEVRW-CYBMUJFWSA-N 1 1 336.388 2.479 20 5 EEBDMO CC(C)[N@H+]1CCO[C@H](COC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000842333146 1188640023 /nfs/dbraw/zinc/64/00/23/1188640023.db2.gz BKWJGFDHIMKEHX-YESZJQIVSA-N 1 1 348.399 2.351 20 5 EEBDMO CCc1ccccc1C[NH+]1CCC(N(C)C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001005379827 1195336778 /nfs/dbraw/zinc/33/67/78/1195336778.db2.gz XKNAIMCACVRTOA-QZTJIDSGSA-N 1 1 345.443 2.337 20 5 EEBDMO Cc1cccc(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001034643830 1196464969 /nfs/dbraw/zinc/46/49/69/1196464969.db2.gz UIUUADPLBRSUKH-QBPKDAKJSA-N 1 1 331.416 2.177 20 5 EEBDMO COc1cc(OCC(=O)O[C@@H](C)Cn2cc[nH+]c2C)ccc1[N+](=O)[O-] ZINC000810620191 1199618392 /nfs/dbraw/zinc/61/83/92/1199618392.db2.gz DLQUVHCXPSEOQR-NSHDSACASA-N 1 1 349.343 2.119 20 5 EEBDMO C[C@]([NH3+])(C(=O)N1CC(C)(C)[C@@H]1[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000876982940 1199836105 /nfs/dbraw/zinc/83/61/05/1199836105.db2.gz JUOPBRUKLGZRQP-RVKKMQEKSA-N 1 1 347.415 2.185 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(C(=O)C(F)(F)c3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC000812342707 1200670826 /nfs/dbraw/zinc/67/08/26/1200670826.db2.gz OVYOYTPRCCVTQT-NEPJUHHUSA-N 1 1 339.342 2.097 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])CC[C@H]21 ZINC000866707457 1201586338 /nfs/dbraw/zinc/58/63/38/1201586338.db2.gz ADOKWJVXDHPHIL-UKRRQHHQSA-N 1 1 335.379 2.219 20 5 EEBDMO CC(C)CO[C@@H]1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1 ZINC000867927622 1201707528 /nfs/dbraw/zinc/70/75/28/1201707528.db2.gz KJWFUPIDBFHGKV-NVXWUHKLSA-N 1 1 335.404 2.042 20 5 EEBDMO COc1cc(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000886593259 1202529351 /nfs/dbraw/zinc/52/93/51/1202529351.db2.gz LYDVHWLDHYIGGH-AWEZNQCLSA-N 1 1 335.404 2.406 20 5 EEBDMO COc1cc(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000886593259 1202529353 /nfs/dbraw/zinc/52/93/53/1202529353.db2.gz LYDVHWLDHYIGGH-AWEZNQCLSA-N 1 1 335.404 2.406 20 5 EEBDMO CC[N@H+]1CC[C@H]1CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000890067370 1204775986 /nfs/dbraw/zinc/77/59/86/1204775986.db2.gz NBQMTGJWLFOIRP-INIZCTEOSA-N 1 1 332.404 2.363 20 5 EEBDMO Cc1cc(N(C)CCCNC(=O)C[N@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC001095574885 1205878899 /nfs/dbraw/zinc/87/88/99/1205878899.db2.gz OPWQXACGQZPTRE-UHFFFAOYSA-N 1 1 336.436 2.186 20 5 EEBDMO CC(C)(C)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)C(N)=O ZINC000930012226 1206528762 /nfs/dbraw/zinc/52/87/62/1206528762.db2.gz XIGAMZWZOZELHF-LLVKDONJSA-N 1 1 344.209 2.347 20 5 EEBDMO O=[N+]([O-])c1ccc(Br)c(C[N@@H+]2C[C@@H]3COC[C@@H]3C2)c1 ZINC000931606337 1207424289 /nfs/dbraw/zinc/42/42/89/1207424289.db2.gz CVZVRSIWUXDCBT-PHIMTYICSA-N 1 1 327.178 2.436 20 5 EEBDMO O=[N+]([O-])c1ccc(Br)c(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c1 ZINC000931606337 1207424292 /nfs/dbraw/zinc/42/42/92/1207424292.db2.gz CVZVRSIWUXDCBT-PHIMTYICSA-N 1 1 327.178 2.436 20 5 EEBDMO O=C(C[N@H+]1CCC[C@@H]1CCO)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000778266920 1208031667 /nfs/dbraw/zinc/03/16/67/1208031667.db2.gz BLESCQNYYSBMEP-LLVKDONJSA-N 1 1 327.768 2.034 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@@H]1CCO)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000778266920 1208031670 /nfs/dbraw/zinc/03/16/70/1208031670.db2.gz BLESCQNYYSBMEP-LLVKDONJSA-N 1 1 327.768 2.034 20 5 EEBDMO CC(C)[NH+]1CC(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000779555878 1210518772 /nfs/dbraw/zinc/51/87/72/1210518772.db2.gz IKOIEMQKUYSQJS-UHFFFAOYSA-N 1 1 346.431 2.408 20 5 EEBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000247080653 1213614119 /nfs/dbraw/zinc/61/41/19/1213614119.db2.gz WPKHVQAGCLCTIG-BBRMVZONSA-N 1 1 329.404 2.318 20 5 EEBDMO CC[N@H+](Cc1ccccc1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000957712976 1215372359 /nfs/dbraw/zinc/37/23/59/1215372359.db2.gz DTOMNTACODHPTO-QZTJIDSGSA-N 1 1 345.443 2.412 20 5 EEBDMO CC[N@@H+](Cc1ccccc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957712976 1215372362 /nfs/dbraw/zinc/37/23/62/1215372362.db2.gz DTOMNTACODHPTO-QZTJIDSGSA-N 1 1 345.443 2.412 20 5 EEBDMO CC[N@H+](Cc1ccccc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957712976 1215372364 /nfs/dbraw/zinc/37/23/64/1215372364.db2.gz DTOMNTACODHPTO-QZTJIDSGSA-N 1 1 345.443 2.412 20 5 EEBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](CC(N)=O)c1ccccc1 ZINC000796531883 1221117811 /nfs/dbraw/zinc/11/78/11/1221117811.db2.gz MOSHWXJRSSIOPN-IAGOWNOFSA-N 1 1 343.383 2.177 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(N2CC[NH+](CCCNC(=O)C(C)C)CC2)c1 ZINC001096248159 1236624770 /nfs/dbraw/zinc/62/47/70/1236624770.db2.gz KOEFOCMBVDJWHQ-UHFFFAOYSA-N 1 1 348.447 2.188 20 5 EEBDMO C/C=C(/C)C(=O)N1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC001048754755 1238527890 /nfs/dbraw/zinc/52/78/90/1238527890.db2.gz UCFFUHFBPUYVPX-BWEGZWNPSA-N 1 1 329.400 2.451 20 5 EEBDMO O=C(NC1(C2CC[NH+](Cc3ccsc3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000153253 1240004213 /nfs/dbraw/zinc/00/42/13/1240004213.db2.gz JHJSENFKRJOCIC-HUUCEWRRSA-N 1 1 349.456 2.274 20 5 EEBDMO O=[N+]([O-])c1ccc(CN2CC[NH+]([C@@H]3CCOC3)CC2)cc1Cl ZINC000827120158 1250159052 /nfs/dbraw/zinc/15/90/52/1250159052.db2.gz QDLZPACJSOTXIZ-CYBMUJFWSA-N 1 1 325.796 2.155 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCS(=O)(=O)C(C)(C)C ZINC000850444660 1277225498 /nfs/dbraw/zinc/22/54/98/1277225498.db2.gz YUGWBEHRPUMVKD-NSHDSACASA-N 1 1 344.433 2.467 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2CCC[C@H]3C[N@H+](C)C[C@H]32)c1F ZINC000854987176 1293022048 /nfs/dbraw/zinc/02/20/48/1293022048.db2.gz MPKGLCOTLSINBE-CMPLNLGQSA-N 1 1 339.342 2.348 20 5 EEBDMO C[N@@H+]1[C@@H]2C[C@H](Oc3ncc(C(F)(F)F)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001225843139 1301171852 /nfs/dbraw/zinc/17/18/52/1301171852.db2.gz CVGGPCXLHBYBGV-XRNSZHNASA-N 1 1 345.277 2.192 20 5 EEBDMO C[N@H+]1[C@@H]2C[C@H](Oc3ncc(C(F)(F)F)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001225843139 1301171862 /nfs/dbraw/zinc/17/18/62/1301171862.db2.gz CVGGPCXLHBYBGV-XRNSZHNASA-N 1 1 345.277 2.192 20 5 EEBDMO COC(=O)c1cc(O[C@@H]2CCC[N@@H+](C)CC2)c(OC)cc1[N+](=O)[O-] ZINC001226440826 1301413815 /nfs/dbraw/zinc/41/38/15/1301413815.db2.gz GGWVBGBJKLEDTH-LLVKDONJSA-N 1 1 338.360 2.253 20 5 EEBDMO CC(C)[N@H+]1CCC[C@H](Oc2n[nH]c(=O)c3cccc([N+](=O)[O-])c32)C1 ZINC001229367086 1302748530 /nfs/dbraw/zinc/74/85/30/1302748530.db2.gz HPBLEJRRECCEGL-NSHDSACASA-N 1 1 332.360 2.495 20 5 EEBDMO C[N@@H+](CCCNC(=O)c1ccnc(F)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC001235262084 1305170498 /nfs/dbraw/zinc/17/04/98/1305170498.db2.gz YIRHUXUGYBACKP-UHFFFAOYSA-N 1 1 346.362 2.381 20 5 EEBDMO C[C@@H](C(=O)NCc1ccco1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001116945252 1305933530 /nfs/dbraw/zinc/93/35/30/1305933530.db2.gz RUERDDDACQXKSG-ZDUSSCGKSA-N 1 1 331.372 2.367 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)c1F ZINC000831555400 1314597977 /nfs/dbraw/zinc/59/79/77/1314597977.db2.gz ODOJFDOJSDPOAW-VHSXEESVSA-N 1 1 327.331 2.346 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)c1F ZINC000831555400 1314597982 /nfs/dbraw/zinc/59/79/82/1314597982.db2.gz ODOJFDOJSDPOAW-VHSXEESVSA-N 1 1 327.331 2.346 20 5 EEBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@H]1[C@H]1CCCOC1 ZINC000842615414 1315732416 /nfs/dbraw/zinc/73/24/16/1315732416.db2.gz MEXSFCQKCZWSDY-STQMWFEESA-N 1 1 347.371 2.351 20 5 EEBDMO Cc1nn(C[N@@H+](C)C[C@]2(O)CCc3ccccc32)c(C)c1[N+](=O)[O-] ZINC000842624095 1315736354 /nfs/dbraw/zinc/73/63/54/1315736354.db2.gz MXECXNZNZUSKGO-QGZVFWFLSA-N 1 1 330.388 2.131 20 5 EEBDMO Cc1nn(C[N@H+](C)C[C@]2(O)CCc3ccccc32)c(C)c1[N+](=O)[O-] ZINC000842624095 1315736358 /nfs/dbraw/zinc/73/63/58/1315736358.db2.gz MXECXNZNZUSKGO-QGZVFWFLSA-N 1 1 330.388 2.131 20 5 EEBDMO CC(=O)N1CC[N@@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C[C@@H]1C ZINC001254481102 1318084586 /nfs/dbraw/zinc/08/45/86/1318084586.db2.gz RUYQWKUDZILPCU-AWEZNQCLSA-N 1 1 346.431 2.116 20 5 EEBDMO CCCNC(=O)[C@H]1CCCC[N@H+]1[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254597467 1318138631 /nfs/dbraw/zinc/13/86/31/1318138631.db2.gz DYENLKUMCDRLJU-IAGOWNOFSA-N 1 1 331.416 2.443 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1C[C@@H](OCC3CC3)[C@H]3COC[C@H]31)C2 ZINC001254599975 1318140239 /nfs/dbraw/zinc/14/02/39/1318140239.db2.gz NLMHTYFATGRZDR-INDMIFKZSA-N 1 1 344.411 2.188 20 5 EEBDMO CCOC(=O)c1ccnc(NCc2ccc(N)[nH+]c2C)c1[N+](=O)[O-] ZINC001156980604 1318325390 /nfs/dbraw/zinc/32/53/90/1318325390.db2.gz KNUZYVIWNXCUIA-UHFFFAOYSA-N 1 1 331.332 2.064 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CC[C@H](O)C[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC001256100990 1318648098 /nfs/dbraw/zinc/64/80/98/1318648098.db2.gz XNKFBJSGVFNZLU-BBRMVZONSA-N 1 1 349.431 2.417 20 5 EEBDMO O=C(NCCC1=CC[N@@H+](Cc2ccccc2F)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160097835 1320070266 /nfs/dbraw/zinc/07/02/66/1320070266.db2.gz KQTCMCIYBZNNLV-NVXWUHKLSA-N 1 1 347.390 2.129 20 5 EEBDMO O=C(NCCC1=CC[N@H+](Cc2ccccc2F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160097835 1320070272 /nfs/dbraw/zinc/07/02/72/1320070272.db2.gz KQTCMCIYBZNNLV-NVXWUHKLSA-N 1 1 347.390 2.129 20 5 EEBDMO O=C(NCCC1=CC[N@@H+](Cc2ccccc2F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160097835 1320070278 /nfs/dbraw/zinc/07/02/78/1320070278.db2.gz KQTCMCIYBZNNLV-NVXWUHKLSA-N 1 1 347.390 2.129 20 5 EEBDMO Cc1nc(Cl)nc(-n2cc(CC[NH3+])c3cnccc32)c1[N+](=O)[O-] ZINC001160944354 1320325457 /nfs/dbraw/zinc/32/54/57/1320325457.db2.gz GHKOTSFHLFWQLZ-UHFFFAOYSA-N 1 1 332.751 2.187 20 5 EEBDMO C[C@H](Nc1nccc2cc([N+](=O)[O-])ccc21)[C@@H]1C[N@@H+](C)CCN1C ZINC001262705882 1322354486 /nfs/dbraw/zinc/35/44/86/1322354486.db2.gz WFJFWWHORVWXNN-LRDDRELGSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1nccc2cc([N+](=O)[O-])ccc21)[C@@H]1CN(C)CC[N@@H+]1C ZINC001262705882 1322354497 /nfs/dbraw/zinc/35/44/97/1322354497.db2.gz WFJFWWHORVWXNN-LRDDRELGSA-N 1 1 329.404 2.189 20 5 EEBDMO C[C@H](Nc1nccc2cc([N+](=O)[O-])ccc21)[C@@H]1CN(C)CC[N@H+]1C ZINC001262705882 1322354499 /nfs/dbraw/zinc/35/44/99/1322354499.db2.gz WFJFWWHORVWXNN-LRDDRELGSA-N 1 1 329.404 2.189 20 5 EEBDMO CC(C)C[C@H](C)[N@@H+](C)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC001307872013 1331552344 /nfs/dbraw/zinc/55/23/44/1331552344.db2.gz KZLLDYNMRFEZNZ-ZDUSSCGKSA-N 1 1 343.449 2.240 20 5 EEBDMO CC(C)C[C@@H](C)[N@@H+](C)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC001307872011 1331552579 /nfs/dbraw/zinc/55/25/79/1331552579.db2.gz KZLLDYNMRFEZNZ-CYBMUJFWSA-N 1 1 343.449 2.240 20 5 EEBDMO C[C@]1(CO)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC001320089116 1332821435 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C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000343182585 161111180 /nfs/dbraw/zinc/11/11/80/161111180.db2.gz KASPNSCUXCWBQP-GASCZTMLSA-N 1 1 349.431 2.458 20 5 EEBDMO CCOc1cc(N2C[C@@H]([NH+]3CCOCC3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000343266569 161118502 /nfs/dbraw/zinc/11/85/02/161118502.db2.gz SOLLIQBUYQULKH-ZFWWWQNUSA-N 1 1 335.404 2.293 20 5 EEBDMO COc1cc([N+](=O)[O-])c(C(=O)NCC[N@@H+](C)C2CC2)cc1SC ZINC000343385495 161130658 /nfs/dbraw/zinc/13/06/58/161130658.db2.gz DAXCOVCSHGRQLJ-UHFFFAOYSA-N 1 1 339.417 2.149 20 5 EEBDMO C[C@@H]1C[C@H](CO)CC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000344148710 161202629 /nfs/dbraw/zinc/20/26/29/161202629.db2.gz DTLYTWSBFJQLMC-VXGBXAGGSA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@@H]1C[C@H](CO)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000344148710 161202630 /nfs/dbraw/zinc/20/26/30/161202630.db2.gz DTLYTWSBFJQLMC-VXGBXAGGSA-N 1 1 332.360 2.238 20 5 EEBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)COc1ccccc1[N+](=O)[O-] ZINC000344737067 161241195 /nfs/dbraw/zinc/24/11/95/161241195.db2.gz XZKYOTXINJTZGD-HNNXBMFYSA-N 1 1 335.404 2.210 20 5 EEBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCN1CCN(C)CC1 ZINC000344793739 161246371 /nfs/dbraw/zinc/24/63/71/161246371.db2.gz PCBHBQGSIOOWAG-SSZFMOIBSA-N 1 1 332.448 2.225 20 5 EEBDMO O=[N+]([O-])c1ccccc1Cc1noc(CCCC[NH+]2CCOCC2)n1 ZINC000345524169 161308649 /nfs/dbraw/zinc/30/86/49/161308649.db2.gz HPMBJYXJWSLUCU-UHFFFAOYSA-N 1 1 346.387 2.224 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000345941786 161344163 /nfs/dbraw/zinc/34/41/63/161344163.db2.gz DNDINWQMYWMQLR-ZIAGYGMSSA-N 1 1 334.420 2.338 20 5 EEBDMO Cc1ccccc1C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)CC1 ZINC000345990541 161348278 /nfs/dbraw/zinc/34/82/78/161348278.db2.gz IRLDKWIUVALVGK-UHFFFAOYSA-N 1 1 342.399 2.200 20 5 EEBDMO Cc1cc(NC[C@@]2(O)CC[N@H+](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000360048164 164224035 /nfs/dbraw/zinc/22/40/35/164224035.db2.gz RGKOGEUGWWAJPF-ZDUSSCGKSA-N 1 1 333.310 2.401 20 5 EEBDMO Nc1ccc(-c2noc([C@H]3CCc4[nH+]ccn4C3)n2)cc1[N+](=O)[O-] ZINC000364280963 165081387 /nfs/dbraw/zinc/08/13/87/165081387.db2.gz JYJXUFBCFCUBSF-JTQLQIEISA-N 1 1 326.316 2.154 20 5 EEBDMO COc1cc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc([N+](=O)[O-])c1C ZINC000364478915 165151720 /nfs/dbraw/zinc/15/17/20/165151720.db2.gz OWCHPOWXWMPPFN-KGLIPLIRSA-N 1 1 333.388 2.268 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H]([C@H]2CCOC2)C1 ZINC000374408873 167036772 /nfs/dbraw/zinc/03/67/72/167036772.db2.gz AOKUKNPSVSFHHU-KBPBESRZSA-N 1 1 333.388 2.200 20 5 EEBDMO CC(C)N1CCN([C@@H]2CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000375902075 167222305 /nfs/dbraw/zinc/22/23/05/167222305.db2.gz MCKIKVCSSHBDKQ-LJQANCHMSA-N 1 1 346.475 2.238 20 5 EEBDMO CC(C)N1CCN([C@@H]2CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000375902075 167222307 /nfs/dbraw/zinc/22/23/07/167222307.db2.gz MCKIKVCSSHBDKQ-LJQANCHMSA-N 1 1 346.475 2.238 20 5 EEBDMO C[C@@H]1C[N@H+](CCOc2ccccc2[N+](=O)[O-])C[C@]2(CCCOC2)O1 ZINC000376125833 167266176 /nfs/dbraw/zinc/26/61/76/167266176.db2.gz AYUXHAMPPXPIHQ-PBHICJAKSA-N 1 1 336.388 2.244 20 5 EEBDMO C[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@]2(CCCOC2)O1 ZINC000376125833 167266180 /nfs/dbraw/zinc/26/61/80/167266180.db2.gz AYUXHAMPPXPIHQ-PBHICJAKSA-N 1 1 336.388 2.244 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000272762778 269016557 /nfs/dbraw/zinc/01/65/57/269016557.db2.gz ATTURHOZPKEEBW-GFCCVEGCSA-N 1 1 336.392 2.409 20 5 EEBDMO C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCn1ccc([N+](=O)[O-])n1 ZINC000274871040 269067313 /nfs/dbraw/zinc/06/73/13/269067313.db2.gz XBAJPDIVSSPIGD-RDJZCZTQSA-N 1 1 343.431 2.292 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C2CCOCC2)C[C@@H]1C ZINC000278349014 269224627 /nfs/dbraw/zinc/22/46/27/269224627.db2.gz CXTILJQOBQFZPO-AWEZNQCLSA-N 1 1 347.415 2.229 20 5 EEBDMO Cc1cc(N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000278694558 269240531 /nfs/dbraw/zinc/24/05/31/269240531.db2.gz HVOVRBSWQXFNAX-GASCZTMLSA-N 1 1 339.399 2.358 20 5 EEBDMO CN(Cc1ccco1)C(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282500332 269494588 /nfs/dbraw/zinc/49/45/88/269494588.db2.gz QUVRQAFGTHMBMW-UHFFFAOYSA-N 1 1 331.372 2.321 20 5 EEBDMO CN(Cc1ccco1)C(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282500332 269494589 /nfs/dbraw/zinc/49/45/89/269494589.db2.gz QUVRQAFGTHMBMW-UHFFFAOYSA-N 1 1 331.372 2.321 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)[C@@H](C)C1 ZINC000275429777 274247915 /nfs/dbraw/zinc/24/79/15/274247915.db2.gz VFCBFJMRNXLBRR-QWHCGFSZSA-N 1 1 330.388 2.034 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)[C@@H](C)C1 ZINC000275429784 274247937 /nfs/dbraw/zinc/24/79/37/274247937.db2.gz VFCBFJMRNXLBRR-STQMWFEESA-N 1 1 330.388 2.034 20 5 EEBDMO C[C@@H]1C[N@@H+](CCN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000193699849 274347580 /nfs/dbraw/zinc/34/75/80/274347580.db2.gz LLDYHMKQKSRSIV-BETUJISGSA-N 1 1 336.392 2.168 20 5 EEBDMO C[C@@H]1C[N@H+](CCN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000193699849 274347581 /nfs/dbraw/zinc/34/75/81/274347581.db2.gz LLDYHMKQKSRSIV-BETUJISGSA-N 1 1 336.392 2.168 20 5 EEBDMO CC[N@H+]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)[C@@H](C)C1 ZINC000288444383 275059027 /nfs/dbraw/zinc/05/90/27/275059027.db2.gz NMFQOAAPZRPLIJ-LBPRGKRZSA-N 1 1 330.388 2.171 20 5 EEBDMO CC[N@H+]1CCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000288480242 275062585 /nfs/dbraw/zinc/06/25/85/275062585.db2.gz PGNKLQLOMBLJRE-JTQLQIEISA-N 1 1 343.786 2.482 20 5 EEBDMO O=C(NC[C@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1)C(F)(F)F ZINC000289458318 275117579 /nfs/dbraw/zinc/11/75/79/275117579.db2.gz LSLLOCAHEXUUNR-LLVKDONJSA-N 1 1 345.321 2.485 20 5 EEBDMO C[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCC1(F)F ZINC000289684175 275138929 /nfs/dbraw/zinc/13/89/29/275138929.db2.gz GNAXONNQKVBCMJ-RYUDHWBXSA-N 1 1 330.331 2.312 20 5 EEBDMO C[C@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000290956653 275255488 /nfs/dbraw/zinc/25/54/88/275255488.db2.gz NWLAYJJYYWGEDV-NWDGAFQWSA-N 1 1 347.419 2.154 20 5 EEBDMO CCCCOCCNC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000292123202 275379811 /nfs/dbraw/zinc/37/98/11/275379811.db2.gz KKYZCWBFELHDPP-UHFFFAOYSA-N 1 1 337.420 2.352 20 5 EEBDMO C[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1(CO)CCC1 ZINC000292169444 275387599 /nfs/dbraw/zinc/38/75/99/275387599.db2.gz PMUFTNUUGFSNKK-UHFFFAOYSA-N 1 1 327.768 2.034 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1(CO)CCC1 ZINC000292169444 275387600 /nfs/dbraw/zinc/38/76/00/275387600.db2.gz PMUFTNUUGFSNKK-UHFFFAOYSA-N 1 1 327.768 2.034 20 5 EEBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000408074309 288099544 /nfs/dbraw/zinc/09/95/44/288099544.db2.gz VYRMGNOHXUNJJS-UONOGXRCSA-N 1 1 346.431 2.360 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000408074309 288099545 /nfs/dbraw/zinc/09/95/45/288099545.db2.gz VYRMGNOHXUNJJS-UONOGXRCSA-N 1 1 346.431 2.360 20 5 EEBDMO COc1ccc(OCCN2CC[C@@]3(C2)CCC[N@@H+](C)C3)c([N+](=O)[O-])c1 ZINC000293042005 293109878 /nfs/dbraw/zinc/10/98/78/293109878.db2.gz SMDPDGXLFLGPCU-SFHVURJKSA-N 1 1 349.431 2.400 20 5 EEBDMO CCCc1[nH]nc(C(=O)Nc2cc(C)c3[nH+]ccn3c2)c1[N+](=O)[O-] ZINC000293861175 293312422 /nfs/dbraw/zinc/31/24/22/293312422.db2.gz JMSCVQSMEIDYSI-UHFFFAOYSA-N 1 1 328.332 2.479 20 5 EEBDMO Cc1nc(N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000297130098 294159724 /nfs/dbraw/zinc/15/97/24/294159724.db2.gz MYVFTWFGJXLSDS-ZDUSSCGKSA-N 1 1 327.388 2.404 20 5 EEBDMO COc1cc(C(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000160969392 311360615 /nfs/dbraw/zinc/36/06/15/311360615.db2.gz LCOUMBLYSXFQRQ-QWHCGFSZSA-N 1 1 335.404 2.454 20 5 EEBDMO C[C@@H]1C[N@@H+](C)CCN1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425397266 314385841 /nfs/dbraw/zinc/38/58/41/314385841.db2.gz AHDMOVIVGRGIGK-SNVBAGLBSA-N 1 1 328.210 2.493 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H]([C@H]2CCOC2)C1 ZINC000441650737 315190564 /nfs/dbraw/zinc/19/05/64/315190564.db2.gz VJDMMANBPOXFEY-KGLIPLIRSA-N 1 1 333.388 2.200 20 5 EEBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000445200171 315351714 /nfs/dbraw/zinc/35/17/14/315351714.db2.gz ZUNMPJOAHJNSCX-ZDUSSCGKSA-N 1 1 336.392 2.080 20 5 EEBDMO C[C@H]1CC[N@@H+](CCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000524720666 317023989 /nfs/dbraw/zinc/02/39/89/317023989.db2.gz KAYLYGHKCPWQAV-AWEZNQCLSA-N 1 1 334.420 2.245 20 5 EEBDMO C[C@H]1CC[N@@H+](CCNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000525804117 317078425 /nfs/dbraw/zinc/07/84/25/317078425.db2.gz JBVDDFIJWLUKFT-ZDUSSCGKSA-N 1 1 330.388 2.008 20 5 EEBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc2c(c1)CCS2(=O)=O ZINC000540621641 318076390 /nfs/dbraw/zinc/07/63/90/318076390.db2.gz CDIFKQYBLJIJDO-UHFFFAOYSA-N 1 1 332.381 2.214 20 5 EEBDMO CSCC[C@H](C)[N@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182180024 323367999 /nfs/dbraw/zinc/36/79/99/323367999.db2.gz OKPHSBAZUWCALE-LBPRGKRZSA-N 1 1 346.474 2.442 20 5 EEBDMO CSCC[C@H](C)[N@@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182180024 323368000 /nfs/dbraw/zinc/36/80/00/323368000.db2.gz OKPHSBAZUWCALE-LBPRGKRZSA-N 1 1 346.474 2.442 20 5 EEBDMO O=C(CC[N@H+]1CCOC[C@@H]1C1CCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000582120276 324384623 /nfs/dbraw/zinc/38/46/23/324384623.db2.gz MWYGNJCPMQZHKS-MRXNPFEDSA-N 1 1 333.388 2.424 20 5 EEBDMO C[N@@H+]1CCCC[C@@H]1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000609549116 450048770 /nfs/dbraw/zinc/04/87/70/450048770.db2.gz JHICBQLKLZWFOP-CQSZACIVSA-N 1 1 329.360 2.408 20 5 EEBDMO C[N@H+]1CCCC[C@@H]1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000609549116 450048775 /nfs/dbraw/zinc/04/87/75/450048775.db2.gz JHICBQLKLZWFOP-CQSZACIVSA-N 1 1 329.360 2.408 20 5 EEBDMO NC(=O)c1cccc(N2CCC[N@H+](C3CCCC3)CC2)c1[N+](=O)[O-] ZINC000342352961 465311880 /nfs/dbraw/zinc/31/18/80/465311880.db2.gz VKXAJHVPUMRZGI-UHFFFAOYSA-N 1 1 332.404 2.148 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CCO[C@H]3CCC[C@H]32)c([N+](=O)[O-])c1 ZINC000298281049 465353752 /nfs/dbraw/zinc/35/37/52/465353752.db2.gz XCMXWOBFXRPTOG-ZBFHGGJFSA-N 1 1 349.387 2.185 20 5 EEBDMO C[N@H+]1CCO[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C[C@@H]21 ZINC000153187946 462623499 /nfs/dbraw/zinc/62/34/99/462623499.db2.gz PNSZIGPGNHEQDH-QWHCGFSZSA-N 1 1 331.294 2.133 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000153926182 462708978 /nfs/dbraw/zinc/70/89/78/462708978.db2.gz PAVBXENBRGJZPJ-OAHLLOKOSA-N 1 1 335.404 2.162 20 5 EEBDMO C[NH+](C)[C@H](CNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000008189387 462771842 /nfs/dbraw/zinc/77/18/42/462771842.db2.gz ZWWFMSUYTUMRTO-MRXNPFEDSA-N 1 1 349.412 2.176 20 5 EEBDMO CCc1nn(C)c(NC[C@@H](CC(C)C)[NH+]2CCOCC2)c1[N+](=O)[O-] ZINC000092827980 462983534 /nfs/dbraw/zinc/98/35/34/462983534.db2.gz NZAXKNUHNHRNNC-CYBMUJFWSA-N 1 1 339.440 2.050 20 5 EEBDMO O=[N+]([O-])c1ccc(NCc2ccccc2C[NH+]2CCOCC2)nc1 ZINC000018061364 463003935 /nfs/dbraw/zinc/00/39/35/463003935.db2.gz FCKLIKJSWXDMHG-UHFFFAOYSA-N 1 1 328.372 2.434 20 5 EEBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](CO)C(C)(C)C ZINC000134368251 463029455 /nfs/dbraw/zinc/02/94/55/463029455.db2.gz ODJDSBUSSHVWEH-ZDUSSCGKSA-N 1 1 334.376 2.484 20 5 EEBDMO COC(=O)CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C[C@H]1CCCO1 ZINC000093460646 463038136 /nfs/dbraw/zinc/03/81/36/463038136.db2.gz ZKJQQGFWRYQKRC-OAHLLOKOSA-N 1 1 336.388 2.447 20 5 EEBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)NCc2ccc([N+](=O)[O-])cc2)C1 ZINC000157641987 463153205 /nfs/dbraw/zinc/15/32/05/463153205.db2.gz UHJGVVOCXCTFQH-OAHLLOKOSA-N 1 1 334.420 2.372 20 5 EEBDMO CCOC(=O)[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000026218835 463154511 /nfs/dbraw/zinc/15/45/11/463154511.db2.gz OGNOTUAUNGUKLS-CYBMUJFWSA-N 1 1 349.387 2.199 20 5 EEBDMO C[N@@H+]1CCC[C@@H]2CN(CCC(=O)Nc3ccccc3[N+](=O)[O-])CC[C@@H]21 ZINC000139980359 463335034 /nfs/dbraw/zinc/33/50/34/463335034.db2.gz QBURJAMMFIKMLA-ZBFHGGJFSA-N 1 1 346.431 2.340 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(CCC(=O)Nc3ccccc3[N+](=O)[O-])CC[C@@H]21 ZINC000139980359 463335039 /nfs/dbraw/zinc/33/50/39/463335039.db2.gz QBURJAMMFIKMLA-ZBFHGGJFSA-N 1 1 346.431 2.340 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000080988885 463379688 /nfs/dbraw/zinc/37/96/88/463379688.db2.gz BXYQVXPCHGHHHP-ZDUSSCGKSA-N 1 1 343.387 2.444 20 5 EEBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)[C@@H]1CCC[N@@H+](C)C1 ZINC000151144025 463483439 /nfs/dbraw/zinc/48/34/39/463483439.db2.gz CRVFKHQZAXOAAU-OAHLLOKOSA-N 1 1 346.431 2.361 20 5 EEBDMO O=[N+]([O-])c1ccc2oc(CN3CC[NH+](C[C@@H]4CCCO4)CC3)nc2c1 ZINC000083128375 463535717 /nfs/dbraw/zinc/53/57/17/463535717.db2.gz KLZFVELRRXOJLF-AWEZNQCLSA-N 1 1 346.387 2.033 20 5 EEBDMO O=C1[C@@H]([N@H+]2CCC3(C2)CCOCC3)CCN1c1cccc([N+](=O)[O-])c1 ZINC000072899019 463561583 /nfs/dbraw/zinc/56/15/83/463561583.db2.gz MAXDCGQOLJUHLK-INIZCTEOSA-N 1 1 345.399 2.203 20 5 EEBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2csc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000044402422 463678226 /nfs/dbraw/zinc/67/82/26/463678226.db2.gz ZLWZYURIHAQSBW-GHMZBOCLSA-N 1 1 341.433 2.274 20 5 EEBDMO COCC[N@@H+](C)CCNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000171129841 463793848 /nfs/dbraw/zinc/79/38/48/463793848.db2.gz DFCWWYRLVJEAMH-UHFFFAOYSA-N 1 1 337.401 2.118 20 5 EEBDMO O=[N+]([O-])c1cnc(NC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)nc1 ZINC000276949942 463816778 /nfs/dbraw/zinc/81/67/78/463816778.db2.gz BPHOFJWGASVHGP-INIZCTEOSA-N 1 1 343.387 2.088 20 5 EEBDMO O=[N+]([O-])c1cnc(NC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)nc1 ZINC000276949947 463817633 /nfs/dbraw/zinc/81/76/33/463817633.db2.gz BPHOFJWGASVHGP-MRXNPFEDSA-N 1 1 343.387 2.088 20 5 EEBDMO CO[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1OC ZINC000276955596 463819990 /nfs/dbraw/zinc/81/99/90/463819990.db2.gz 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C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000195317016 464039785 /nfs/dbraw/zinc/03/97/85/464039785.db2.gz GLVVZGMZCFPOIU-TZMCWYRMSA-N 1 1 335.429 2.382 20 5 EEBDMO O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[N@H+](C2CCCC2)CC1 ZINC000172418006 464075072 /nfs/dbraw/zinc/07/50/72/464075072.db2.gz FVHAWQHINGOIEC-UHFFFAOYSA-N 1 1 346.431 2.484 20 5 EEBDMO CN(C)C1(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000186961900 464084994 /nfs/dbraw/zinc/08/49/94/464084994.db2.gz YWQXHSVUYJOTGQ-UHFFFAOYSA-N 1 1 334.420 2.340 20 5 EEBDMO CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC1([NH+](C)C)CCC1 ZINC000186961900 464084997 /nfs/dbraw/zinc/08/49/97/464084997.db2.gz YWQXHSVUYJOTGQ-UHFFFAOYSA-N 1 1 334.420 2.340 20 5 EEBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000279270219 464086207 /nfs/dbraw/zinc/08/62/07/464086207.db2.gz JCBIIQIJRYWLGS-QWHCGFSZSA-N 1 1 333.388 2.350 20 5 EEBDMO CN(C)C(=O)[C@H]1CCC[N@H+]1CCCNc1ccc(F)cc1[N+](=O)[O-] ZINC000263677564 464149194 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2.326 20 5 EEBDMO O=[N+]([O-])c1cc(CNC[C@@H](O)C[N@H+]2CCc3ccccc3C2)cs1 ZINC000237955283 464410274 /nfs/dbraw/zinc/41/02/74/464410274.db2.gz UQDCBUMNBDHDRG-MRXNPFEDSA-N 1 1 347.440 2.165 20 5 EEBDMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000174962043 464473871 /nfs/dbraw/zinc/47/38/71/464473871.db2.gz SFMLLASVJONIQI-LSDHHAIUSA-N 1 1 346.431 2.482 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272133533 464490536 /nfs/dbraw/zinc/49/05/36/464490536.db2.gz XKTYFPPSRVWKAA-KBPBESRZSA-N 1 1 339.342 2.430 20 5 EEBDMO CCCN1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1=O ZINC000189387859 464492134 /nfs/dbraw/zinc/49/21/34/464492134.db2.gz IJOIDZXEKTUDOA-UHFFFAOYSA-N 1 1 335.404 2.308 20 5 EEBDMO CCCN1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1=O ZINC000189387859 464492139 /nfs/dbraw/zinc/49/21/39/464492139.db2.gz IJOIDZXEKTUDOA-UHFFFAOYSA-N 1 1 335.404 2.308 20 5 EEBDMO CC(C)NC(=O)c1ccc(N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])c1 ZINC000272233825 464529018 /nfs/dbraw/zinc/52/90/18/464529018.db2.gz VCCFDQFFSQRFFM-DYVFJYSZSA-N 1 1 346.431 2.263 20 5 EEBDMO C[C@H](CO)[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H](C)O ZINC000294616069 464554485 /nfs/dbraw/zinc/55/44/85/464554485.db2.gz OKELFBXGXPLLOY-ZJUUUORDSA-N 1 1 336.310 2.177 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)[C@H]2C1 ZINC000272487236 464629013 /nfs/dbraw/zinc/62/90/13/464629013.db2.gz MRRDJBIJEWPWTB-NHYWBVRUSA-N 1 1 328.372 2.242 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](C)C1 ZINC000247337662 464670093 /nfs/dbraw/zinc/67/00/93/464670093.db2.gz JBIAAHJKHQWBST-XHDPSFHLSA-N 1 1 345.403 2.273 20 5 EEBDMO CC[N@@H+]1CC[C@@H](N(C)C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@@H](C)C1 ZINC000247337662 464670098 /nfs/dbraw/zinc/67/00/98/464670098.db2.gz JBIAAHJKHQWBST-XHDPSFHLSA-N 1 1 345.403 2.273 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@@H](C)C1 ZINC000247337662 464670101 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ZINC000744194358 577894322 /nfs/dbraw/zinc/89/43/22/577894322.db2.gz DFXPGEZQYPSCDK-KRWDZBQOSA-N 1 1 345.399 2.294 20 5 EEBDMO Cc1nn(C[N@@H+](C)CCCn2ccnc2C)c2ncc([N+](=O)[O-])cc12 ZINC000746631645 577931228 /nfs/dbraw/zinc/93/12/28/577931228.db2.gz MYUZSWDAGWAVRB-UHFFFAOYSA-N 1 1 343.391 2.132 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)nc1-c1ccncc1 ZINC000749800275 577981972 /nfs/dbraw/zinc/98/19/72/577981972.db2.gz RFZZYOHOPMTMLC-CABCVRRESA-N 1 1 343.387 2.169 20 5 EEBDMO Cc1nn(CN2CCC[N@H+](C(C)C)CC2)c2ncc([N+](=O)[O-])cc12 ZINC000749952074 577984430 /nfs/dbraw/zinc/98/44/30/577984430.db2.gz SHGISDNOTOGUBB-UHFFFAOYSA-N 1 1 332.408 2.022 20 5 EEBDMO CCOC[C@H]1CCC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1 ZINC000749953297 577984593 /nfs/dbraw/zinc/98/45/93/577984593.db2.gz LMHBVTCCFKYCLR-ZDUSSCGKSA-N 1 1 333.392 2.354 20 5 EEBDMO CC[N@@H+](C[C@@H]1CCOC1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742149689 578127932 /nfs/dbraw/zinc/12/79/32/578127932.db2.gz MAMWFGTXQMVTAA-ZDUSSCGKSA-N 1 1 331.376 2.169 20 5 EEBDMO CCCNC(=O)[C@@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000050900075 676487455 /nfs/dbraw/zinc/48/74/55/676487455.db2.gz STUGCRSHCPRGDL-CYBMUJFWSA-N 1 1 345.403 2.140 20 5 EEBDMO O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000176203617 677811438 /nfs/dbraw/zinc/81/14/38/677811438.db2.gz PFIXMWYGDFPGHJ-TXEJJXNPSA-N 1 1 329.356 2.270 20 5 EEBDMO O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000176203617 677811443 /nfs/dbraw/zinc/81/14/43/677811443.db2.gz PFIXMWYGDFPGHJ-TXEJJXNPSA-N 1 1 329.356 2.270 20 5 EEBDMO COc1c(O)ccc(C[N@@H+]2CCS[C@H]3COCC[C@@H]32)c1[N+](=O)[O-] ZINC000892211424 678258347 /nfs/dbraw/zinc/25/83/47/678258347.db2.gz LSXWGOIMMQTRFE-AAEUAGOBSA-N 1 1 340.401 2.015 20 5 EEBDMO COc1c(O)ccc(C[N@H+]2CCS[C@H]3COCC[C@@H]32)c1[N+](=O)[O-] ZINC000892211424 678258348 /nfs/dbraw/zinc/25/83/48/678258348.db2.gz LSXWGOIMMQTRFE-AAEUAGOBSA-N 1 1 340.401 2.015 20 5 EEBDMO CC[NH+](CC)[C@H](C(=O)OCCn1cc([N+](=O)[O-])cn1)c1ccccc1 ZINC000177787000 681521178 /nfs/dbraw/zinc/52/11/78/681521178.db2.gz LEKJMTOJRVKOMA-INIZCTEOSA-N 1 1 346.387 2.418 20 5 EEBDMO COc1c(O)ccc(C[N@H+]2CC[C@H](c3nccn3C)C2)c1[N+](=O)[O-] ZINC000894484317 682921131 /nfs/dbraw/zinc/92/11/31/682921131.db2.gz QRZFISYFFSAUBP-LBPRGKRZSA-N 1 1 332.360 2.032 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCc1ccsc1 ZINC001029304775 683940338 /nfs/dbraw/zinc/94/03/38/683940338.db2.gz KAPYFBDCRZKKQP-QKPAOTATSA-N 1 1 349.456 2.021 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@H+]2CCCc1ccsc1 ZINC001029304775 683940339 /nfs/dbraw/zinc/94/03/39/683940339.db2.gz KAPYFBDCRZKKQP-QKPAOTATSA-N 1 1 349.456 2.021 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCc1ccsc1 ZINC001029304775 683940341 /nfs/dbraw/zinc/94/03/41/683940341.db2.gz KAPYFBDCRZKKQP-QKPAOTATSA-N 1 1 349.456 2.021 20 5 EEBDMO COc1c(O)ccc(CN[C@@H]2CCC[N@@H+]3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000895228253 684311024 /nfs/dbraw/zinc/31/10/24/684311024.db2.gz XGHUCQYDHCCBKR-ZIAGYGMSSA-N 1 1 335.404 2.416 20 5 EEBDMO COc1c(O)ccc(CN[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000895228253 684311028 /nfs/dbraw/zinc/31/10/28/684311028.db2.gz XGHUCQYDHCCBKR-ZIAGYGMSSA-N 1 1 335.404 2.416 20 5 EEBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@H](CF)C2)cc1[N+](=O)[O-] ZINC000895544382 684638672 /nfs/dbraw/zinc/63/86/72/684638672.db2.gz LAAYDHVJFPNADT-CYBMUJFWSA-N 1 1 340.351 2.328 20 5 EEBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc([C@@H]2CCC[N@@H+]2C)[nH]n1 ZINC000895669584 684681245 /nfs/dbraw/zinc/68/12/45/684681245.db2.gz GGUIOHGHNYDZII-INIZCTEOSA-N 1 1 343.387 2.357 20 5 EEBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc([C@@H]2CCC[N@H+]2C)[nH]n1 ZINC000895669584 684681250 /nfs/dbraw/zinc/68/12/50/684681250.db2.gz GGUIOHGHNYDZII-INIZCTEOSA-N 1 1 343.387 2.357 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](C[NH+]3CCOCC3)C2)c1C ZINC000896684887 685171336 /nfs/dbraw/zinc/17/13/36/685171336.db2.gz ULXFVLUPXNNQOF-OAHLLOKOSA-N 1 1 347.415 2.006 20 5 EEBDMO Cc1ccc([C@H](C)NC(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000893452607 687691767 /nfs/dbraw/zinc/69/17/67/687691767.db2.gz MPKGTUIGQMBMEP-BJJXKVORSA-N 1 1 332.404 2.310 20 5 EEBDMO Cc1ccc([C@H](C)NC(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000893452620 687691795 /nfs/dbraw/zinc/69/17/95/687691795.db2.gz MPKGTUIGQMBMEP-NOLJZWGESA-N 1 1 332.404 2.310 20 5 EEBDMO C[C@@H](NC(=O)N1CC[C@]2(CC[N@@H+](C)C2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000925246314 688228619 /nfs/dbraw/zinc/22/86/19/688228619.db2.gz GSJVECCSJDXUMH-DYVFJYSZSA-N 1 1 332.404 2.393 20 5 EEBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC[N@H+]1CCC(C)(C)C1 ZINC000898598062 693390438 /nfs/dbraw/zinc/39/04/38/693390438.db2.gz ONZIDQPKENHWBO-UHFFFAOYSA-N 1 1 334.420 2.468 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)O[C@H]1C[C@@H]([NH+]2CCOCC2)C1 ZINC000873527910 1198631391 /nfs/dbraw/zinc/63/13/91/1198631391.db2.gz AGGIPIPTSOFNDF-OKILXGFUSA-N 1 1 334.372 2.232 20 5 EEBDMO Cc1cc(N2CC[N@@H+](C[C@H](C)O)C[C@H]2C)c(Cl)cc1[N+](=O)[O-] ZINC000795141955 1200885346 /nfs/dbraw/zinc/88/53/46/1200885346.db2.gz ZMECDUCTSPIIDH-NEPJUHHUSA-N 1 1 327.812 2.448 20 5 EEBDMO Cc1cc(N2CC[N@H+](C[C@H](C)O)C[C@H]2C)c(Cl)cc1[N+](=O)[O-] ZINC000795141955 1200885353 /nfs/dbraw/zinc/88/53/53/1200885353.db2.gz ZMECDUCTSPIIDH-NEPJUHHUSA-N 1 1 327.812 2.448 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC[C@@](CO)(c3ccccc3)C2)cc1 ZINC000812883345 1200968340 /nfs/dbraw/zinc/96/83/40/1200968340.db2.gz STUDCISPZPQKCI-RBUKOAKNSA-N 1 1 342.395 2.264 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[N@@H+]2Cc3ccccc3N3CCC[C@@H]3C2)c1 ZINC000880550925 1201519663 /nfs/dbraw/zinc/51/96/63/1201519663.db2.gz WWSBJRIRQPEYHG-OAHLLOKOSA-N 1 1 327.388 2.276 20 5 EEBDMO COc1ccccc1CN(C)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867947888 1201712451 /nfs/dbraw/zinc/71/24/51/1201712451.db2.gz WAYAMVNCJTWULI-SFHVURJKSA-N 1 1 343.383 2.436 20 5 EEBDMO Cc1[nH+]ccn1CCCCNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000129976784 1201931254 /nfs/dbraw/zinc/93/12/54/1201931254.db2.gz LCFYYIJUSOYDNJ-UHFFFAOYSA-N 1 1 345.403 2.376 20 5 EEBDMO C[N@H+]1CCN(Cc2cccnc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000886193721 1202480045 /nfs/dbraw/zinc/48/00/45/1202480045.db2.gz BAYOFYVGVBISBV-QGZVFWFLSA-N 1 1 326.400 2.349 20 5 EEBDMO COCC[N@H+]1[C@H](C)CN(c2ccc([N+](=O)[O-])c(C(C)=O)c2)C[C@@H]1C ZINC000826632334 1204599606 /nfs/dbraw/zinc/59/96/06/1204599606.db2.gz FITAXTLMQMBIRV-BETUJISGSA-N 1 1 335.404 2.343 20 5 EEBDMO COCC[N@@H+]1[C@H](C)CN(c2ccc([N+](=O)[O-])c(C(C)=O)c2)C[C@@H]1C ZINC000826632334 1204599608 /nfs/dbraw/zinc/59/96/08/1204599608.db2.gz FITAXTLMQMBIRV-BETUJISGSA-N 1 1 335.404 2.343 20 5 EEBDMO CC(C)N1CC[NH+](CCC(=O)N[C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000928245923 1206363767 /nfs/dbraw/zinc/36/37/67/1206363767.db2.gz ZKJAQXHTXYLUDM-OAHLLOKOSA-N 1 1 348.447 2.188 20 5 EEBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1C ZINC000928556476 1206398747 /nfs/dbraw/zinc/39/87/47/1206398747.db2.gz PQSMLEOGHXAGAI-VIFPVBQESA-N 1 1 342.193 2.100 20 5 EEBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@@H+]1C ZINC000928556476 1206398750 /nfs/dbraw/zinc/39/87/50/1206398750.db2.gz PQSMLEOGHXAGAI-VIFPVBQESA-N 1 1 342.193 2.100 20 5 EEBDMO O=C(NC1CC2(C1)CC([NH2+]CC1CCCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC000963789803 1218040762 /nfs/dbraw/zinc/04/07/62/1218040762.db2.gz BPQMVWIPICCQTL-YVXVDGILSA-N 1 1 335.448 2.249 20 5 EEBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](CC(N)=O)c1ccccc1 ZINC000796531887 1221117985 /nfs/dbraw/zinc/11/79/85/1221117985.db2.gz MOSHWXJRSSIOPN-SJORKVTESA-N 1 1 343.383 2.177 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CC3CCC4(CC4)CC3)C[C@@H]2C1 ZINC001048813017 1238716287 /nfs/dbraw/zinc/71/62/87/1238716287.db2.gz WAASMHOYDRFULW-YYIAUSFCSA-N 1 1 347.459 2.012 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@@H+](CC3CCC4(CC4)CC3)C[C@@H]2C1 ZINC001048813017 1238716300 /nfs/dbraw/zinc/71/63/00/1238716300.db2.gz WAASMHOYDRFULW-YYIAUSFCSA-N 1 1 347.459 2.012 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CC3CCC4(CC4)CC3)C[C@@H]2C1 ZINC001048813017 1238716318 /nfs/dbraw/zinc/71/63/18/1238716318.db2.gz WAASMHOYDRFULW-YYIAUSFCSA-N 1 1 347.459 2.012 20 5 EEBDMO CC(C)=CC[N@H+]1CCc2c(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cccc2C1 ZINC001051291128 1245487369 /nfs/dbraw/zinc/48/73/69/1245487369.db2.gz LDOCNMXDBXDGGA-QZTJIDSGSA-N 1 1 343.427 2.292 20 5 EEBDMO CC(C)=CC[N@@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001051291128 1245487374 /nfs/dbraw/zinc/48/73/74/1245487374.db2.gz LDOCNMXDBXDGGA-QZTJIDSGSA-N 1 1 343.427 2.292 20 5 EEBDMO CC(C)=CC[N@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001051291128 1245487379 /nfs/dbraw/zinc/48/73/79/1245487379.db2.gz LDOCNMXDBXDGGA-QZTJIDSGSA-N 1 1 343.427 2.292 20 5 EEBDMO CC(C)=CC[N@H+]1Cc2ccc(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2C1 ZINC001054264612 1247932663 /nfs/dbraw/zinc/93/26/63/1247932663.db2.gz MRXSTULRJYXHSJ-IAGOWNOFSA-N 1 1 329.400 2.250 20 5 EEBDMO CCN(CCNC(=O)C[N@@H+](C)C1CCC1)c1cc(C)ccc1[N+](=O)[O-] ZINC001100750985 1259213320 /nfs/dbraw/zinc/21/33/20/1259213320.db2.gz CPOCZKWZGNHDAM-UHFFFAOYSA-N 1 1 348.447 2.330 20 5 EEBDMO O=C(OCC[NH+]1CCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000861384614 1295382853 /nfs/dbraw/zinc/38/28/53/1295382853.db2.gz AECMPSXDFIRTNQ-UHFFFAOYSA-N 1 1 348.277 2.398 20 5 EEBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](OCc3cccc([N+](=O)[O-])c3)C[C@H]1[N@H+]2C ZINC001222770886 1299846907 /nfs/dbraw/zinc/84/69/07/1299846907.db2.gz OCDJSUPCPVTPDM-NXOAAHMSSA-N 1 1 334.372 2.278 20 5 EEBDMO C[N@@H+](CCCNC(=O)c1ccccn1)Cc1cccc([N+](=O)[O-])c1 ZINC001231177231 1303666994 /nfs/dbraw/zinc/66/69/94/1303666994.db2.gz WBUNMHUKAIKUNX-UHFFFAOYSA-N 1 1 328.372 2.242 20 5 EEBDMO Cc1cc(C(=O)NCCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])no1 ZINC001233665461 1304552614 /nfs/dbraw/zinc/55/26/14/1304552614.db2.gz IFYINRRHAHMZOJ-UHFFFAOYSA-N 1 1 332.360 2.143 20 5 EEBDMO C[C@]1(C(N)=O)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001116895215 1305927758 /nfs/dbraw/zinc/92/77/58/1305927758.db2.gz ZWMHGEOVUTYLMY-ZDUSSCGKSA-N 1 1 342.193 2.055 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC001120008284 1309278484 /nfs/dbraw/zinc/27/84/84/1309278484.db2.gz NJBZREMZYGYSKP-QGZVFWFLSA-N 1 1 346.431 2.116 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cc1Cl ZINC000836779172 1315025614 /nfs/dbraw/zinc/02/56/14/1315025614.db2.gz MONQYLKSSLBJSR-QMTHXVAHSA-N 1 1 341.795 2.006 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cc1Cl ZINC000836779172 1315025616 /nfs/dbraw/zinc/02/56/16/1315025616.db2.gz MONQYLKSSLBJSR-QMTHXVAHSA-N 1 1 341.795 2.006 20 5 EEBDMO CC[C@]1(CO)CCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839574285 1315216738 /nfs/dbraw/zinc/21/67/38/1315216738.db2.gz KTBCSAQVFFRJAM-OAHLLOKOSA-N 1 1 341.795 2.424 20 5 EEBDMO CC[C@]1(CO)CCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839574285 1315216741 /nfs/dbraw/zinc/21/67/41/1315216741.db2.gz KTBCSAQVFFRJAM-OAHLLOKOSA-N 1 1 341.795 2.424 20 5 EEBDMO O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CCC3(CC2)OCCCO3)c1 ZINC000840085266 1315289987 /nfs/dbraw/zinc/28/99/87/1315289987.db2.gz DWWHHKUWPRNEQW-UHFFFAOYSA-N 1 1 332.360 2.131 20 5 EEBDMO O=C(O[C@H]1C[C@@H]([NH+]2CCOCC2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000842358822 1315688820 /nfs/dbraw/zinc/68/88/20/1315688820.db2.gz PSBVZGSGRHNYMK-VVLHAWIVSA-N 1 1 346.383 2.105 20 5 EEBDMO CCO[C@@H]1C[C@H]2CN([C@H](C)Cc3ccccc3[N+](=O)[O-])CC[N@H+]2C1 ZINC001254556928 1318121254 /nfs/dbraw/zinc/12/12/54/1318121254.db2.gz NHCDWJORLKVGFY-HYVNUMGLSA-N 1 1 333.432 2.321 20 5 EEBDMO CCOC(=O)c1cc([N+](=O)[O-])cnc1N1CC[N@@H+](C)CC12CCCC2 ZINC001158410698 1319225600 /nfs/dbraw/zinc/22/56/00/1319225600.db2.gz YWWSRVYLEDNSMO-UHFFFAOYSA-N 1 1 348.403 2.231 20 5 EEBDMO C[N@@H+]1CCc2c(NCc3cn4cccnc4n3)ccc([N+](=O)[O-])c2C1 ZINC001161909837 1320672955 /nfs/dbraw/zinc/67/29/55/1320672955.db2.gz VGQRQLKNHLMVPT-UHFFFAOYSA-N 1 1 338.371 2.238 20 5 EEBDMO C[N@H+]1CCc2c(NCc3cn4cccnc4n3)ccc([N+](=O)[O-])c2C1 ZINC001161909837 1320672960 /nfs/dbraw/zinc/67/29/60/1320672960.db2.gz VGQRQLKNHLMVPT-UHFFFAOYSA-N 1 1 338.371 2.238 20 5 EEBDMO CCOc1nc(N2CCN(c3cccc(C)[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC001163665105 1321185350 /nfs/dbraw/zinc/18/53/50/1321185350.db2.gz FHXYOPHOEQVILR-UHFFFAOYSA-N 1 1 343.387 2.419 20 5 EEBDMO Cc1nc(Nc2ccc([N+](=O)[O-])nc2)cc(N2C[C@@H](C)O[C@H](C)C2)[nH+]1 ZINC001203566790 1321913467 /nfs/dbraw/zinc/91/34/67/1321913467.db2.gz PRJPCVPQLRNNJY-GHMZBOCLSA-N 1 1 344.375 2.445 20 5 EEBDMO Cc1nc(N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-] ZINC001334304824 1336236385 /nfs/dbraw/zinc/23/63/85/1336236385.db2.gz MUFLVZZBRMQXBE-FOLVSLTJSA-N 1 1 325.372 2.236 20 5 EEBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[NH+]2CCC3(CC2)OCCO3)c1 ZINC000848475778 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ZINC000361570475 285075833 /nfs/dbraw/zinc/07/58/33/285075833.db2.gz WOOAZYHFZQQOOY-NWDGAFQWSA-N 1 1 339.392 2.287 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(N3CC[N@H+]4CCCC[C@@H]4C3)n2)cc1 ZINC000359456334 285106883 /nfs/dbraw/zinc/10/68/83/285106883.db2.gz SXANEKJQOCFGFR-CQSZACIVSA-N 1 1 329.360 2.319 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOC2(CCC2)C1 ZINC000154162697 533139019 /nfs/dbraw/zinc/13/90/19/533139019.db2.gz HTOLQWSWLZSTKE-UHFFFAOYSA-N 1 1 349.387 2.187 20 5 EEBDMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000270484133 256140128 /nfs/dbraw/zinc/14/01/28/256140128.db2.gz IUASDGRARHRSCE-RDJZCZTQSA-N 1 1 346.431 2.406 20 5 EEBDMO CCOC(=O)c1ccnc(N[C@H]2C[N@H+](C3CC3)C[C@H]2C)c1[N+](=O)[O-] ZINC000268140439 256118408 /nfs/dbraw/zinc/11/84/08/256118408.db2.gz KEKSSDATBGCSBG-MFKMUULPSA-N 1 1 334.376 2.061 20 5 EEBDMO Cc1nnc([C@@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])s1 ZINC000273617776 256312451 /nfs/dbraw/zinc/31/24/51/256312451.db2.gz PUHCYWSXHLZSQI-SECBINFHSA-N 1 1 335.389 2.434 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@]2(CCOC2)C1 ZINC000153903486 140834504 /nfs/dbraw/zinc/83/45/04/140834504.db2.gz CDWXWLBLOIYIKM-QGZVFWFLSA-N 1 1 349.387 2.044 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+](C)CCN2CCCC2)cccc1[N+](=O)[O-] ZINC000089898745 292213852 /nfs/dbraw/zinc/21/38/52/292213852.db2.gz LIOIGGJDBNLGHT-UHFFFAOYSA-N 1 1 334.420 2.259 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+](C)CCN2CCCC2)cccc1[N+](=O)[O-] ZINC000089898745 292213853 /nfs/dbraw/zinc/21/38/53/292213853.db2.gz LIOIGGJDBNLGHT-UHFFFAOYSA-N 1 1 334.420 2.259 20 5 EEBDMO COc1ccc(CNC(=O)N[C@@H](C)C[N@@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000357663380 153273508 /nfs/dbraw/zinc/27/35/08/153273508.db2.gz KMLADAXEKXVRHL-LBPRGKRZSA-N 1 1 338.408 2.131 20 5 EEBDMO O=C(C[NH2+]Cc1ccccc1[N+](=O)[O-])N[C@H]1CCOc2ccccc21 ZINC000374327331 154053927 /nfs/dbraw/zinc/05/39/27/154053927.db2.gz GDKUDBHHEXCFPV-HNNXBMFYSA-N 1 1 341.367 2.324 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000069045616 159024673 /nfs/dbraw/zinc/02/46/73/159024673.db2.gz NBSWKRTYCZTGSV-AWEZNQCLSA-N 1 1 334.420 2.243 20 5 EEBDMO CNC(=O)[C@@H](C)C[N@@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000246234431 160269406 /nfs/dbraw/zinc/26/94/06/160269406.db2.gz QQIDIFDZFZOUME-WDEREUQCSA-N 1 1 347.375 2.020 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC000246562084 160285045 /nfs/dbraw/zinc/28/50/45/160285045.db2.gz HHZVHAQPZOCASK-XJKSGUPXSA-N 1 1 333.388 2.343 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC000246562084 160285047 /nfs/dbraw/zinc/28/50/47/160285047.db2.gz HHZVHAQPZOCASK-XJKSGUPXSA-N 1 1 333.388 2.343 20 5 EEBDMO C[N@@H+]1CCC[C@@H]2CN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)CC[C@H]21 ZINC000247012444 160305446 /nfs/dbraw/zinc/30/54/46/160305446.db2.gz QAITVPCUPNIGJA-RHSMWYFYSA-N 1 1 346.431 2.340 20 5 EEBDMO C[N@H+]1CCC[C@@H]2CN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)CC[C@H]21 ZINC000247012444 160305448 /nfs/dbraw/zinc/30/54/48/160305448.db2.gz QAITVPCUPNIGJA-RHSMWYFYSA-N 1 1 346.431 2.340 20 5 EEBDMO CSC[C@H]1CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000247297485 160318405 /nfs/dbraw/zinc/31/84/05/160318405.db2.gz UNFSNPKCXPHGKZ-ZIAGYGMSSA-N 1 1 326.418 2.162 20 5 EEBDMO C[C@H](c1ccccn1)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248472659 160348069 /nfs/dbraw/zinc/34/80/69/160348069.db2.gz WHGWUOFHXJKUIT-ZIAGYGMSSA-N 1 1 331.372 2.423 20 5 EEBDMO COc1ccc(CNC(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000339860007 160876886 /nfs/dbraw/zinc/87/68/86/160876886.db2.gz QYMAXUWFFUGDIB-ZIAGYGMSSA-N 1 1 348.403 2.029 20 5 EEBDMO CC[N@H+]1CCN(C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000341801703 161014573 /nfs/dbraw/zinc/01/45/73/161014573.db2.gz UNBYHJIWUBPRTN-AWEZNQCLSA-N 1 1 335.404 2.225 20 5 EEBDMO C[C@H]1[C@@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CCC[N@H+]1C ZINC000343446093 161136748 /nfs/dbraw/zinc/13/67/48/161136748.db2.gz LUXCDTFLHCPJHH-FZMZJTMJSA-N 1 1 332.404 2.382 20 5 EEBDMO CCCc1n[nH]c(C(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000344722178 161239571 /nfs/dbraw/zinc/23/95/71/161239571.db2.gz JEYADLYDFZOOAZ-LBPRGKRZSA-N 1 1 349.435 2.217 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[N@@H+](C3CCC3)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000344722178 161239572 /nfs/dbraw/zinc/23/95/72/161239572.db2.gz JEYADLYDFZOOAZ-LBPRGKRZSA-N 1 1 349.435 2.217 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000344722178 161239573 /nfs/dbraw/zinc/23/95/73/161239573.db2.gz JEYADLYDFZOOAZ-LBPRGKRZSA-N 1 1 349.435 2.217 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C[C@@H](O)C(F)F)cs2)c1 ZINC000344769885 161244494 /nfs/dbraw/zinc/24/44/94/161244494.db2.gz WDASLPHXSIPUKU-LLVKDONJSA-N 1 1 329.328 2.434 20 5 EEBDMO CCC[N@@H+]1CCC[C@@H]1CNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000352502043 162161176 /nfs/dbraw/zinc/16/11/76/162161176.db2.gz ZHUNVOMHOROKPF-LLVKDONJSA-N 1 1 347.462 2.117 20 5 EEBDMO CCC[N@H+]1CCC[C@@H]1CNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000352502043 162161177 /nfs/dbraw/zinc/16/11/77/162161177.db2.gz ZHUNVOMHOROKPF-LLVKDONJSA-N 1 1 347.462 2.117 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CNCc1ncc(C[NH+](C)C)s1 ZINC000352738116 162267357 /nfs/dbraw/zinc/26/73/57/162267357.db2.gz SBHRHRHVNKYSFQ-UHFFFAOYSA-N 1 1 336.417 2.411 20 5 EEBDMO COC(=O)COc1ccc(C[N@@H+]2CCSC[C@H]2C)cc1[N+](=O)[O-] ZINC000355738782 163286326 /nfs/dbraw/zinc/28/63/26/163286326.db2.gz ZLMPOAYEQPNVJJ-LLVKDONJSA-N 1 1 340.401 2.084 20 5 EEBDMO COC(=O)COc1ccc(C[N@H+]2CCSC[C@H]2C)cc1[N+](=O)[O-] ZINC000355738782 163286330 /nfs/dbraw/zinc/28/63/30/163286330.db2.gz ZLMPOAYEQPNVJJ-LLVKDONJSA-N 1 1 340.401 2.084 20 5 EEBDMO CCC[C@H]1CNCC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000359051456 164046960 /nfs/dbraw/zinc/04/69/60/164046960.db2.gz FCTZGUDKLYMYBH-AWEZNQCLSA-N 1 1 334.420 2.306 20 5 EEBDMO CCC[C@H]1CNCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000359051456 164046962 /nfs/dbraw/zinc/04/69/62/164046962.db2.gz FCTZGUDKLYMYBH-AWEZNQCLSA-N 1 1 334.420 2.306 20 5 EEBDMO CCC[N@@H+](CC)CCNS(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C ZINC000360452771 164313823 /nfs/dbraw/zinc/31/38/23/164313823.db2.gz XIITYYQWJUYCAI-UHFFFAOYSA-N 1 1 343.449 2.222 20 5 EEBDMO C[C@@H]1C[C@H](NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000360667399 164360851 /nfs/dbraw/zinc/36/08/51/164360851.db2.gz XCMPHAIJDZSNMN-NXEZZACHSA-N 1 1 347.824 2.009 20 5 EEBDMO O=C(C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)Nc1cccc(F)c1 ZINC000369693492 166314786 /nfs/dbraw/zinc/31/47/86/166314786.db2.gz SNVRCLZUFXSBSD-UHFFFAOYSA-N 1 1 347.350 2.206 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CCN(c3[nH]cc[nH+]3)CC2)cc1OC(F)F ZINC000278492619 269233423 /nfs/dbraw/zinc/23/34/23/269233423.db2.gz HOYXOJNAETWKKW-UHFFFAOYSA-N 1 1 339.302 2.246 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(C(=O)C(F)(F)c3ccc([N+](=O)[O-])cc3)[C@@H]2C1 ZINC000272600414 274176961 /nfs/dbraw/zinc/17/69/61/274176961.db2.gz YLTXODAJMGBIEP-SMDDNHRTSA-N 1 1 339.342 2.239 20 5 EEBDMO COc1ccc(NC(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000272795986 274182916 /nfs/dbraw/zinc/18/29/16/274182916.db2.gz GYNFRDBNVNSGMK-STQMWFEESA-N 1 1 334.376 2.352 20 5 EEBDMO C[C@@H]1[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)CC[N@H+]1Cc1ccccc1 ZINC000288276852 275041715 /nfs/dbraw/zinc/04/17/15/275041715.db2.gz QXDPEGVJQPSBNW-YPMHNXCESA-N 1 1 328.376 2.042 20 5 EEBDMO Cc1cnn([C@H]2CC[N@@H+]([C@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])C2)c1 ZINC000289756388 275145903 /nfs/dbraw/zinc/14/59/03/275145903.db2.gz FRHFTERESUPDJP-KGLIPLIRSA-N 1 1 343.387 2.374 20 5 EEBDMO Cc1cnn([C@H]2CC[N@H+]([C@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])C2)c1 ZINC000289756388 275145904 /nfs/dbraw/zinc/14/59/04/275145904.db2.gz FRHFTERESUPDJP-KGLIPLIRSA-N 1 1 343.387 2.374 20 5 EEBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000290563878 275218482 /nfs/dbraw/zinc/21/84/82/275218482.db2.gz KGYGDBRWDYEDRP-SNVBAGLBSA-N 1 1 326.372 2.166 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](n2cccn2)C1 ZINC000291706566 275332195 /nfs/dbraw/zinc/33/21/95/275332195.db2.gz IHRZFZNIBWICQI-DOMZBBRYSA-N 1 1 329.360 2.065 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](n2cccn2)C1 ZINC000291706566 275332197 /nfs/dbraw/zinc/33/21/97/275332197.db2.gz IHRZFZNIBWICQI-DOMZBBRYSA-N 1 1 329.360 2.065 20 5 EEBDMO C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000362843914 288084367 /nfs/dbraw/zinc/08/43/67/288084367.db2.gz SJPIIVWFBNCZCG-DIOULYMOSA-N 1 1 335.429 2.367 20 5 EEBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181317492 279282931 /nfs/dbraw/zinc/28/29/31/279282931.db2.gz GSYNTTVODYXZSW-CYBMUJFWSA-N 1 1 342.399 2.427 20 5 EEBDMO CN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C1CC[NH+](C)CC1 ZINC000294210478 293396015 /nfs/dbraw/zinc/39/60/15/293396015.db2.gz IRRHFUYBCJEFKC-UHFFFAOYSA-N 1 1 343.387 2.151 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1 ZINC000296938586 294107506 /nfs/dbraw/zinc/10/75/06/294107506.db2.gz IVYSEZLHDPAPIW-GOOCMWNKSA-N 1 1 347.415 2.414 20 5 EEBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000159859843 311347584 /nfs/dbraw/zinc/34/75/84/311347584.db2.gz KQOBHLSHKUVHIY-OCCSQVGLSA-N 1 1 325.434 2.363 20 5 EEBDMO C[C@H]1C[C@@H](CO)C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000421361020 314091625 /nfs/dbraw/zinc/09/16/25/314091625.db2.gz KBENYQKMMAYAAI-UONOGXRCSA-N 1 1 344.415 2.446 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCCC[N@H+]1CCC[C@@H]1CO ZINC000421781638 314163301 /nfs/dbraw/zinc/16/33/01/314163301.db2.gz AZMPGRRUBYYKLS-OAHLLOKOSA-N 1 1 349.431 2.178 20 5 EEBDMO CCC[C@@H]1C[NH2+]CCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000440864259 315155817 /nfs/dbraw/zinc/15/58/17/315155817.db2.gz WFAKVQNBLAZRRG-SNVBAGLBSA-N 1 1 347.824 2.011 20 5 EEBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1 ZINC000445173302 315349707 /nfs/dbraw/zinc/34/97/07/315349707.db2.gz NYRLXFOGLDQRNW-SCRDCRAPSA-N 1 1 348.403 2.173 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC000578375793 320310893 /nfs/dbraw/zinc/31/08/93/320310893.db2.gz HPKSWLQLDIGCDU-UONOGXRCSA-N 1 1 332.404 2.010 20 5 EEBDMO CO[C@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1(C)C ZINC000296079910 465074293 /nfs/dbraw/zinc/07/42/93/465074293.db2.gz PWPAZEJWGGHKNH-INIZCTEOSA-N 1 1 347.415 2.231 20 5 EEBDMO CO[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1(C)C ZINC000296079910 465074297 /nfs/dbraw/zinc/07/42/97/465074297.db2.gz PWPAZEJWGGHKNH-INIZCTEOSA-N 1 1 347.415 2.231 20 5 EEBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000341951595 465278321 /nfs/dbraw/zinc/27/83/21/465278321.db2.gz VORCAODOJPUNFH-LBPRGKRZSA-N 1 1 343.449 2.302 20 5 EEBDMO CN(CCCC[NH+](C)C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000590670995 468300068 /nfs/dbraw/zinc/30/00/68/468300068.db2.gz PPEOPBOKKWWERW-UHFFFAOYSA-N 1 1 345.403 2.399 20 5 EEBDMO O=C1NCCCC[C@@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113320107 462589319 /nfs/dbraw/zinc/58/93/19/462589319.db2.gz ISQMGZMCFDIQFD-AWEZNQCLSA-N 1 1 346.412 2.477 20 5 EEBDMO Cc1cc(NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)ncc1[N+](=O)[O-] ZINC000074739825 462629281 /nfs/dbraw/zinc/62/92/81/462629281.db2.gz MQCQLXIRYHLKJC-MRXNPFEDSA-N 1 1 342.399 2.129 20 5 EEBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C[C@H]1CCCOC1 ZINC000128587739 462655831 /nfs/dbraw/zinc/65/58/31/462655831.db2.gz CIEDDGRZQFRDOH-GFCCVEGCSA-N 1 1 339.367 2.421 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCOCC1(C)C ZINC000064247550 462690516 /nfs/dbraw/zinc/69/05/16/462690516.db2.gz MQYPSULQDNKHJL-UHFFFAOYSA-N 1 1 337.376 2.043 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOCC1(C)C ZINC000064247550 462690518 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20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+](C)[C@@H]2CC(C)(C)OC2=O)cccc1[N+](=O)[O-] ZINC000795717477 1215008988 /nfs/dbraw/zinc/00/89/88/1215008988.db2.gz MISGDQDVCYTUCM-CQSZACIVSA-N 1 1 349.387 2.258 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H]2CC(C)(C)OC2=O)cccc1[N+](=O)[O-] ZINC000795717477 1215008990 /nfs/dbraw/zinc/00/89/90/1215008990.db2.gz MISGDQDVCYTUCM-CQSZACIVSA-N 1 1 349.387 2.258 20 5 EEBDMO C[C@@H]1CN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C ZINC000815180350 1278067815 /nfs/dbraw/zinc/06/78/15/1278067815.db2.gz JAHVRLCHDKPYFC-PHIMTYICSA-N 1 1 340.811 2.211 20 5 EEBDMO COC[C@]1(C)CC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1 ZINC000853515999 1292406181 /nfs/dbraw/zinc/40/61/81/1292406181.db2.gz IAZVWCPLOBUYSK-MRXNPFEDSA-N 1 1 331.376 2.169 20 5 EEBDMO COC[C@]1(C)CC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1 ZINC000853515999 1292406185 /nfs/dbraw/zinc/40/61/85/1292406185.db2.gz IAZVWCPLOBUYSK-MRXNPFEDSA-N 1 1 331.376 2.169 20 5 EEBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000825550043 1292706658 /nfs/dbraw/zinc/70/66/58/1292706658.db2.gz XWVFPCXDTRLSNV-SJORKVTESA-N 1 1 349.431 2.399 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C1 ZINC000855289600 1293155713 /nfs/dbraw/zinc/15/57/13/1293155713.db2.gz SECXWIKNRWOUSZ-JTQLQIEISA-N 1 1 349.416 2.202 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+](C2CCCCC2)C1)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000855810628 1293335908 /nfs/dbraw/zinc/33/59/08/1293335908.db2.gz CWVWLPVRXZGTGX-PBHICJAKSA-N 1 1 347.415 2.151 20 5 EEBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@@H+](C)C1 ZINC000862789291 1295961864 /nfs/dbraw/zinc/96/18/64/1295961864.db2.gz KAWFOLFJCQODOY-CYBMUJFWSA-N 1 1 334.420 2.123 20 5 EEBDMO O=[N+]([O-])c1cncc(O[C@H]2COCC[N@@H+](Cc3ccccc3)C2)c1 ZINC001227990063 1302042681 /nfs/dbraw/zinc/04/26/81/1302042681.db2.gz FHRXXWMMBQRDIE-QGZVFWFLSA-N 1 1 329.356 2.270 20 5 EEBDMO O=c1nc2cc([N+](=O)[O-])ccc2c(OC2CC[NH+](C3CC3)CC2)[nH]1 ZINC001228241440 1302170639 /nfs/dbraw/zinc/17/06/39/1302170639.db2.gz BEWGFMIXVUTTDY-UHFFFAOYSA-N 1 1 330.344 2.249 20 5 EEBDMO Cc1cc(O)c([N+](=O)[O-])c(OC[C@@H]2CCC3(CC[NH+](C)CC3)O2)n1 ZINC001231260759 1303708907 /nfs/dbraw/zinc/70/89/07/1303708907.db2.gz WOOAEJCXSFVUDW-LBPRGKRZSA-N 1 1 337.376 2.026 20 5 EEBDMO CC(C)OCCC(=O)NCCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001234188575 1304788036 /nfs/dbraw/zinc/78/80/36/1304788036.db2.gz GMJARTCYIMFUQS-UHFFFAOYSA-N 1 1 337.420 2.348 20 5 EEBDMO Cc1cc(OCC(=O)NCCn2cc[nH+]c2C(C)C)ccc1[N+](=O)[O-] ZINC000797616591 1304792289 /nfs/dbraw/zinc/79/22/89/1304792289.db2.gz PEEPXUJMJKYEBT-UHFFFAOYSA-N 1 1 346.387 2.418 20 5 EEBDMO O=[N+]([O-])c1cc(F)c(N2CCC(NC[C@H]3CCC[NH2+]3)CC2)c(F)c1 ZINC001246187544 1310256776 /nfs/dbraw/zinc/25/67/76/1310256776.db2.gz PKTOSMQOXQHLDM-GFCCVEGCSA-N 1 1 340.374 2.183 20 5 EEBDMO CC(C)[N@H+]1CCO[C@H](COC(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)C1 ZINC001122827384 1310402057 /nfs/dbraw/zinc/40/20/57/1310402057.db2.gz LOTJKZFPIPQZNG-YESZJQIVSA-N 1 1 348.399 2.351 20 5 EEBDMO CC[C@@H](C)[N@@H+](CCO)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839603625 1315219042 /nfs/dbraw/zinc/21/90/42/1315219042.db2.gz GFKQDTULSYWFPJ-SNVBAGLBSA-N 1 1 329.784 2.280 20 5 EEBDMO COc1cc(Cc2noc([C@@H]([NH3+])CCSC)n2)ccc1[N+](=O)[O-] ZINC000843191320 1315863805 /nfs/dbraw/zinc/86/38/05/1315863805.db2.gz DGQVQHYCZQHBLT-JTQLQIEISA-N 1 1 338.389 2.330 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CCN(c3nccs3)CC1)C2 ZINC001254597244 1318138305 /nfs/dbraw/zinc/13/83/05/1318138305.db2.gz GNXDUMOMXYGETL-OAHLLOKOSA-N 1 1 330.413 2.341 20 5 EEBDMO CCOC(=O)[C@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CCS1 ZINC001254612654 1318145542 /nfs/dbraw/zinc/14/55/42/1318145542.db2.gz XMXIOKKDFXITTF-LSDHHAIUSA-N 1 1 336.413 2.043 20 5 EEBDMO CCC[N@@H+]1C[C@H]2CN(c3cnc4cc([N+](=O)[O-])ccc4n3)C[C@H]2C1 ZINC001157689168 1318797968 /nfs/dbraw/zinc/79/79/68/1318797968.db2.gz HEDQTQXSFMZEEE-BETUJISGSA-N 1 1 327.388 2.316 20 5 EEBDMO CCOC(=O)c1ccnc(N2CC[N@@H+](C)CC23CCCC3)c1[N+](=O)[O-] ZINC001158409923 1319225486 /nfs/dbraw/zinc/22/54/86/1319225486.db2.gz DRFGKZGOPRCHAP-UHFFFAOYSA-N 1 1 348.403 2.231 20 5 EEBDMO O=C(NCCC1=CC[N@@H+](CCc2ccccc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160090703 1320067962 /nfs/dbraw/zinc/06/79/62/1320067962.db2.gz NUUXPNPVJCXKDT-QZTJIDSGSA-N 1 1 343.427 2.033 20 5 EEBDMO O=C(NCCC1=CC[N@H+](CCc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160090703 1320067968 /nfs/dbraw/zinc/06/79/68/1320067968.db2.gz NUUXPNPVJCXKDT-QZTJIDSGSA-N 1 1 343.427 2.033 20 5 EEBDMO O=C(NCCC1=CC[N@@H+](CCc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160090703 1320067972 /nfs/dbraw/zinc/06/79/72/1320067972.db2.gz NUUXPNPVJCXKDT-QZTJIDSGSA-N 1 1 343.427 2.033 20 5 EEBDMO Cc1cc(C[NH2+]CC2(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1 ZINC001164494282 1321395814 /nfs/dbraw/zinc/39/58/14/1321395814.db2.gz CZRSOKKQCXRRCV-ZIAGYGMSSA-N 1 1 337.445 2.098 20 5 EEBDMO COc1ccc([C@@H]2CN(C(=O)c3ccccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001262636427 1322336236 /nfs/dbraw/zinc/33/62/36/1322336236.db2.gz RXVWWSMHPVGLSP-INIZCTEOSA-N 1 1 341.367 2.390 20 5 EEBDMO Cc1nn(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c2ncc([N+](=O)[O-])cc12 ZINC001319328696 1332685302 /nfs/dbraw/zinc/68/53/02/1332685302.db2.gz PRJXNXMNAHNIFU-SWLSCSKDSA-N 1 1 331.376 2.106 20 5 EEBDMO C[C@@]1(CO)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC001320089117 1332821182 /nfs/dbraw/zinc/82/11/82/1332821182.db2.gz WISUQQUMECGFPC-MRXNPFEDSA-N 1 1 339.367 2.157 20 5 EEBDMO CC[N@@H+](CCNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-])C1CC1 ZINC001334142884 1336211862 /nfs/dbraw/zinc/21/18/62/1336211862.db2.gz VIOFBKJZETXIGK-UHFFFAOYSA-N 1 1 330.388 2.343 20 5 EEBDMO COC(=O)CC[N@H+](CC[N+](=O)[O-])Cc1cccc(Br)c1 ZINC001334187621 1336218945 /nfs/dbraw/zinc/21/89/45/1336218945.db2.gz NODWZNDJWRXJML-UHFFFAOYSA-N 1 1 345.193 2.091 20 5 EEBDMO COC(=O)CC[N@@H+](CC[N+](=O)[O-])Cc1cccc(Br)c1 ZINC001334187621 1336218947 /nfs/dbraw/zinc/21/89/47/1336218947.db2.gz NODWZNDJWRXJML-UHFFFAOYSA-N 1 1 345.193 2.091 20 5 EEBDMO CC[N@@H+]1CCCC[C@H]1CNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001590732002 1349394733 /nfs/dbraw/zinc/39/47/33/1349394733.db2.gz HSJGNVUGYOWDBG-VIFPVBQESA-N 1 1 337.409 2.123 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001590732002 1349394737 /nfs/dbraw/zinc/39/47/37/1349394737.db2.gz HSJGNVUGYOWDBG-VIFPVBQESA-N 1 1 337.409 2.123 20 5 EEBDMO Cc1[nH+]ccn1CCCC[NH2+][C@](C)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001600756912 1350129793 /nfs/dbraw/zinc/12/97/93/1350129793.db2.gz OBSBVSVGJRSOOK-KRWDZBQOSA-N 1 1 346.387 2.470 20 5 EEBDMO C[N@H+]1CCO[C@@H]2CN(c3cc4ccc(Cl)nc4cc3[N+](=O)[O-])C[C@H]21 ZINC001164667735 719482991 /nfs/dbraw/zinc/48/29/91/719482991.db2.gz MKWATNBQEHMQKN-HUUCEWRRSA-N 1 1 348.790 2.316 20 5 EEBDMO CCN(CCNc1ccc([N+](=O)[O-])cc1F)C(=O)Cn1c[nH+]cc1C ZINC001106892538 769400241 /nfs/dbraw/zinc/40/02/41/769400241.db2.gz RTRUVXZDFKZDMC-UHFFFAOYSA-N 1 1 349.366 2.199 20 5 EEBDMO CCOC(=O)CC[C@H]1CCC[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1 ZINC000154842718 769451751 /nfs/dbraw/zinc/45/17/51/769451751.db2.gz YHZKSKDAANSEOO-CQSZACIVSA-N 1 1 338.408 2.421 20 5 EEBDMO CCOC(=O)CC[C@H]1CCC[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1 ZINC000154842718 769451761 /nfs/dbraw/zinc/45/17/61/769451761.db2.gz YHZKSKDAANSEOO-CQSZACIVSA-N 1 1 338.408 2.421 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])cc(NCCC[N@H+]2CCCC[C@@H]2C)n1 ZINC001167752676 769542125 /nfs/dbraw/zinc/54/21/25/769542125.db2.gz WTBAUTLPPCCTEM-LBPRGKRZSA-N 1 1 336.392 2.453 20 5 EEBDMO Cc1cc(C(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c(N)c([N+](=O)[O-])c1 ZINC000068516048 774620137 /nfs/dbraw/zinc/62/01/37/774620137.db2.gz QMZXLJVZPUJLBF-WCQYABFASA-N 1 1 334.420 2.336 20 5 EEBDMO C[C@]12CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CC1CCCC1)C2 ZINC000982278978 779503503 /nfs/dbraw/zinc/50/35/03/779503503.db2.gz VJXYBPXFLPPJOC-AHCXZYCDSA-N 1 1 335.448 2.012 20 5 EEBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@H+](CC1CCCC1)C2 ZINC000982278978 779503507 /nfs/dbraw/zinc/50/35/07/779503507.db2.gz VJXYBPXFLPPJOC-AHCXZYCDSA-N 1 1 335.448 2.012 20 5 EEBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CC1CCCC1)C2 ZINC000982278978 779503514 /nfs/dbraw/zinc/50/35/14/779503514.db2.gz VJXYBPXFLPPJOC-AHCXZYCDSA-N 1 1 335.448 2.012 20 5 EEBDMO COc1cc([N+](=O)[O-])cnc1N1CC[N@@H+](C)[C@H](Cc2ccccc2)C1 ZINC000893745753 780149169 /nfs/dbraw/zinc/14/91/69/780149169.db2.gz YUWDLLZBLYWVMA-MRXNPFEDSA-N 1 1 342.399 2.362 20 5 EEBDMO Cc1cc(C[NH+]2CC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)cs1 ZINC001035704234 784985090 /nfs/dbraw/zinc/98/50/90/784985090.db2.gz HDPKKIOQHUQGNG-HUUCEWRRSA-N 1 1 349.456 2.146 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)[C@H](C)C1 ZINC000910287570 786619850 /nfs/dbraw/zinc/61/98/50/786619850.db2.gz LHVARBZRPZBQAV-GFCCVEGCSA-N 1 1 339.367 2.055 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)[C@@H](C)C1 ZINC000910291340 786651431 /nfs/dbraw/zinc/65/14/31/786651431.db2.gz CWFRZJUKUKAGCT-ZDUSSCGKSA-N 1 1 334.420 2.217 20 5 EEBDMO C[C@H](CNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1 ZINC000824003032 787996822 /nfs/dbraw/zinc/99/68/22/787996822.db2.gz MFAZGKXYCCRVRR-NWDGAFQWSA-N 1 1 335.408 2.419 20 5 EEBDMO CC(C)c1[nH+]ccn1CC(=O)NCCNc1cccc(F)c1[N+](=O)[O-] ZINC001094157942 795971582 /nfs/dbraw/zinc/97/15/82/795971582.db2.gz SDMHXTJWHRUCED-UHFFFAOYSA-N 1 1 349.366 2.282 20 5 EEBDMO [NH3+]Cc1nccnc1Nc1nc2cc([N+](=O)[O-])ccc2nc1Cl ZINC001171445187 796245308 /nfs/dbraw/zinc/24/53/08/796245308.db2.gz XFQZIZVEUQQIAG-UHFFFAOYSA-N 1 1 331.723 2.184 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H](C)[C@@H](O)C2)c1F ZINC001173180145 797278525 /nfs/dbraw/zinc/27/85/25/797278525.db2.gz IRWVCXSJAAMSOI-SUNKGSAMSA-N 1 1 326.368 2.376 20 5 EEBDMO CC(C)C[C@H]([NH3+])c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000843237661 800251184 /nfs/dbraw/zinc/25/11/84/800251184.db2.gz TUGCOAOMJVUNAX-NSHDSACASA-N 1 1 343.347 2.271 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CC[C@H](F)[C@](O)(C(F)(F)F)CC2)C1 ZINC001169012882 803571293 /nfs/dbraw/zinc/57/12/93/803571293.db2.gz SKAHKVOUVDSLNC-RHYQMDGZSA-N 1 1 328.306 2.159 20 5 EEBDMO O=C(NC1CCC1)[C@H]1C[C@H]2C[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@H]2C1 ZINC001169030250 803576929 /nfs/dbraw/zinc/57/69/29/803576929.db2.gz XHYLNPMNTJIXKJ-WVCIDPQESA-N 1 1 335.448 2.059 20 5 EEBDMO O=C1NCC[C@]12C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@H]2c1ccccc1 ZINC001169026763 803592548 /nfs/dbraw/zinc/59/25/48/803592548.db2.gz NVPCAAMZRGGINN-LKCYJCQHSA-N 1 1 343.427 2.038 20 5 EEBDMO CCOC(=O)C1=C(Nc2nc3c(cc2[N+](=O)[O-])CCCC3)CC[NH2+]C1 ZINC001170514021 812026916 /nfs/dbraw/zinc/02/69/16/812026916.db2.gz NGGRYIGKTBRDFH-UHFFFAOYSA-N 1 1 346.387 2.091 20 5 EEBDMO CN(C(=O)C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000174248358 231159713 /nfs/dbraw/zinc/15/97/13/231159713.db2.gz ZNQPHMFNWQGJGW-UHFFFAOYSA-N 1 1 333.388 2.059 20 5 EEBDMO CCc1n[nH]c(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000171911401 529467677 /nfs/dbraw/zinc/46/76/77/529467677.db2.gz OWBWYGMTEOFYRB-LBPRGKRZSA-N 1 1 347.375 2.040 20 5 EEBDMO C[N@@H+](CCCNC(=O)c1cccc([N+](=O)[O-])c1N)Cc1ccccc1 ZINC000178151183 529891648 /nfs/dbraw/zinc/89/16/48/529891648.db2.gz XFHBMEHBTJMAON-UHFFFAOYSA-N 1 1 342.399 2.429 20 5 EEBDMO C[NH2+]Cc1noc(-c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])n1 ZINC000414503986 530011493 /nfs/dbraw/zinc/01/14/93/530011493.db2.gz RUERQCVSIJIQTI-UHFFFAOYSA-N 1 1 332.238 2.305 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000072858307 216319117 /nfs/dbraw/zinc/31/91/17/216319117.db2.gz JCPAYZHHAICDFF-KBPBESRZSA-N 1 1 334.420 2.195 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](NCCC[NH+]1CCC(O)CC1)CCC2 ZINC000192722237 239852803 /nfs/dbraw/zinc/85/28/03/239852803.db2.gz BVRLAFPXPVGUDE-SFHVURJKSA-N 1 1 333.432 2.409 20 5 EEBDMO O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](C[C@H]2CCC=CO2)CC1 ZINC000193994550 240394064 /nfs/dbraw/zinc/39/40/64/240394064.db2.gz YAAFTWDDZJVZFU-MRXNPFEDSA-N 1 1 331.372 2.045 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)CC[N@H+]1C ZINC000445896404 242141390 /nfs/dbraw/zinc/14/13/90/242141390.db2.gz HZUSSOOEKUTQEK-WFASDCNBSA-N 1 1 332.404 2.145 20 5 EEBDMO C[S@](=O)c1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000446850018 242225701 /nfs/dbraw/zinc/22/57/01/242225701.db2.gz UDDDWKZHGLRRRZ-DEOSSOPVSA-N 1 1 344.396 2.498 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451418790 243107252 /nfs/dbraw/zinc/10/72/52/243107252.db2.gz NBIGSGRACXRZHK-UAGQMJEPSA-N 1 1 347.415 2.467 20 5 EEBDMO C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H](CO)CC(C)(C)C ZINC000451772515 243254020 /nfs/dbraw/zinc/25/40/20/243254020.db2.gz ASZFRKJVZJQUHK-GJZGRUSLSA-N 1 1 340.420 2.063 20 5 EEBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCOC3(CCOCC3)C2)cc1 ZINC000135634721 223596818 /nfs/dbraw/zinc/59/68/18/223596818.db2.gz RFNZPKSYRODEFA-UHFFFAOYSA-N 1 1 336.388 2.245 20 5 EEBDMO CC[C@@H]1C(=O)N(CC)CC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000495231828 247094577 /nfs/dbraw/zinc/09/45/77/247094577.db2.gz WFLGJHLHFHKSCA-MRXNPFEDSA-N 1 1 335.404 2.306 20 5 EEBDMO CC[C@@H]1C(=O)N(CC)CC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000495231828 247094581 /nfs/dbraw/zinc/09/45/81/247094581.db2.gz WFLGJHLHFHKSCA-MRXNPFEDSA-N 1 1 335.404 2.306 20 5 EEBDMO CC[C@H](O)[C@H]1CCCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000265282039 247369336 /nfs/dbraw/zinc/36/93/36/247369336.db2.gz ZLFUEVWPONMXFD-WBVHZDCISA-N 1 1 347.415 2.109 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@@H]1C ZINC000266316889 248243531 /nfs/dbraw/zinc/24/35/31/248243531.db2.gz FBKXPIVTCCPCEP-STQMWFEESA-N 1 1 330.388 2.034 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@@H]2[C@H](O)C(F)(F)F)c1 ZINC000154184851 224215649 /nfs/dbraw/zinc/21/56/49/224215649.db2.gz JDZAIBLXOMWLRR-AGIUHOORSA-N 1 1 334.294 2.016 20 5 EEBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H]2[C@H](O)C(F)(F)F)c1 ZINC000154184851 224215651 /nfs/dbraw/zinc/21/56/51/224215651.db2.gz JDZAIBLXOMWLRR-AGIUHOORSA-N 1 1 334.294 2.016 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1[C@@H](C)CCC[C@H]1CO ZINC000270452449 256136872 /nfs/dbraw/zinc/13/68/72/256136872.db2.gz LEWFAHVBHJTDCS-ZFWWWQNUSA-N 1 1 335.404 2.467 20 5 EEBDMO CC[C@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1O ZINC000270999909 256197191 /nfs/dbraw/zinc/19/71/91/256197191.db2.gz YTNATIYQGWSCQK-SWLSCSKDSA-N 1 1 331.372 2.495 20 5 EEBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC[NH+]1CCSCC1 ZINC000271317953 256232219 /nfs/dbraw/zinc/23/22/19/256232219.db2.gz UDEOEOHLNIAATE-UHFFFAOYSA-N 1 1 337.445 2.299 20 5 EEBDMO C[N@@H+]1CC=C(CNc2ncc([N+](=O)[O-])cc2Br)CC1 ZINC000271753463 256240513 /nfs/dbraw/zinc/24/05/13/256240513.db2.gz CHFIXTCBQHUHBG-UHFFFAOYSA-N 1 1 327.182 2.426 20 5 EEBDMO C[N@H+](CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000053691469 292138029 /nfs/dbraw/zinc/13/80/29/292138029.db2.gz BVKBGESPFBVOCF-UHFFFAOYSA-N 1 1 349.412 2.005 20 5 EEBDMO C[N@@H+](CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000053691469 292138031 /nfs/dbraw/zinc/13/80/31/292138031.db2.gz BVKBGESPFBVOCF-UHFFFAOYSA-N 1 1 349.412 2.005 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCOC[C@H]1C1CC1 ZINC000090007641 292216491 /nfs/dbraw/zinc/21/64/91/292216491.db2.gz QQDMSYGXQDCZFE-HNNXBMFYSA-N 1 1 347.371 2.004 20 5 EEBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCOC[C@H]1C1CC1 ZINC000090007641 292216493 /nfs/dbraw/zinc/21/64/93/292216493.db2.gz QQDMSYGXQDCZFE-HNNXBMFYSA-N 1 1 347.371 2.004 20 5 EEBDMO Cc1[nH+]ccn1CCCCNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173757350 152193129 /nfs/dbraw/zinc/19/31/29/152193129.db2.gz ZAAMMJCLPDFGGN-UHFFFAOYSA-N 1 1 345.403 2.133 20 5 EEBDMO CCC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C)CC[N@@H+]1CCOC ZINC000128554130 292344058 /nfs/dbraw/zinc/34/40/58/292344058.db2.gz HPCIPISOHWVFOM-MRXNPFEDSA-N 1 1 349.431 2.476 20 5 EEBDMO CCC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C)CC[N@H+]1CCOC ZINC000128554130 292344059 /nfs/dbraw/zinc/34/40/59/292344059.db2.gz HPCIPISOHWVFOM-MRXNPFEDSA-N 1 1 349.431 2.476 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CCc1ccccn1 ZINC000129908400 292365168 /nfs/dbraw/zinc/36/51/68/292365168.db2.gz HVLAFRAGYFEREH-ZDUSSCGKSA-N 1 1 328.372 2.491 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCc1ccccn1 ZINC000129908400 292365169 /nfs/dbraw/zinc/36/51/69/292365169.db2.gz HVLAFRAGYFEREH-ZDUSSCGKSA-N 1 1 328.372 2.491 20 5 EEBDMO CCOC[C@@H]1CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000072977126 159047719 /nfs/dbraw/zinc/04/77/19/159047719.db2.gz HVUPDTIEHXZOCR-CQSZACIVSA-N 1 1 335.404 2.306 20 5 EEBDMO CCOC[C@@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000072977126 159047720 /nfs/dbraw/zinc/04/77/20/159047720.db2.gz HVUPDTIEHXZOCR-CQSZACIVSA-N 1 1 335.404 2.306 20 5 EEBDMO O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000081290853 159150914 /nfs/dbraw/zinc/15/09/14/159150914.db2.gz WPIRUCXSOHPBEA-OAHLLOKOSA-N 1 1 346.431 2.387 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118842603 159368390 /nfs/dbraw/zinc/36/83/90/159368390.db2.gz SVSUTVUQFMGGDY-ZIAGYGMSSA-N 1 1 334.420 2.195 20 5 EEBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(CCn2cc([N+](=O)[O-])cn2)C1 ZINC000245411737 160233334 /nfs/dbraw/zinc/23/33/34/160233334.db2.gz YFKFNUYMWVZWCP-HOTGVXAUSA-N 1 1 335.452 2.378 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2[C@H](C)CCC[C@H]2CO)cccc1[N+](=O)[O-] ZINC000245711791 160249894 /nfs/dbraw/zinc/24/98/94/160249894.db2.gz ZOGKDFBHFUOBDA-OCCSQVGLSA-N 1 1 335.404 2.467 20 5 EEBDMO C[C@@H](c1ccccn1)[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000245738420 160250449 /nfs/dbraw/zinc/25/04/49/160250449.db2.gz VDXXWTIJQRLGJR-DZGCQCFKSA-N 1 1 331.372 2.423 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]2OCCC[C@H]2C1 ZINC000246442557 160278736 /nfs/dbraw/zinc/27/87/36/160278736.db2.gz BLLQKWVXHCBWGO-WWGRRREGSA-N 1 1 333.388 2.423 20 5 EEBDMO CSCC[C@H](C)[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000247246315 160317441 /nfs/dbraw/zinc/31/74/41/160317441.db2.gz ZQJWAORQBLOEBQ-GXTWGEPZSA-N 1 1 328.434 2.408 20 5 EEBDMO COC[C@@H]1CCCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000342705231 161084428 /nfs/dbraw/zinc/08/44/28/161084428.db2.gz TVTWSIKGTULXJN-PBHICJAKSA-N 1 1 347.415 2.449 20 5 EEBDMO CCC[C@]1(CO)CC[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000344252572 161211497 /nfs/dbraw/zinc/21/14/97/161211497.db2.gz HZNBQVOTRGCTJD-KRWDZBQOSA-N 1 1 335.404 2.326 20 5 EEBDMO CCC[C@]1(CO)CC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000344252572 161211498 /nfs/dbraw/zinc/21/14/98/161211498.db2.gz HZNBQVOTRGCTJD-KRWDZBQOSA-N 1 1 335.404 2.326 20 5 EEBDMO C[NH+](C)Cc1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)no1 ZINC000344999584 161262675 /nfs/dbraw/zinc/26/26/75/161262675.db2.gz HXTSIWKWDMVFGX-UHFFFAOYSA-N 1 1 338.751 2.228 20 5 EEBDMO O=C(CC[N@H+]1CC[C@H](COC(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000353019333 162393916 /nfs/dbraw/zinc/39/39/16/162393916.db2.gz GGWQKHXEQNOASV-NSHDSACASA-N 1 1 343.330 2.485 20 5 EEBDMO O=C([C@@H]1CCCc2[nH+]ccn21)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000355053721 163064207 /nfs/dbraw/zinc/06/42/07/163064207.db2.gz GHGCUHCOQNTTNO-HNNXBMFYSA-N 1 1 326.356 2.254 20 5 EEBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000359778862 164169803 /nfs/dbraw/zinc/16/98/03/164169803.db2.gz RTKIYQWVXKCRDH-NSHDSACASA-N 1 1 333.392 2.321 20 5 EEBDMO CCC[N@H+](CC)C[C@H](C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000359778862 164169804 /nfs/dbraw/zinc/16/98/04/164169804.db2.gz RTKIYQWVXKCRDH-NSHDSACASA-N 1 1 333.392 2.321 20 5 EEBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000359778862 164169806 /nfs/dbraw/zinc/16/98/06/164169806.db2.gz RTKIYQWVXKCRDH-NSHDSACASA-N 1 1 333.392 2.321 20 5 EEBDMO C[N@H+]1CCCC12CCN(C(=O)COc1ccccc1[N+](=O)[O-])CC2 ZINC000368708898 166113221 /nfs/dbraw/zinc/11/32/21/166113221.db2.gz YIOHNWDMYAENLD-UHFFFAOYSA-N 1 1 333.388 2.060 20 5 EEBDMO Cc1cc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000159799189 225280664 /nfs/dbraw/zinc/28/06/64/225280664.db2.gz NIHZXFNYIOZJGS-UHFFFAOYSA-N 1 1 349.431 2.334 20 5 EEBDMO CN(CCCN1CC[NH+](C)CC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000122687823 222137610 /nfs/dbraw/zinc/13/76/10/222137610.db2.gz WSVGLLYKGZUYAY-UHFFFAOYSA-N 1 1 340.855 2.318 20 5 EEBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000124218904 222393505 /nfs/dbraw/zinc/39/35/05/222393505.db2.gz ICEGBMGCFXCSAU-CYBMUJFWSA-N 1 1 334.420 2.275 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000277367527 269151134 /nfs/dbraw/zinc/15/11/34/269151134.db2.gz HKANTKYRFRLRST-KRWDZBQOSA-N 1 1 346.431 2.453 20 5 EEBDMO C[N@H+]1CC[C@]2(CCN(c3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)C2)C1 ZINC000292150480 275384814 /nfs/dbraw/zinc/38/48/14/275384814.db2.gz CFYIACCFYZSVCP-KRWDZBQOSA-N 1 1 330.388 2.012 20 5 EEBDMO COc1cccc([C@H](C)[NH+]2CCN(c3c([N+](=O)[O-])ncn3C)CC2)c1 ZINC000264256254 278021311 /nfs/dbraw/zinc/02/13/11/278021311.db2.gz ZEUZXNSIZFUWBI-ZDUSSCGKSA-N 1 1 345.403 2.220 20 5 EEBDMO CC(C)[C@H]1C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CCCO1 ZINC000293329780 293182655 /nfs/dbraw/zinc/18/26/55/293182655.db2.gz XZICGVPKRXLTSW-QGZVFWFLSA-N 1 1 347.415 2.231 20 5 EEBDMO CC(C)[C@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CCCO1 ZINC000293329780 293182656 /nfs/dbraw/zinc/18/26/56/293182656.db2.gz XZICGVPKRXLTSW-QGZVFWFLSA-N 1 1 347.415 2.231 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C[C@H](C)[N@@H+]1C ZINC000294100392 293370375 /nfs/dbraw/zinc/37/03/75/293370375.db2.gz YFAIBULXILRCOC-PHIMTYICSA-N 1 1 344.371 2.013 20 5 EEBDMO COc1cc(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc([N+](=O)[O-])c1C ZINC000296841430 294080841 /nfs/dbraw/zinc/08/08/41/294080841.db2.gz DJZQUOGKCFCQNO-AGUYFDCRSA-N 1 1 333.388 2.267 20 5 EEBDMO C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000296951708 294110642 /nfs/dbraw/zinc/11/06/42/294110642.db2.gz XWYICTBSFWSIQR-DTDBQYNISA-N 1 1 344.415 2.419 20 5 EEBDMO COc1cccc(C(=O)N2C[C@H]3CCCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-] ZINC000332523168 312019544 /nfs/dbraw/zinc/01/95/44/312019544.db2.gz ATZYVCJMPXTYAN-QWHCGFSZSA-N 1 1 333.388 2.302 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCCC[N@H+](C)C1CC1 ZINC000416500204 313239083 /nfs/dbraw/zinc/23/90/83/313239083.db2.gz GBEXCVLAJXUMAV-UHFFFAOYSA-N 1 1 341.433 2.056 20 5 EEBDMO CC[C@H]1C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1 ZINC000439482243 315081376 /nfs/dbraw/zinc/08/13/76/315081376.db2.gz SDFVXRYWLIDHKJ-HOTGVXAUSA-N 1 1 333.388 2.201 20 5 EEBDMO CC[C@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1 ZINC000439482243 315081380 /nfs/dbraw/zinc/08/13/80/315081380.db2.gz SDFVXRYWLIDHKJ-HOTGVXAUSA-N 1 1 333.388 2.201 20 5 EEBDMO CCC[C@H]1C[NH2+]CCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000440864256 315155652 /nfs/dbraw/zinc/15/56/52/315155652.db2.gz WFAKVQNBLAZRRG-JTQLQIEISA-N 1 1 347.824 2.011 20 5 EEBDMO C[C@H](CCO)CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000449360578 315437796 /nfs/dbraw/zinc/43/77/96/315437796.db2.gz VANYKJUXVFMGAP-XJKSGUPXSA-N 1 1 332.404 2.416 20 5 EEBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000496715121 316236113 /nfs/dbraw/zinc/23/61/13/316236113.db2.gz WAEWGHQNWXHLAB-GFCCVEGCSA-N 1 1 346.387 2.448 20 5 EEBDMO CNc1ccc(C(=O)NCc2c[nH+]c3n2CCCC3)cc1[N+](=O)[O-] ZINC000551378992 318462781 /nfs/dbraw/zinc/46/27/81/318462781.db2.gz KLCBFHPAMYOEBQ-UHFFFAOYSA-N 1 1 329.360 2.099 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+](C(C)C)C2)c1 ZINC000565670254 319203257 /nfs/dbraw/zinc/20/32/57/319203257.db2.gz HWZZCZQQLFTZSJ-CYBMUJFWSA-N 1 1 335.404 2.454 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+](C)C[C@@H](O)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000181312566 323343692 /nfs/dbraw/zinc/34/36/92/323343692.db2.gz CYOFFXJSWGURND-GFCCVEGCSA-N 1 1 349.309 2.087 20 5 EEBDMO CNc1ccc(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000581684660 324302910 /nfs/dbraw/zinc/30/29/10/324302910.db2.gz XGBTTYXPOYHYQK-DVOMOZLQSA-N 1 1 346.431 2.439 20 5 EEBDMO Cc1c(CNC(=O)NCC[N@@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000358549646 465187336 /nfs/dbraw/zinc/18/73/36/465187336.db2.gz ZHIHERJCWMQRRU-ZDUSSCGKSA-N 1 1 334.420 2.434 20 5 EEBDMO CC[N@@H+](C)CCNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000112926545 462555845 /nfs/dbraw/zinc/55/58/45/462555845.db2.gz NWJIDDVTDJSKQS-SNVBAGLBSA-N 1 1 329.784 2.083 20 5 EEBDMO COC(=O)CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C(C)C ZINC000114476078 462652469 /nfs/dbraw/zinc/65/24/69/462652469.db2.gz AQVNRMOACJUWEA-UHFFFAOYSA-N 1 1 337.376 2.115 20 5 EEBDMO COC(=O)CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C(C)C ZINC000114476078 462652475 /nfs/dbraw/zinc/65/24/75/462652475.db2.gz AQVNRMOACJUWEA-UHFFFAOYSA-N 1 1 337.376 2.115 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@]4(CCOC4)C3)o2)cc1 ZINC000153908722 462708013 /nfs/dbraw/zinc/70/80/13/462708013.db2.gz BSXGKNMAOOYEPM-MRXNPFEDSA-N 1 1 330.344 2.257 20 5 EEBDMO COCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000064995123 462731968 /nfs/dbraw/zinc/73/19/68/462731968.db2.gz ASHMTOFZPSHGCV-CZUORRHYSA-N 1 1 349.431 2.266 20 5 EEBDMO COCC[NH+]1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000089884342 462733969 /nfs/dbraw/zinc/73/39/69/462733969.db2.gz JOFJCNATZAMYRZ-UHFFFAOYSA-N 1 1 346.387 2.014 20 5 EEBDMO CNC(=O)[C@H](C)C[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089907918 462739766 /nfs/dbraw/zinc/73/97/66/462739766.db2.gz JVOVAMPRNNHHTE-LLVKDONJSA-N 1 1 332.360 2.064 20 5 EEBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCCN(CC(F)F)CC2)c1 ZINC000091084317 462833582 /nfs/dbraw/zinc/83/35/82/462833582.db2.gz ZIKHHINEPJHYTN-UHFFFAOYSA-N 1 1 329.347 2.246 20 5 EEBDMO CC1CC[NH+](CCNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 ZINC000052160102 463063825 /nfs/dbraw/zinc/06/38/25/463063825.db2.gz IDBFIHUHVLEXQD-UHFFFAOYSA-N 1 1 341.433 2.142 20 5 EEBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NCCc1cn2c([nH+]1)CCCC2 ZINC000134889412 463092087 /nfs/dbraw/zinc/09/20/87/463092087.db2.gz CTVLYJHTTPRFRL-UHFFFAOYSA-N 1 1 343.387 2.142 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@H](O)C[N@H+]2CCc3ccccc3C2)cc1 ZINC000078494583 463122074 /nfs/dbraw/zinc/12/20/74/463122074.db2.gz JYFKXRKOGNTMLD-SFHVURJKSA-N 1 1 327.384 2.426 20 5 EEBDMO CCCC[NH+]1CCC(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000068442674 463138058 /nfs/dbraw/zinc/13/80/58/463138058.db2.gz CIPDAZUGJBRBGR-UHFFFAOYSA-N 1 1 345.403 2.465 20 5 EEBDMO C[C@@H]1OCC[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@H]1C ZINC000139131973 463318828 /nfs/dbraw/zinc/31/88/28/463318828.db2.gz FETOONMJVQPQHY-RYUDHWBXSA-N 1 1 335.360 2.002 20 5 EEBDMO C[C@@H]1OCC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@H]1C ZINC000139131973 463318834 /nfs/dbraw/zinc/31/88/34/463318834.db2.gz FETOONMJVQPQHY-RYUDHWBXSA-N 1 1 335.360 2.002 20 5 EEBDMO C[C@@H]1CC[C@H](C)C[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000072897317 463560914 /nfs/dbraw/zinc/56/09/14/463560914.db2.gz SJURGURKOSAGGP-WDEREUQCSA-N 1 1 335.360 2.382 20 5 EEBDMO C[C@@H]1CC[C@H](C)C[N@@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000072897317 463560917 /nfs/dbraw/zinc/56/09/17/463560917.db2.gz SJURGURKOSAGGP-WDEREUQCSA-N 1 1 335.360 2.382 20 5 EEBDMO C[N@H+]1CCC[C@H](CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000108346280 463599366 /nfs/dbraw/zinc/59/93/66/463599366.db2.gz IWXXOUHUTUZSLB-CQSZACIVSA-N 1 1 334.420 2.245 20 5 EEBDMO Cc1c(CC(=O)N2CC[NH+](CCOC(C)C)CC2)cccc1[N+](=O)[O-] ZINC000127017458 463677296 /nfs/dbraw/zinc/67/72/96/463677296.db2.gz XQCVYRNRBYDOBO-UHFFFAOYSA-N 1 1 349.431 2.015 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@@H]1C ZINC000112080310 463690276 /nfs/dbraw/zinc/69/02/76/463690276.db2.gz VXSKOHCKWFVCQT-QWHCGFSZSA-N 1 1 330.388 2.034 20 5 EEBDMO Nc1ccc(NCc2ccccc2C[N@H+]2CC[C@@H](O)C2)c([N+](=O)[O-])c1 ZINC000286872577 463729552 /nfs/dbraw/zinc/72/95/52/463729552.db2.gz NOXAKXUKYXQVMB-MRXNPFEDSA-N 1 1 342.399 2.356 20 5 EEBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@H]1c1cccc(F)c1 ZINC000261693846 463830128 /nfs/dbraw/zinc/83/01/28/463830128.db2.gz CNLPKDFSPNVYON-KRWDZBQOSA-N 1 1 343.358 2.450 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(C(=O)NCCc3ccccc3[N+](=O)[O-])CC[C@@H]21 ZINC000269002553 463842800 /nfs/dbraw/zinc/84/28/00/463842800.db2.gz ZPAVOBKIDDGHJB-HOTGVXAUSA-N 1 1 346.431 2.263 20 5 EEBDMO Cn1ccnc1[C@H](O)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000283319771 463843130 /nfs/dbraw/zinc/84/31/30/463843130.db2.gz ZOTRAWPMZNDJJJ-MRXNPFEDSA-N 1 1 348.378 2.413 20 5 EEBDMO C[C@H](CN1CCOCC1)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000278728159 463978127 /nfs/dbraw/zinc/97/81/27/463978127.db2.gz ANRFVXBMXIJPGD-OAHLLOKOSA-N 1 1 337.420 2.016 20 5 EEBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCN(C)[C@@H](c2nccn2C)C1 ZINC000279253581 464080429 /nfs/dbraw/zinc/08/04/29/464080429.db2.gz AHUJWBDNCDECPA-XJKSGUPXSA-N 1 1 329.404 2.378 20 5 EEBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCN(C)[C@@H](c2nccn2C)C1 ZINC000279253581 464080436 /nfs/dbraw/zinc/08/04/36/464080436.db2.gz AHUJWBDNCDECPA-XJKSGUPXSA-N 1 1 329.404 2.378 20 5 EEBDMO CC(C)C(=O)NC[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000263700485 464158765 /nfs/dbraw/zinc/15/87/65/464158765.db2.gz IMJXICNVWVMMFE-OAHLLOKOSA-N 1 1 349.431 2.458 20 5 EEBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)Cn3cc([N+](=O)[O-])cn3)c2C1 ZINC000179769517 464184903 /nfs/dbraw/zinc/18/49/03/464184903.db2.gz DCWOVESXIDKCOS-UHFFFAOYSA-N 1 1 343.387 2.402 20 5 EEBDMO O=C(Cc1cccc([N+](=O)[O-])c1)NCC[N@@H+]1CCc2sccc2C1 ZINC000173210508 464211189 /nfs/dbraw/zinc/21/11/89/464211189.db2.gz BQQRDXGWOIATBB-UHFFFAOYSA-N 1 1 345.424 2.373 20 5 EEBDMO O=C(Cc1cccc([N+](=O)[O-])c1)NCC[N@H+]1CCc2sccc2C1 ZINC000173210508 464211194 /nfs/dbraw/zinc/21/11/94/464211194.db2.gz BQQRDXGWOIATBB-UHFFFAOYSA-N 1 1 345.424 2.373 20 5 EEBDMO O=C1CCCN1[C@H]1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000270915631 464270074 /nfs/dbraw/zinc/27/00/74/464270074.db2.gz OLAXLPNPMMMKMW-HNNXBMFYSA-N 1 1 333.388 2.060 20 5 EEBDMO C[N@H+]1CCC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000180548455 464335379 /nfs/dbraw/zinc/33/53/79/464335379.db2.gz VWTVHWDLEKVPRK-SECBINFHSA-N 1 1 342.193 2.181 20 5 EEBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000343054820 465473507 /nfs/dbraw/zinc/47/35/07/465473507.db2.gz PYTPODLEHUZWPM-CQSZACIVSA-N 1 1 345.403 2.776 20 5 EEBDMO O=C(C[N@H+](CCO)C1CCCCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000264736985 464443785 /nfs/dbraw/zinc/44/37/85/464443785.db2.gz RCACMANMRFXSPP-UHFFFAOYSA-N 1 1 347.415 2.111 20 5 EEBDMO C[N@@H+]1CC[C@H]2CCN(c3ncc([N+](=O)[O-])cc3Br)[C@@H]2C1 ZINC000272166832 464503021 /nfs/dbraw/zinc/50/30/21/464503021.db2.gz GZYXINPETAKSQP-JOYOIKCWSA-N 1 1 341.209 2.283 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(c3ncc([N+](=O)[O-])cc3Br)[C@@H]2C1 ZINC000272166832 464503026 /nfs/dbraw/zinc/50/30/26/464503026.db2.gz GZYXINPETAKSQP-JOYOIKCWSA-N 1 1 341.209 2.283 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)C1 ZINC000295416680 464824001 /nfs/dbraw/zinc/82/40/01/464824001.db2.gz UUMQWALNTZSDPR-GOSISDBHSA-N 1 1 345.399 2.112 20 5 EEBDMO Cc1n[nH]c(C(=O)NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000266923988 464872617 /nfs/dbraw/zinc/87/26/17/464872617.db2.gz LURMEKUBHCFRLC-GFCCVEGCSA-N 1 1 345.403 2.267 20 5 EEBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000286325496 464881824 /nfs/dbraw/zinc/88/18/24/464881824.db2.gz DOSWDBLLSBPVML-GVSKICRLSA-N 1 1 345.399 2.197 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000298737111 465489700 /nfs/dbraw/zinc/48/97/00/465489700.db2.gz NCGXTJBAKCNCSW-JSGCOSHPSA-N 1 1 334.376 2.352 20 5 EEBDMO O=c1cc(C[N@H+]2CCOC[C@H](O)C2)c2c(ccc3ccccc32)o1 ZINC000295723519 464941279 /nfs/dbraw/zinc/94/12/79/464941279.db2.gz VMVFBYBLBQEHNK-OAHLLOKOSA-N 1 1 325.364 2.139 20 5 EEBDMO O=c1cc(C[N@@H+]2CCOC[C@H](O)C2)c2c(ccc3ccccc32)o1 ZINC000295723519 464941284 /nfs/dbraw/zinc/94/12/84/464941284.db2.gz VMVFBYBLBQEHNK-OAHLLOKOSA-N 1 1 325.364 2.139 20 5 EEBDMO COc1cc(C[N@H+](C)C2(CO)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000353027088 465585796 /nfs/dbraw/zinc/58/57/96/465585796.db2.gz LUPDEVBSTUYULG-UHFFFAOYSA-N 1 1 332.303 2.162 20 5 EEBDMO COc1cc(C[N@@H+](C)C2(CO)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000353027088 465585802 /nfs/dbraw/zinc/58/58/02/465585802.db2.gz LUPDEVBSTUYULG-UHFFFAOYSA-N 1 1 332.303 2.162 20 5 EEBDMO CC(C)[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000299275177 465678270 /nfs/dbraw/zinc/67/82/70/465678270.db2.gz MWUSQVDYXOLEIL-CKEIUWERSA-N 1 1 349.431 2.345 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000340141033 465805855 /nfs/dbraw/zinc/80/58/55/465805855.db2.gz HPFOXQDOSOUBOA-LSDHHAIUSA-N 1 1 332.404 2.063 20 5 EEBDMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC000362543729 465818695 /nfs/dbraw/zinc/81/86/95/465818695.db2.gz VYZTXJLXDYGFMP-CXAGYDPISA-N 1 1 346.431 2.391 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]C[C@H](CO)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000353511423 465943328 /nfs/dbraw/zinc/94/33/28/465943328.db2.gz OXFYUSVHINOBIW-GDBMZVCRSA-N 1 1 330.388 2.026 20 5 EEBDMO CC(C)[C@](C)(O)C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353513102 465943756 /nfs/dbraw/zinc/94/37/56/465943756.db2.gz FAKFHNOMQCDSKE-DOTOQJQBSA-N 1 1 332.404 2.414 20 5 EEBDMO CN(C[C@H]1CC[N@@H+](C)[C@H]1c1cccnc1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000349118021 465980373 /nfs/dbraw/zinc/98/03/73/465980373.db2.gz AYQSMNDCVAMPGY-CJNGLKHVSA-N 1 1 343.387 2.083 20 5 EEBDMO C[C@@H]1C[C@@H]1[N@@H+]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000346239177 466018464 /nfs/dbraw/zinc/01/84/64/466018464.db2.gz OXWUVMUQCDIYAD-OZVIIMIRSA-N 1 1 333.388 2.103 20 5 EEBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000346239177 466018469 /nfs/dbraw/zinc/01/84/69/466018469.db2.gz OXWUVMUQCDIYAD-OZVIIMIRSA-N 1 1 333.388 2.103 20 5 EEBDMO Cc1cc(N2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000302019737 466080037 /nfs/dbraw/zinc/08/00/37/466080037.db2.gz NGZXOBHGDCLBHT-ZIAGYGMSSA-N 1 1 344.415 2.343 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@H](C[NH+]3CCCCC3)C2)c1[N+](=O)[O-] ZINC000331451753 466091628 /nfs/dbraw/zinc/09/16/28/466091628.db2.gz OWQPPBYOJNTXIV-CYBMUJFWSA-N 1 1 349.435 2.389 20 5 EEBDMO Cc1ccc([C@@H]2CCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000363049628 466194641 /nfs/dbraw/zinc/19/46/41/466194641.db2.gz OCWZDUDPFRXXPW-IRXDYDNUSA-N 1 1 330.388 2.298 20 5 EEBDMO CC1(C)CCC[N@@H+](CCNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000331711249 466209683 /nfs/dbraw/zinc/20/96/83/466209683.db2.gz KYISTRYLAGQLRV-UHFFFAOYSA-N 1 1 345.403 2.323 20 5 EEBDMO C[C@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]1CO ZINC000305471215 466411003 /nfs/dbraw/zinc/41/10/03/466411003.db2.gz YDFADRPBWSLPCA-SMDDNHRTSA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]1CO ZINC000305471215 466411006 /nfs/dbraw/zinc/41/10/06/466411006.db2.gz YDFADRPBWSLPCA-SMDDNHRTSA-N 1 1 332.360 2.238 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000372592472 466492135 /nfs/dbraw/zinc/49/21/35/466492135.db2.gz UTWRULXXYICCRL-PIIMJCKOSA-N 1 1 337.379 2.455 20 5 EEBDMO C[N@H+]1CC[C@@](O)(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000358152505 466498575 /nfs/dbraw/zinc/49/85/75/466498575.db2.gz CIBVSLDCLRSLKS-QGZVFWFLSA-N 1 1 331.372 2.011 20 5 EEBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1 ZINC000347250438 466508977 /nfs/dbraw/zinc/50/89/77/466508977.db2.gz NWJDTAADTTYYAA-GXTWGEPZSA-N 1 1 328.372 2.488 20 5 EEBDMO C[C@H]([C@H](C)Nc1ncnc2cccc([N+](=O)[O-])c21)[NH+]1CCOCC1 ZINC000347402216 466613131 /nfs/dbraw/zinc/61/31/31/466613131.db2.gz FWDYYCXSAPJKQJ-NWDGAFQWSA-N 1 1 331.376 2.059 20 5 EEBDMO C[NH+](C)[C@@H]1CCCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000372989763 466655529 /nfs/dbraw/zinc/65/55/29/466655529.db2.gz KQQITWILMKMVFJ-OAHLLOKOSA-N 1 1 334.420 2.340 20 5 EEBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@]23CCOC3)c([N+](=O)[O-])c1 ZINC000411765270 466896237 /nfs/dbraw/zinc/89/62/37/466896237.db2.gz JJGVHIJYWUYQJR-QGZVFWFLSA-N 1 1 349.387 2.187 20 5 EEBDMO Cc1nn(C)c(N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1[N+](=O)[O-] ZINC000370736914 466984388 /nfs/dbraw/zinc/98/43/88/466984388.db2.gz BTQZPXGZXKDWEK-FICVDOATSA-N 1 1 327.388 2.179 20 5 EEBDMO COC(=O)[C@@]1(C)CCC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000412060686 466987631 /nfs/dbraw/zinc/98/76/31/466987631.db2.gz GPGFDEWLBNTCNM-SJCJKPOMSA-N 1 1 349.387 2.197 20 5 EEBDMO COC(=O)[C@@]1(C)CCC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000412060686 466987635 /nfs/dbraw/zinc/98/76/35/466987635.db2.gz GPGFDEWLBNTCNM-SJCJKPOMSA-N 1 1 349.387 2.197 20 5 EEBDMO O=[N+]([O-])c1cnc(NC[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000413158975 467180767 /nfs/dbraw/zinc/18/07/67/467180767.db2.gz WOVKQRMKODHCSA-KRWDZBQOSA-N 1 1 346.362 2.178 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]([C@H]2CCOC2)C1 ZINC000378236658 467237710 /nfs/dbraw/zinc/23/77/10/467237710.db2.gz PHQWLKPSNIYDOW-MCIONIFRSA-N 1 1 333.388 2.280 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+](C2CC2)C[C@@H](C)C1 ZINC000451080275 467242004 /nfs/dbraw/zinc/24/20/04/467242004.db2.gz BNFNLKVTDGKDKQ-UONOGXRCSA-N 1 1 346.431 2.338 20 5 EEBDMO Cc1nn(C)c(N2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000413527159 467260030 /nfs/dbraw/zinc/26/00/30/467260030.db2.gz AJASCJBNUPKPQD-CYBMUJFWSA-N 1 1 329.404 2.347 20 5 EEBDMO Cc1nn(C)c(N2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000413527162 467260794 /nfs/dbraw/zinc/26/07/94/467260794.db2.gz AJASCJBNUPKPQD-ZDUSSCGKSA-N 1 1 329.404 2.347 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@@H](n2cc(C[NH3+])nn2)C1 ZINC000420368442 467381610 /nfs/dbraw/zinc/38/16/10/467381610.db2.gz AQTLLYRSYKFCNN-XJKSGUPXSA-N 1 1 344.419 2.352 20 5 EEBDMO Cc1c(NC(=O)CC[NH2+][C@@H]2[C@H](C)CCN[C@H]2C)cccc1[N+](=O)[O-] ZINC000420381195 467386067 /nfs/dbraw/zinc/38/60/67/467386067.db2.gz ZAEHVLAUVVTJBI-BTJLNZGRSA-N 1 1 334.420 2.208 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1[C@H](O)C(F)(F)F ZINC000430230074 467409740 /nfs/dbraw/zinc/40/97/40/467409740.db2.gz ZSLCIEQXPDSPJV-AAEUAGOBSA-N 1 1 334.294 2.491 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1[C@H](O)C(F)(F)F ZINC000430230074 467409744 /nfs/dbraw/zinc/40/97/44/467409744.db2.gz ZSLCIEQXPDSPJV-AAEUAGOBSA-N 1 1 334.294 2.491 20 5 EEBDMO CNc1nc(C(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000454709292 467611252 /nfs/dbraw/zinc/61/12/52/467611252.db2.gz HKXGCERQVZQUBS-RYUDHWBXSA-N 1 1 335.408 2.024 20 5 EEBDMO O=[N+]([O-])c1ccc(CNC[C@@H]2CCC[N@@H+]2CCCO)c(Cl)c1 ZINC000449388185 467635905 /nfs/dbraw/zinc/63/59/05/467635905.db2.gz OLMJEGBEKCJEDT-AWEZNQCLSA-N 1 1 327.812 2.185 20 5 EEBDMO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCCN2CCCO)c(Cl)c1 ZINC000449388185 467635906 /nfs/dbraw/zinc/63/59/06/467635906.db2.gz OLMJEGBEKCJEDT-AWEZNQCLSA-N 1 1 327.812 2.185 20 5 EEBDMO C[N@H+]1CCC[C@@H](CCNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000458591684 467863495 /nfs/dbraw/zinc/86/34/95/467863495.db2.gz SKFPNFTXOOBNRY-HNNXBMFYSA-N 1 1 334.420 2.168 20 5 EEBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000450573315 467872247 /nfs/dbraw/zinc/87/22/47/467872247.db2.gz WYRKXXGYFHXNHC-RYUDHWBXSA-N 1 1 343.387 2.150 20 5 EEBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000450573315 467872252 /nfs/dbraw/zinc/87/22/52/467872252.db2.gz WYRKXXGYFHXNHC-RYUDHWBXSA-N 1 1 343.387 2.150 20 5 EEBDMO COC(=O)[C@@H]([NH2+]CCCNc1ccc([N+](=O)[O-])cc1F)C(C)C ZINC000450598998 467877548 /nfs/dbraw/zinc/87/75/48/467877548.db2.gz KDKMVPUTSMCUOF-AWEZNQCLSA-N 1 1 327.356 2.323 20 5 EEBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1 ZINC000516806196 468047703 /nfs/dbraw/zinc/04/77/03/468047703.db2.gz PRVXEHVGEMDLAP-ZIAGYGMSSA-N 1 1 337.424 2.175 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@@H+](C)[C@H](C(C)C)C1 ZINC000488001882 468066138 /nfs/dbraw/zinc/06/61/38/468066138.db2.gz VQCLVVPWMWDKNG-HNNXBMFYSA-N 1 1 334.420 2.114 20 5 EEBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@@H]1CCC[N@@H+](C)C1 ZINC000548889068 468153890 /nfs/dbraw/zinc/15/38/90/468153890.db2.gz KUPPNPWVGBLBBC-HNNXBMFYSA-N 1 1 334.420 2.121 20 5 EEBDMO CNc1ccc(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)cc1[N+](=O)[O-] ZINC000533194349 468178370 /nfs/dbraw/zinc/17/83/70/468178370.db2.gz ORIYTENOIUIYNQ-HIFRSBDPSA-N 1 1 332.404 2.193 20 5 EEBDMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1 ZINC000534517929 468261007 /nfs/dbraw/zinc/26/10/07/468261007.db2.gz RSKSRHKJNLWJEZ-CZUORRHYSA-N 1 1 346.431 2.391 20 5 EEBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594234478 468523902 /nfs/dbraw/zinc/52/39/02/468523902.db2.gz XJHQUKMSTKJFIM-RDJZCZTQSA-N 1 1 346.431 2.453 20 5 EEBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H]3CC[C@@H](O)C[C@@H]3C2)c2c(c1)COCO2 ZINC000570298470 468619951 /nfs/dbraw/zinc/61/99/51/468619951.db2.gz MYURDDYXNICBMG-HWWQOWPSSA-N 1 1 334.372 2.054 20 5 EEBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)CCOc1ccccc1[N+](=O)[O-])C2 ZINC000597713684 468647783 /nfs/dbraw/zinc/64/77/83/468647783.db2.gz FOTBYFRKQMBKSC-SFHVURJKSA-N 1 1 347.415 2.308 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c1[N+](=O)[O-] ZINC000592255457 468666122 /nfs/dbraw/zinc/66/61/22/468666122.db2.gz PSQMWIVZOJPAPI-QWHCGFSZSA-N 1 1 349.435 2.122 20 5 EEBDMO COc1ccc(-c2ccc(C[NH2+]C3CN(C(C)=O)C3)o2)c([N+](=O)[O-])c1 ZINC000570942623 468718746 /nfs/dbraw/zinc/71/87/46/468718746.db2.gz SMXPMLMDJQYUNF-UHFFFAOYSA-N 1 1 345.355 2.184 20 5 EEBDMO Cc1noc(C[N@@H+]2CCC[C@H](c3nnc4ccccn43)C2)c1[N+](=O)[O-] ZINC000595323241 468812391 /nfs/dbraw/zinc/81/23/91/468812391.db2.gz XKNDHDGBDUBGPW-LBPRGKRZSA-N 1 1 342.359 2.314 20 5 EEBDMO Cc1noc(C[N@H+]2CCC[C@H](c3nnc4ccccn43)C2)c1[N+](=O)[O-] ZINC000595323241 468812398 /nfs/dbraw/zinc/81/23/98/468812398.db2.gz XKNDHDGBDUBGPW-LBPRGKRZSA-N 1 1 342.359 2.314 20 5 EEBDMO CC[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H](CC)CO1 ZINC000593058776 468855871 /nfs/dbraw/zinc/85/58/71/468855871.db2.gz OJUSVFIBCMDXJD-RBSFLKMASA-N 1 1 338.404 2.224 20 5 EEBDMO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000593314751 468936574 /nfs/dbraw/zinc/93/65/74/468936574.db2.gz HGILOFZQGXNKCO-JJRVBVJISA-N 1 1 337.395 2.452 20 5 EEBDMO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCN(Cc3csc([N+](=O)[O-])c3)C2)C1 ZINC000593315581 468936778 /nfs/dbraw/zinc/93/67/78/468936778.db2.gz MPHJLUZONRZMKT-MCIONIFRSA-N 1 1 325.434 2.375 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](C)[C@H](CO)C2)cccc1[N+](=O)[O-] ZINC000598652434 468946417 /nfs/dbraw/zinc/94/64/17/468946417.db2.gz YZPZEHXBXIDGLP-OCCSQVGLSA-N 1 1 335.404 2.182 20 5 EEBDMO CCN1C[C@@H](C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)Oc2ccccc21 ZINC000610447492 468970876 /nfs/dbraw/zinc/97/08/76/468970876.db2.gz LYQVCNGEJJXDDP-OAHLLOKOSA-N 1 1 345.403 2.011 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CC1=CCCOC1 ZINC000595754571 468991056 /nfs/dbraw/zinc/99/10/56/468991056.db2.gz XXXDQIAEZYJSTO-UHFFFAOYSA-N 1 1 349.387 2.211 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCO)[C@H]1CCc2ccccc21 ZINC000602777771 469067208 /nfs/dbraw/zinc/06/72/08/469067208.db2.gz LKXMDXQHGABSQD-INIZCTEOSA-N 1 1 330.388 2.082 20 5 EEBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2N[C@H]1CC[N@H+](C2CC2)C1 ZINC000596091928 469151814 /nfs/dbraw/zinc/15/18/14/469151814.db2.gz PUUIMQWFRGGFCJ-NSHDSACASA-N 1 1 328.372 2.222 20 5 EEBDMO COCC1([N@@H+](C)CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000611179139 469184194 /nfs/dbraw/zinc/18/41/94/469184194.db2.gz SHBBPWCFFLJOOU-UHFFFAOYSA-N 1 1 335.360 2.004 20 5 EEBDMO CC(C)[N@H+]1CCCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000611249339 469208299 /nfs/dbraw/zinc/20/82/99/469208299.db2.gz NKLYTMFQCQPAMS-UHFFFAOYSA-N 1 1 335.404 2.282 20 5 EEBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@H](c3cc[nH]n3)C1)OCCO2 ZINC000611261556 469212612 /nfs/dbraw/zinc/21/26/12/469212612.db2.gz YYRAIZYPTZZMDW-LBPRGKRZSA-N 1 1 344.371 2.469 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21 ZINC000602997565 469212903 /nfs/dbraw/zinc/21/29/03/469212903.db2.gz MZKAMAGUHRSTPM-PVAVHDDUSA-N 1 1 347.415 2.467 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21 ZINC000602997565 469212910 /nfs/dbraw/zinc/21/29/10/469212910.db2.gz MZKAMAGUHRSTPM-PVAVHDDUSA-N 1 1 347.415 2.467 20 5 EEBDMO C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@H]1CCCC[C@@H]1O ZINC000611521397 469271400 /nfs/dbraw/zinc/27/14/00/469271400.db2.gz MEYJULKWXLZAGT-DOMZBBRYSA-N 1 1 336.388 2.349 20 5 EEBDMO CC(C)[N@@H+](C)CCNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599480906 469271439 /nfs/dbraw/zinc/27/14/39/469271439.db2.gz QMZNYFQNWYBGIH-UHFFFAOYSA-N 1 1 344.209 2.427 20 5 EEBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000615878656 469333297 /nfs/dbraw/zinc/33/32/97/469333297.db2.gz FTUNTLGLNJKCDC-BETUJISGSA-N 1 1 333.388 2.057 20 5 EEBDMO COc1ccc(CN2CCC[N@@H+](C[C@@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000603847984 469436026 /nfs/dbraw/zinc/43/60/26/469436026.db2.gz IQXJCXOKRAIDMC-INIZCTEOSA-N 1 1 349.431 2.290 20 5 EEBDMO Cc1nn(C)c(-c2nc(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)no2)c1[N+](=O)[O-] ZINC000612955107 469589908 /nfs/dbraw/zinc/58/99/08/469589908.db2.gz UIXDLSDZQBDWEU-FGWVZKOKSA-N 1 1 332.364 2.027 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H](CCO)C3)o2)cc1 ZINC000609204393 469902931 /nfs/dbraw/zinc/90/29/31/469902931.db2.gz MEWHPZUJMOHKLM-GFCCVEGCSA-N 1 1 332.360 2.239 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H](CCO)C3)o2)cc1 ZINC000609204393 469902936 /nfs/dbraw/zinc/90/29/36/469902936.db2.gz MEWHPZUJMOHKLM-GFCCVEGCSA-N 1 1 332.360 2.239 20 5 EEBDMO Cc1c(NC(=O)N[C@H](C)CCN2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000183940773 533913266 /nfs/dbraw/zinc/91/32/66/533913266.db2.gz VQPHNMBABQJZCX-CYBMUJFWSA-N 1 1 349.435 2.051 20 5 EEBDMO Cc1[nH+]ccn1CCOC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000772034458 577246366 /nfs/dbraw/zinc/24/63/66/577246366.db2.gz LQNPCJXMTMHVBD-UHFFFAOYSA-N 1 1 328.328 2.367 20 5 EEBDMO CCC(C)(C)[N@@H+](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000733996653 577268924 /nfs/dbraw/zinc/26/89/24/577268924.db2.gz NRKVYMLHUALDSM-UHFFFAOYSA-N 1 1 348.447 2.364 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2CCN(c3cccc(O)c3)CC2)cc1 ZINC000776273474 577456257 /nfs/dbraw/zinc/45/62/57/577456257.db2.gz BTPZHNVZHOIZTB-SFHVURJKSA-N 1 1 343.383 2.156 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2CCC([C@@H](O)C(F)(F)F)CC2)cc1 ZINC000776587541 577463437 /nfs/dbraw/zinc/46/34/37/577463437.db2.gz VZRMVXVEQMNZAB-UONOGXRCSA-N 1 1 348.321 2.263 20 5 EEBDMO Cn1ncc2c1CCC[C@H]2[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776591689 577463749 /nfs/dbraw/zinc/46/37/49/577463749.db2.gz UGLJOGORCSHARQ-WBVHZDCISA-N 1 1 330.388 2.371 20 5 EEBDMO Cc1[nH+]ccn1CCCOC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000767542479 577539201 /nfs/dbraw/zinc/53/92/01/577539201.db2.gz XURBCPORQDBCCV-UHFFFAOYSA-N 1 1 347.327 2.118 20 5 EEBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CC[N@@H+](C)[C@H](C)C1 ZINC000761067579 577675425 /nfs/dbraw/zinc/67/54/25/577675425.db2.gz FXQKTHMNQXKHNC-MNOVXSKESA-N 1 1 340.811 2.211 20 5 EEBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[N@H+](C)[C@H](C)C1 ZINC000761077025 577675716 /nfs/dbraw/zinc/67/57/16/577675716.db2.gz JYGMEYLYNGESJP-NEPJUHHUSA-N 1 1 331.376 2.342 20 5 EEBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[N@@H+](C)[C@H](C)C1 ZINC000761077025 577675717 /nfs/dbraw/zinc/67/57/17/577675717.db2.gz JYGMEYLYNGESJP-NEPJUHHUSA-N 1 1 331.376 2.342 20 5 EEBDMO O=[N+]([O-])c1ccc2nc(N3CC[C@H](C[NH+]4CCOCC4)C3)sc2c1 ZINC000742415266 577872709 /nfs/dbraw/zinc/87/27/09/577872709.db2.gz ARHFBVHKUIMTPH-GFCCVEGCSA-N 1 1 348.428 2.363 20 5 EEBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000744798902 577903200 /nfs/dbraw/zinc/90/32/00/577903200.db2.gz QYEXWVLTOBQDNP-CQSZACIVSA-N 1 1 346.431 2.267 20 5 EEBDMO CC[N@H+](C[C@H]1CCCO1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742145732 578127883 /nfs/dbraw/zinc/12/78/83/578127883.db2.gz DIJWRVGPSNRESI-CQSZACIVSA-N 1 1 331.376 2.312 20 5 EEBDMO CC[N@@H+](C[C@H]1CCCO1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742145732 578127884 /nfs/dbraw/zinc/12/78/84/578127884.db2.gz DIJWRVGPSNRESI-CQSZACIVSA-N 1 1 331.376 2.312 20 5 EEBDMO CC(C)c1ccccc1C[NH2+][C@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC001022064087 676628813 /nfs/dbraw/zinc/62/88/13/676628813.db2.gz VOBQUMINLVWXNF-YALNPMBYSA-N 1 1 331.416 2.212 20 5 EEBDMO C[C@@H](NC(=O)N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000892111541 678013345 /nfs/dbraw/zinc/01/33/45/678013345.db2.gz MLYUAHOWNDDVDV-HACGYAERSA-N 1 1 332.404 2.249 20 5 EEBDMO Cc1[nH]ccc1C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21 ZINC001025729144 683251825 /nfs/dbraw/zinc/25/18/25/683251825.db2.gz XXCWVDLGGLPEMS-QLPKVWCKSA-N 1 1 340.383 2.092 20 5 EEBDMO C[C@@H](CNC(=O)N[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000893020261 683570619 /nfs/dbraw/zinc/57/06/19/683570619.db2.gz OYYNJHVQGJJAEC-QWHCGFSZSA-N 1 1 332.404 2.234 20 5 EEBDMO C[C@H](CNC(=O)N[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000893020260 683571026 /nfs/dbraw/zinc/57/10/26/683571026.db2.gz OYYNJHVQGJJAEC-OLZOCXBDSA-N 1 1 332.404 2.234 20 5 EEBDMO CC(C)c1ccc(CN2CC[C@H](N3CC[NH2+]CC3)C2)cc1[N+](=O)[O-] ZINC000262121962 683892992 /nfs/dbraw/zinc/89/29/92/683892992.db2.gz MEKLMQWPAOFKKE-INIZCTEOSA-N 1 1 332.448 2.198 20 5 EEBDMO Cc1cccc(C)c1C[N@H+](C)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985432327 686710086 /nfs/dbraw/zinc/71/00/86/686710086.db2.gz ZOPZXBCGXFGRRS-SJLPKXTDSA-N 1 1 345.443 2.391 20 5 EEBDMO Cc1cccc(C)c1C[N@@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985432327 686710091 /nfs/dbraw/zinc/71/00/91/686710091.db2.gz ZOPZXBCGXFGRRS-SJLPKXTDSA-N 1 1 345.443 2.391 20 5 EEBDMO Cc1cccc(C)c1C[N@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985432327 686710094 /nfs/dbraw/zinc/71/00/94/686710094.db2.gz ZOPZXBCGXFGRRS-SJLPKXTDSA-N 1 1 345.443 2.391 20 5 EEBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccc(F)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643018 1196464268 /nfs/dbraw/zinc/46/42/68/1196464268.db2.gz JEZFXCUCEUPWQC-KLHDSHLOSA-N 1 1 335.379 2.008 20 5 EEBDMO CCC[N@@H+](CC)C[C@H](C)NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000810120342 1199302835 /nfs/dbraw/zinc/30/28/35/1199302835.db2.gz BCOFWYXTYMPFFF-NSHDSACASA-N 1 1 347.412 2.133 20 5 EEBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878340933 1200408153 /nfs/dbraw/zinc/40/81/53/1200408153.db2.gz VLDFDDRLNNVZGW-RYUDHWBXSA-N 1 1 331.376 2.169 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])C1 ZINC000866186930 1201459368 /nfs/dbraw/zinc/45/93/68/1201459368.db2.gz YJOMJSMBJDUKFW-CYBMUJFWSA-N 1 1 337.395 2.467 20 5 EEBDMO CC(C)OC1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1 ZINC000867943570 1201710810 /nfs/dbraw/zinc/71/08/10/1201710810.db2.gz ZDANPJLYBNJZPN-KRWDZBQOSA-N 1 1 335.404 2.185 20 5 EEBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000886590772 1202528699 /nfs/dbraw/zinc/52/86/99/1202528699.db2.gz DHSCXDXRPGYDFL-CYBMUJFWSA-N 1 1 345.403 2.273 20 5 EEBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000886590772 1202528701 /nfs/dbraw/zinc/52/87/01/1202528701.db2.gz DHSCXDXRPGYDFL-CYBMUJFWSA-N 1 1 345.403 2.273 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCCC[N@@H+](C)C1 ZINC000929092674 1206446706 /nfs/dbraw/zinc/44/67/06/1206446706.db2.gz VKVMTSAAPKLTBN-LBPRGKRZSA-N 1 1 336.392 2.457 20 5 EEBDMO CCN(CCCNC(=O)C[N@@H+](C)C1CCC1)c1ccccc1[N+](=O)[O-] ZINC001095981033 1232958569 /nfs/dbraw/zinc/95/85/69/1232958569.db2.gz BGFZADARPZUAQZ-UHFFFAOYSA-N 1 1 348.447 2.412 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N(C)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC001096111388 1234961595 /nfs/dbraw/zinc/96/15/95/1234961595.db2.gz AHTVMZMRMGXEPK-UHFFFAOYSA-N 1 1 348.447 2.364 20 5 EEBDMO Cc1ccc(N2CC[NH+](CCCNC(=O)C(C)C)CC2)c([N+](=O)[O-])c1 ZINC001096248825 1236630668 /nfs/dbraw/zinc/63/06/68/1236630668.db2.gz YUVURHRUVRZIAT-UHFFFAOYSA-N 1 1 348.447 2.188 20 5 EEBDMO Cc1cc(N2CC[NH+](CCNC(=O)CC(C)C)CC2)ccc1[N+](=O)[O-] ZINC001096261636 1236792533 /nfs/dbraw/zinc/79/25/33/1236792533.db2.gz FWADKBIMFRFWGX-UHFFFAOYSA-N 1 1 348.447 2.188 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)N[C@H]1C[C@H](Nc2ccccc2[N+](=O)[O-])C1 ZINC001097078433 1243673563 /nfs/dbraw/zinc/67/35/63/1243673563.db2.gz ODESLOUTBWHLRQ-JOCQHMNTSA-N 1 1 334.420 2.384 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](Nc2ccccc2[N+](=O)[O-])C1 ZINC001097205204 1243820629 /nfs/dbraw/zinc/82/06/29/1243820629.db2.gz ALAVXMWPMMDXBL-OKILXGFUSA-N 1 1 334.420 2.386 20 5 EEBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@H+](C2CC2)C1 ZINC000853232262 1292334995 /nfs/dbraw/zinc/33/49/95/1292334995.db2.gz XORQIIIULJKITB-LLVKDONJSA-N 1 1 332.360 2.200 20 5 EEBDMO COC(=O)CC[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)C(C)C ZINC000853496408 1292399939 /nfs/dbraw/zinc/39/99/39/1292399939.db2.gz RTVXUCGVHNZAPY-UHFFFAOYSA-N 1 1 347.375 2.084 20 5 EEBDMO COC(=O)CC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)C(C)C ZINC000853496408 1292399953 /nfs/dbraw/zinc/39/99/53/1292399953.db2.gz RTVXUCGVHNZAPY-UHFFFAOYSA-N 1 1 347.375 2.084 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000855289179 1293156327 /nfs/dbraw/zinc/15/63/27/1293156327.db2.gz NWCRHMVFJAFBCI-LLVKDONJSA-N 1 1 339.367 2.102 20 5 EEBDMO C[C@]1(CO)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@]1(C)CO ZINC000859821476 1294659236 /nfs/dbraw/zinc/65/92/36/1294659236.db2.gz QRAMAHUUTNOWBO-GASCZTMLSA-N 1 1 328.796 2.061 20 5 EEBDMO C[C@]1(CO)C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@]1(C)CO ZINC000859821476 1294659245 /nfs/dbraw/zinc/65/92/45/1294659245.db2.gz QRAMAHUUTNOWBO-GASCZTMLSA-N 1 1 328.796 2.061 20 5 EEBDMO Cc1ccc(Nc2cc(N3CC[NH+](C)CC3)ncn2)c([N+](=O)[O-])c1 ZINC001214167391 1296329748 /nfs/dbraw/zinc/32/97/48/1296329748.db2.gz JNBKMDWXTUWCKR-UHFFFAOYSA-N 1 1 328.376 2.189 20 5 EEBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](OCCc3ccc([N+](=O)[O-])cc3)C[C@H]1[N@H+]2C ZINC001224333850 1300550462 /nfs/dbraw/zinc/55/04/62/1300550462.db2.gz NBIPJNAGWVGHOK-FJIDUMEYSA-N 1 1 348.399 2.321 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(NC2(CNC(=O)C[N@H+](C)C(C)C)CCC2)n1 ZINC001111815343 1303933078 /nfs/dbraw/zinc/93/30/78/1303933078.db2.gz FIXSLBAWJRCRBW-UHFFFAOYSA-N 1 1 349.435 2.089 20 5 EEBDMO C[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CCCC1 ZINC000798191807 1304941748 /nfs/dbraw/zinc/94/17/48/1304941748.db2.gz MVHLYOXPVQIPTQ-QGZVFWFLSA-N 1 1 346.387 2.194 20 5 EEBDMO COc1ccc(NC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c([N+](=O)[O-])c1 ZINC001123267351 1310505278 /nfs/dbraw/zinc/50/52/78/1310505278.db2.gz CFJFNLNFXLVKFJ-NEPJUHHUSA-N 1 1 334.376 2.304 20 5 EEBDMO Cc1nn(CN(C)[C@@H]2CC[N@H+](C(C)C)C2)c2ncc([N+](=O)[O-])cc12 ZINC000840152150 1315311443 /nfs/dbraw/zinc/31/14/43/1315311443.db2.gz CUYBCSORWDFUSF-CYBMUJFWSA-N 1 1 332.408 2.020 20 5 EEBDMO Cc1c(Cc2noc(C[NH2+]C[C@H]3CCCO3)n2)cccc1[N+](=O)[O-] ZINC000843192491 1315863925 /nfs/dbraw/zinc/86/39/25/1315863925.db2.gz WEIIJIPEQQCRAX-CYBMUJFWSA-N 1 1 332.360 2.146 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3C[C@@H](F)C[C@H](CO)C3)CC2)cc1 ZINC001254475235 1318083228 /nfs/dbraw/zinc/08/32/28/1318083228.db2.gz CUCHJLREJMCFKQ-KBPBESRZSA-N 1 1 337.395 2.216 20 5 EEBDMO COc1ncnc2c1CC[N@@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])C2 ZINC001254558526 1318121548 /nfs/dbraw/zinc/12/15/48/1318121548.db2.gz CEWPEVJDFFQRGM-LBPRGKRZSA-N 1 1 328.372 2.383 20 5 EEBDMO COc1ncnc2c1CC[N@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])C2 ZINC001254558526 1318121564 /nfs/dbraw/zinc/12/15/64/1318121564.db2.gz CEWPEVJDFFQRGM-LBPRGKRZSA-N 1 1 328.372 2.383 20 5 EEBDMO CCC[N@@H+]1C[C@H]2CN(c3cc(/C=C/N(C)C)c([N+](=O)[O-])cn3)C[C@H]2C1 ZINC001157692743 1318801055 /nfs/dbraw/zinc/80/10/55/1318801055.db2.gz SFEXOJLLONNJOM-LFZXJUCQSA-N 1 1 345.447 2.300 20 5 EEBDMO Nc1cccc(C[NH+]2CCN(c3ncc([N+](=O)[O-])cc3F)CC2)c1 ZINC001158480738 1319261770 /nfs/dbraw/zinc/26/17/70/1319261770.db2.gz MYQBLUHTZZKQPD-UHFFFAOYSA-N 1 1 331.351 2.033 20 5 EEBDMO C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](Nc1cc([N+](=O)[O-])cc(Cl)[n+]1[O-])C2 ZINC001160473033 1320171485 /nfs/dbraw/zinc/17/14/85/1320171485.db2.gz QOAOOJSWCBJPCO-RTCCRHLQSA-N 1 1 326.784 2.309 20 5 EEBDMO COC(=O)c1ccnc(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-] ZINC001160473088 1320171559 /nfs/dbraw/zinc/17/15/59/1320171559.db2.gz SQWPIHLFSUHOHH-CNDDSTCGSA-N 1 1 334.376 2.204 20 5 EEBDMO C[NH+](C)/C=C/c1cc(NC2(c3cnccn3)CC2)ncc1[N+](=O)[O-] ZINC001161945421 1320687374 /nfs/dbraw/zinc/68/73/74/1320687374.db2.gz YBKXKZCCRVZEPX-FPYGCLRLSA-N 1 1 326.360 2.413 20 5 EEBDMO CCC[N@H+]1CC[C@@H](Nc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C1 ZINC001307176140 1329075848 /nfs/dbraw/zinc/07/58/48/1329075848.db2.gz WVWUNYGAGRJNKF-LLVKDONJSA-N 1 1 345.359 2.369 20 5 EEBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-] ZINC001609167044 1351872684 /nfs/dbraw/zinc/87/26/84/1351872684.db2.gz YPTBGBNXYDBGOG-NWDGAFQWSA-N 1 1 345.407 2.307 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC001326515619 1334108054 /nfs/dbraw/zinc/10/80/54/1334108054.db2.gz IDGFWHSGUPXMQS-QGZVFWFLSA-N 1 1 332.404 2.194 20 5 EEBDMO COC[C@@H]1CCC[N@@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])CC1 ZINC001609319586 1351931822 /nfs/dbraw/zinc/93/18/22/1351931822.db2.gz GZTJIDOQDXRHIB-GFCCVEGCSA-N 1 1 346.391 2.023 20 5 EEBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)N1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001329976095 1334752855 /nfs/dbraw/zinc/75/28/55/1334752855.db2.gz CTRSFWBXNSRTDJ-GFCCVEGCSA-N 1 1 326.356 2.205 20 5 EEBDMO Cc1c(-c2nnc(N3CC[N@@H+](C)C(C)(C)C3)n2C)cccc1[N+](=O)[O-] ZINC001339627982 1337040481 /nfs/dbraw/zinc/04/04/81/1337040481.db2.gz GABUDGVRQNWIID-UHFFFAOYSA-N 1 1 344.419 2.229 20 5 EEBDMO C[C@@H]([NH2+]Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])c1ccccn1 ZINC001575380207 1343783604 /nfs/dbraw/zinc/78/36/04/1343783604.db2.gz SKNMRJSXLPWADU-SNVBAGLBSA-N 1 1 325.332 2.021 20 5 EEBDMO COc1ccc(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)c(C)n1 ZINC001579225502 1344354490 /nfs/dbraw/zinc/35/44/90/1344354490.db2.gz NXOSHUYXTSHGMT-MRXNPFEDSA-N 1 1 330.344 2.119 20 5 EEBDMO Cc1ncc([C@@H](C)[NH2+]Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])s1 ZINC001592408552 1349627887 /nfs/dbraw/zinc/62/78/87/1349627887.db2.gz HOPCJJBJWQNMFX-MRVPVSSYSA-N 1 1 345.388 2.391 20 5 EEBDMO CC[N@@H+]1[C@H](C)CN(c2cc(C)c([N+](=O)[O-])cc2-c2nn[nH]n2)C[C@@H]1C ZINC001604347381 1350921084 /nfs/dbraw/zinc/92/10/84/1350921084.db2.gz JCXDKGUPHHNUML-TXEJJXNPSA-N 1 1 345.407 2.002 20 5 EEBDMO Cc1cc(NCC[N@@H+]2CCC[C@H](C)C2)cc(-c2nn[nH]n2)c1[N+](=O)[O-] ZINC001605734673 1351220123 /nfs/dbraw/zinc/22/01/23/1351220123.db2.gz KJQGSQKSMXCOKP-NSHDSACASA-N 1 1 345.407 2.227 20 5 EEBDMO O=[N+]([O-])c1ccn(C2CCN(c3nc(N4CCCC4)cc[nH+]3)CC2)n1 ZINC000784531214 1371412857 /nfs/dbraw/zinc/41/28/57/1371412857.db2.gz PFQYKVDMSPBMAT-UHFFFAOYSA-N 1 1 343.391 2.023 20 5 EEBDMO C[N@H+](Cc1ccccc1)C[C@@H](O)CNCc1ccc([N+](=O)[O-])cc1 ZINC001356535907 1373201976 /nfs/dbraw/zinc/20/19/76/1373201976.db2.gz YNYVDHAXMAKMKN-SFHVURJKSA-N 1 1 329.400 2.177 20 5 EEBDMO CN(Cc1ccccc1)C[C@@H](O)C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC001356535907 1373201979 /nfs/dbraw/zinc/20/19/79/1373201979.db2.gz YNYVDHAXMAKMKN-SFHVURJKSA-N 1 1 329.400 2.177 20 5 EEBDMO CCc1oncc1C(=O)NCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001753067449 1406662759 /nfs/dbraw/zinc/66/27/59/1406662759.db2.gz FKLSNRLOUXMVBQ-UHFFFAOYSA-N 1 1 332.360 2.007 20 5 EEBDMO [NH3+][C@@H]1C[C@H](NCCc2ccc(Cl)cc2[N+](=O)[O-])C12CCOCC2 ZINC001580162776 1403840442 /nfs/dbraw/zinc/84/04/42/1403840442.db2.gz FPICKKIEKGRUCA-CABCVRRESA-N 1 1 339.823 2.277 20 5 EEBDMO N[C@@H]1C[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C12CCOCC2 ZINC001580162776 1403840449 /nfs/dbraw/zinc/84/04/49/1403840449.db2.gz FPICKKIEKGRUCA-CABCVRRESA-N 1 1 339.823 2.277 20 5 EEBDMO Cc1cc(Cl)nc(N2CC[NH+](C[C@H]3CCCO3)CC2)c1[N+](=O)[O-] ZINC001165040054 721906127 /nfs/dbraw/zinc/90/61/27/721906127.db2.gz WRINDANACDSTCK-GFCCVEGCSA-N 1 1 340.811 2.253 20 5 EEBDMO CC1(C)C(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1(C)C ZINC000782872487 761966732 /nfs/dbraw/zinc/96/67/32/761966732.db2.gz SWLAXRJXKKITIX-UHFFFAOYSA-N 1 1 335.408 2.033 20 5 EEBDMO C[C@H]1C[C@H](CO)C[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000817278501 784657302 /nfs/dbraw/zinc/65/73/02/784657302.db2.gz WWAHSQOWYGNROO-QWRGUYRKSA-N 1 1 341.795 2.137 20 5 EEBDMO C[C@H]1C[C@H](CO)C[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000817278501 784657308 /nfs/dbraw/zinc/65/73/08/784657308.db2.gz WWAHSQOWYGNROO-QWRGUYRKSA-N 1 1 341.795 2.137 20 5 EEBDMO CC1(C)CC(C[NH+]2CC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)C1 ZINC001035705790 784987798 /nfs/dbraw/zinc/98/77/98/784987798.db2.gz BSFUEIXYTDAMGB-HUUCEWRRSA-N 1 1 335.448 2.012 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NC/C=C/CNc1nc(C)ccc1[N+](=O)[O-] ZINC001107277241 786691948 /nfs/dbraw/zinc/69/19/48/786691948.db2.gz YZSYEFZDLKSTTN-AATRIKPKSA-N 1 1 349.435 2.114 20 5 EEBDMO COc1cc(Cc2noc([C@H]3CCCC[NH2+]3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000823145876 787565302 /nfs/dbraw/zinc/56/53/02/787565302.db2.gz JXXYZJDGZFVXQZ-GFCCVEGCSA-N 1 1 348.359 2.400 20 5 EEBDMO CCN(CCNc1ccc([N+](=O)[O-])cc1)C(=O)Cn1cc[nH+]c1C ZINC001106768255 796491976 /nfs/dbraw/zinc/49/19/76/796491976.db2.gz QWRYBANELFQVSN-UHFFFAOYSA-N 1 1 331.376 2.060 20 5 EEBDMO C[N@H+](C1CN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1)[C@@H]1CCOC1 ZINC001172916977 797148890 /nfs/dbraw/zinc/14/88/90/797148890.db2.gz VBOVTWSWTAIVLC-SJLPKXTDSA-N 1 1 345.443 2.247 20 5 EEBDMO C[N@@H+](C1CN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1)[C@@H]1CCOC1 ZINC001172916977 797148895 /nfs/dbraw/zinc/14/88/95/797148895.db2.gz VBOVTWSWTAIVLC-SJLPKXTDSA-N 1 1 345.443 2.247 20 5 EEBDMO O=C1CC[C@@H]2C[N@@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CCN12 ZINC001172912550 797170885 /nfs/dbraw/zinc/17/08/85/797170885.db2.gz BPHFMCLEBCCHFL-NVXWUHKLSA-N 1 1 329.400 2.149 20 5 EEBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCC[C@H](O)C3)CC2)c(F)c1 ZINC001173009602 797195253 /nfs/dbraw/zinc/19/52/53/797195253.db2.gz FEYGRDWPMDOXCQ-ZDUSSCGKSA-N 1 1 341.358 2.299 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[N@@H+](C)CC2)c1F ZINC001173183607 797280177 /nfs/dbraw/zinc/28/01/77/797280177.db2.gz IFKWUWWOQRWSPQ-LBPRGKRZSA-N 1 1 325.384 2.311 20 5 EEBDMO CCCC[NH2+]CCCN(CC1CCCC1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001177314083 798853718 /nfs/dbraw/zinc/85/37/18/798853718.db2.gz ZSFMXBWHSNLSIY-HZPDHXFCSA-N 1 1 325.453 2.450 20 5 EEBDMO O=C(NC[C@H]1C[C@@H]([NH2+]Cc2cc3ccccc3o2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086083045 802111596 /nfs/dbraw/zinc/11/15/96/802111596.db2.gz LTZWHGBTBCKZQH-WXYCVUISSA-N 1 1 343.383 2.082 20 5 EEBDMO COc1cccc(C2(N)CC[NH+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)CC2)c1 ZINC001168999806 803565042 /nfs/dbraw/zinc/56/50/42/803565042.db2.gz VZJSWPUAZMUDGN-GOEBONIOSA-N 1 1 333.432 2.390 20 5 EEBDMO COc1cccc(C2([NH3+])CCN([C@@H]3CC[C@H](C[N+](=O)[O-])C3)CC2)c1 ZINC001168999806 803565045 /nfs/dbraw/zinc/56/50/45/803565045.db2.gz VZJSWPUAZMUDGN-GOEBONIOSA-N 1 1 333.432 2.390 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)C(C)(C)[NH+]1CCCC1 ZINC000805613600 811394552 /nfs/dbraw/zinc/39/45/52/811394552.db2.gz DZTLWOAPZQBZRI-UHFFFAOYSA-N 1 1 349.387 2.259 20 5 EEBDMO CCOC1CC([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000808212944 812535067 /nfs/dbraw/zinc/53/50/67/812535067.db2.gz APLDIHFIFJDSTH-UHFFFAOYSA-N 1 1 331.376 2.310 20 5 EEBDMO CCOC1CC([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000808212944 812535071 /nfs/dbraw/zinc/53/50/71/812535071.db2.gz APLDIHFIFJDSTH-UHFFFAOYSA-N 1 1 331.376 2.310 20 5 EEBDMO C[C@]([NH2+]CCC[NH+]1CCCCC1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593268446 994594378 /nfs/dbraw/zinc/59/43/78/994594378.db2.gz UYVFTUBNWCPSST-QGZVFWFLSA-N 1 1 335.404 2.360 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C(=O)OC[C@@H](C)C[NH+]2CCOCC2)c1C ZINC001516972973 1119020011 /nfs/dbraw/zinc/02/00/11/1119020011.db2.gz KIBGVARYXOGNHV-LBPRGKRZSA-N 1 1 336.388 2.337 20 5 EEBDMO Cc1cc(NC(=O)NCC(C)(C)[NH+]2CCN(C)CC2)cc([N+](=O)[O-])c1 ZINC001517936770 1119048054 /nfs/dbraw/zinc/04/80/54/1119048054.db2.gz NFMCEKRGMSTQDX-UHFFFAOYSA-N 1 1 349.435 2.051 20 5 EEBDMO CC[C@]1(CO)CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000187530737 529424818 /nfs/dbraw/zinc/42/48/18/529424818.db2.gz LQABFLXITVVZQR-KRWDZBQOSA-N 1 1 336.388 2.446 20 5 EEBDMO CC[C@]1(CO)CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000187530737 529424819 /nfs/dbraw/zinc/42/48/19/529424819.db2.gz LQABFLXITVVZQR-KRWDZBQOSA-N 1 1 336.388 2.446 20 5 EEBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000186752978 529902952 /nfs/dbraw/zinc/90/29/52/529902952.db2.gz GQPWGZBPIOZSDU-UHFFFAOYSA-N 1 1 346.431 2.361 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000068008124 215269528 /nfs/dbraw/zinc/26/95/28/215269528.db2.gz VTAHEORYQLNUAK-GFCCVEGCSA-N 1 1 345.403 2.465 20 5 EEBDMO C[C@@H]1CCCC[N@@H+]1CCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000068008124 215269531 /nfs/dbraw/zinc/26/95/31/215269531.db2.gz VTAHEORYQLNUAK-GFCCVEGCSA-N 1 1 345.403 2.465 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000068008124 215269537 /nfs/dbraw/zinc/26/95/37/215269537.db2.gz VTAHEORYQLNUAK-GFCCVEGCSA-N 1 1 345.403 2.465 20 5 EEBDMO C[C@H]1OCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H]1C ZINC000128935784 223002911 /nfs/dbraw/zinc/00/29/11/223002911.db2.gz STLAVGBTXBKCJI-WDEREUQCSA-N 1 1 325.340 2.172 20 5 EEBDMO C[C@H]1OCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H]1C ZINC000128935784 223002914 /nfs/dbraw/zinc/00/29/14/223002914.db2.gz STLAVGBTXBKCJI-WDEREUQCSA-N 1 1 325.340 2.172 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000193723232 240282641 /nfs/dbraw/zinc/28/26/41/240282641.db2.gz HLLDQYOXOWBOLH-NSHDSACASA-N 1 1 347.824 2.011 20 5 EEBDMO CC1(C)C[C@@H](O)CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000451816473 243277221 /nfs/dbraw/zinc/27/72/21/243277221.db2.gz XGFLHDGIXWFXCL-HOTGVXAUSA-N 1 1 347.415 2.183 20 5 EEBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](CCOCC2CCCC2)CC1 ZINC000459513162 245150229 /nfs/dbraw/zinc/15/02/29/245150229.db2.gz RFCJJSIZIJEMIU-UHFFFAOYSA-N 1 1 334.420 2.319 20 5 EEBDMO CCOC[C@@H]1CCCC[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000459698487 245213918 /nfs/dbraw/zinc/21/39/18/245213918.db2.gz CDKWZWRFHIPIDY-INIZCTEOSA-N 1 1 347.415 2.375 20 5 EEBDMO CCOC[C@@H]1CCCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000459698487 245213922 /nfs/dbraw/zinc/21/39/22/245213922.db2.gz CDKWZWRFHIPIDY-INIZCTEOSA-N 1 1 347.415 2.375 20 5 EEBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000265048229 247161338 /nfs/dbraw/zinc/16/13/38/247161338.db2.gz PDLZDTBYFFQEJM-DLBZAZTESA-N 1 1 347.415 2.109 20 5 EEBDMO COC1CCC([N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000265266901 247353959 /nfs/dbraw/zinc/35/39/59/247353959.db2.gz ZPJBBNKMKHGXRS-SIWZUTFBSA-N 1 1 338.404 2.224 20 5 EEBDMO COc1cc(N2CC[NH+](Cc3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000266103714 248099334 /nfs/dbraw/zinc/09/93/34/248099334.db2.gz IIMZFEBZLPCHEH-UHFFFAOYSA-N 1 1 328.372 2.321 20 5 EEBDMO COc1cc(CN2CC[C@@H]3CC[C@H](C2)[N@H+]3C)c([N+](=O)[O-])cc1OC ZINC000093614797 218236717 /nfs/dbraw/zinc/23/67/17/218236717.db2.gz GVJXXRMUPPCZES-UONOGXRCSA-N 1 1 335.404 2.281 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@@H]1CCO ZINC000112583905 220352067 /nfs/dbraw/zinc/35/20/67/220352067.db2.gz PRUBJPBGCPRHLZ-CQSZACIVSA-N 1 1 335.404 2.469 20 5 EEBDMO COCC1=CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000189592433 533160486 /nfs/dbraw/zinc/16/04/86/533160486.db2.gz MOTKQUPZTMPKIW-UHFFFAOYSA-N 1 1 337.351 2.341 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCN(C)c2[nH+]cccc21 ZINC000270699061 256161948 /nfs/dbraw/zinc/16/19/48/256161948.db2.gz ZZBVUZRXOSZKOB-UHFFFAOYSA-N 1 1 341.371 2.193 20 5 EEBDMO C[N@@H+](CCNC(=O)NCCc1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000119027878 221226437 /nfs/dbraw/zinc/22/64/37/221226437.db2.gz HIPIPTBMSCWQIV-UHFFFAOYSA-N 1 1 334.420 2.311 20 5 EEBDMO C[N@@H+]1CC=C(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000273837799 256331805 /nfs/dbraw/zinc/33/18/05/256331805.db2.gz IPCBNVCHHXUNNN-UHFFFAOYSA-N 1 1 335.379 2.390 20 5 EEBDMO CC(C)(C)OC(=O)CC[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000052844731 132186072 /nfs/dbraw/zinc/18/60/72/132186072.db2.gz VRHICYURBPHAMI-UHFFFAOYSA-N 1 1 335.404 2.449 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3cn4ccccc4n3)C2)nc1 ZINC000173467283 152168159 /nfs/dbraw/zinc/16/81/59/152168159.db2.gz BEVMESQKXBUAIS-ZDUSSCGKSA-N 1 1 338.371 2.324 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cn4ccccc4n3)C2)nc1 ZINC000173467283 152168163 /nfs/dbraw/zinc/16/81/63/152168163.db2.gz BEVMESQKXBUAIS-ZDUSSCGKSA-N 1 1 338.371 2.324 20 5 EEBDMO Cc1nc(CC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cs1 ZINC000128780706 292347285 /nfs/dbraw/zinc/34/72/85/292347285.db2.gz WQWDPNMLBUYWQR-GFCCVEGCSA-N 1 1 333.417 2.484 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COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000363179323 466265160 /nfs/dbraw/zinc/26/51/60/466265160.db2.gz JBBQMXSRVSZLET-ZIAGYGMSSA-N 1 1 348.403 2.029 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H]([C@@H](C)O)C2)cccc1[N+](=O)[O-] ZINC000305631937 466412724 /nfs/dbraw/zinc/41/27/24/466412724.db2.gz FZQZTDBXJVNAIK-BFHYXJOUSA-N 1 1 335.404 2.323 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]([C@@H](C)O)C2)cccc1[N+](=O)[O-] ZINC000305631937 466412730 /nfs/dbraw/zinc/41/27/30/466412730.db2.gz FZQZTDBXJVNAIK-BFHYXJOUSA-N 1 1 335.404 2.323 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(c3ncc(Br)cc3[N+](=O)[O-])C[C@@H]2C1 ZINC000312639772 466531700 /nfs/dbraw/zinc/53/17/00/466531700.db2.gz DAWDUSGCHGQNGI-ZJUUUORDSA-N 1 1 341.209 2.140 20 5 EEBDMO Nc1c(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)cc(F)cc1[N+](=O)[O-] ZINC000363688048 466560252 /nfs/dbraw/zinc/56/02/52/466560252.db2.gz BTMKFDSCNKRQSL-NSHDSACASA-N 1 1 336.367 2.063 20 5 EEBDMO CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2cc([O-])ccc2[N+](=O)[O-])C1 ZINC000339009872 466566682 /nfs/dbraw/zinc/56/66/82/466566682.db2.gz LFUOHLBGOTVORK-INIZCTEOSA-N 1 1 337.420 2.233 20 5 EEBDMO CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2cc([O-])ccc2[N+](=O)[O-])C1 ZINC000339009872 466566688 /nfs/dbraw/zinc/56/66/88/466566688.db2.gz LFUOHLBGOTVORK-INIZCTEOSA-N 1 1 337.420 2.233 20 5 EEBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000410853153 466750724 /nfs/dbraw/zinc/75/07/24/466750724.db2.gz JAYGSKZFDGLTIA-PHIMTYICSA-N 1 1 339.367 2.297 20 5 EEBDMO Cc1ccc([C@]2(C)CC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000370028265 466764808 /nfs/dbraw/zinc/76/48/08/466764808.db2.gz CJUPNDZJLRLKRE-ZWKOTPCHSA-N 1 1 344.415 2.124 20 5 EEBDMO CC[C@@H]1COCC[N@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000411273849 466797072 /nfs/dbraw/zinc/79/70/72/466797072.db2.gz OXAQVSANCBBWSX-GFCCVEGCSA-N 1 1 337.376 2.043 20 5 EEBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000370447320 466881971 /nfs/dbraw/zinc/88/19/71/466881971.db2.gz MJHWVSTUDLYZEO-XJKSGUPXSA-N 1 1 328.372 2.235 20 5 EEBDMO O=C1CCC[C@@H]1[C@@H]1COCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000373690310 466889701 /nfs/dbraw/zinc/88/97/01/466889701.db2.gz SPBZKSXSCBDBCN-SJORKVTESA-N 1 1 348.399 2.434 20 5 EEBDMO O=C1CCC[C@@H]1[C@@H]1COCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000373690310 466889706 /nfs/dbraw/zinc/88/97/06/466889706.db2.gz SPBZKSXSCBDBCN-SJORKVTESA-N 1 1 348.399 2.434 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]2C[N@@H+](C)C[C@H]21 ZINC000425627392 467116499 /nfs/dbraw/zinc/11/64/99/467116499.db2.gz VNIKXABTFCTVMZ-SMDDNHRTSA-N 1 1 334.376 2.161 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@@H]2[C@H](O)c2ccccc2)n1 ZINC000377954100 467170516 /nfs/dbraw/zinc/17/05/16/467170516.db2.gz NICSZXVPSDCPTL-NVXWUHKLSA-N 1 1 330.388 2.379 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]([C@H]2CCOC2)C1 ZINC000378236660 467237564 /nfs/dbraw/zinc/23/75/64/467237564.db2.gz PHQWLKPSNIYDOW-RDBSUJKOSA-N 1 1 333.388 2.280 20 5 EEBDMO CCOc1cc(C[N@@H+](C)[C@@H](CO)COC(C)C)ccc1[N+](=O)[O-] ZINC000433156680 467300065 /nfs/dbraw/zinc/30/00/65/467300065.db2.gz KBMQCWULKLAKAJ-AWEZNQCLSA-N 1 1 326.393 2.211 20 5 EEBDMO CCCNC(=O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000430221751 467410336 /nfs/dbraw/zinc/41/03/36/467410336.db2.gz DTFCIVUZQDGTSJ-AWEZNQCLSA-N 1 1 335.404 2.342 20 5 EEBDMO CNc1ccc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000391660555 467421442 /nfs/dbraw/zinc/42/14/42/467421442.db2.gz KCOJJTYYKCQYRT-DZGCQCFKSA-N 1 1 332.404 2.193 20 5 EEBDMO NC(=O)c1cccc([N+](=O)[O-])c1NCC[N@H+]1CCc2ccccc2C1 ZINC000420591794 467430619 /nfs/dbraw/zinc/43/06/19/467430619.db2.gz XWVPDTCLJLGOLX-UHFFFAOYSA-N 1 1 340.383 2.164 20 5 EEBDMO C[C@H]1CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@@H]1[NH3+] ZINC000430934337 467478132 /nfs/dbraw/zinc/47/81/32/467478132.db2.gz LRRAYKMWXZFNQZ-WFASDCNBSA-N 1 1 330.388 2.461 20 5 EEBDMO CNc1nc(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000454709297 467611193 /nfs/dbraw/zinc/61/11/93/467611193.db2.gz HKXGCERQVZQUBS-VXGBXAGGSA-N 1 1 335.408 2.024 20 5 EEBDMO CC(C)[NH+]1CC(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000457718621 467687747 /nfs/dbraw/zinc/68/77/47/467687747.db2.gz KAINWWIYOFJVLI-UHFFFAOYSA-N 1 1 341.795 2.226 20 5 EEBDMO CCN1CCN(CC(C)(C)[NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000449744365 467705027 /nfs/dbraw/zinc/70/50/27/467705027.db2.gz GOURASOZFUAJNQ-UHFFFAOYSA-N 1 1 326.466 2.162 20 5 EEBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@@H](N2CCOCC2)C1 ZINC000493211817 467862744 /nfs/dbraw/zinc/86/27/44/467862744.db2.gz STSCHPJGWUYIQG-GFCCVEGCSA-N 1 1 325.796 2.155 20 5 EEBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@H](N2CCOCC2)C1 ZINC000493211817 467862748 /nfs/dbraw/zinc/86/27/48/467862748.db2.gz STSCHPJGWUYIQG-GFCCVEGCSA-N 1 1 325.796 2.155 20 5 EEBDMO CCOC(=O)c1ccnc(N2CC[N@H+](C3CC3)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000450547610 467868648 /nfs/dbraw/zinc/86/86/48/467868648.db2.gz ODPRQZBTASNWLJ-LBPRGKRZSA-N 1 1 348.403 2.087 20 5 EEBDMO CCC(=O)c1ccc(NC[C@@H]2CCC[N@H+]2CCCO)c([N+](=O)[O-])c1 ZINC000450602044 467878146 /nfs/dbraw/zinc/87/81/46/467878146.db2.gz ZORIMMCWPVOFGM-AWEZNQCLSA-N 1 1 335.404 2.446 20 5 EEBDMO C[C@H](O)CCC[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000450739773 467899484 /nfs/dbraw/zinc/89/94/84/467899484.db2.gz RNFHOQNCDJIIHE-ZDUSSCGKSA-N 1 1 347.419 2.144 20 5 EEBDMO C[C@H]1[C@@H](NC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)CCC[N@H+]1C ZINC000450789392 467908481 /nfs/dbraw/zinc/90/84/81/467908481.db2.gz GJXWYVOOLJNDDC-FZMZJTMJSA-N 1 1 343.387 2.197 20 5 EEBDMO CNc1ccc(C(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000532057240 468093567 /nfs/dbraw/zinc/09/35/67/468093567.db2.gz YSDWGLQVGVJTAJ-CYBMUJFWSA-N 1 1 334.420 2.344 20 5 EEBDMO C[C@H]1[C@H](CO)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000488761108 468103380 /nfs/dbraw/zinc/10/33/80/468103380.db2.gz FSTNYYYYGPTDDR-JSGCOSHPSA-N 1 1 331.372 2.495 20 5 EEBDMO CC(C)[C@@H]1CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000489316970 468127239 /nfs/dbraw/zinc/12/72/39/468127239.db2.gz ALASAKKPPAMPQL-HNNXBMFYSA-N 1 1 337.445 2.486 20 5 EEBDMO NC(=O)c1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC000532650759 468129648 /nfs/dbraw/zinc/12/96/48/468129648.db2.gz QQVSLOQFUFKQOO-HNNXBMFYSA-N 1 1 326.356 2.426 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC000532650759 468129651 /nfs/dbraw/zinc/12/96/51/468129651.db2.gz QQVSLOQFUFKQOO-HNNXBMFYSA-N 1 1 326.356 2.426 20 5 EEBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594200392 468510389 /nfs/dbraw/zinc/51/03/89/468510389.db2.gz LSDWZZMCLQUUMR-CABCVRRESA-N 1 1 347.415 2.497 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1[C@@H]2CC[C@H]1CCN(C)C2 ZINC000582615392 468567146 /nfs/dbraw/zinc/56/71/46/468567146.db2.gz VNJSCDIGZHTSFY-GOEBONIOSA-N 1 1 346.431 2.400 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1[C@@H]2CC[C@H]1CC[N@@H+](C)C2 ZINC000582615392 468567151 /nfs/dbraw/zinc/56/71/51/468567151.db2.gz VNJSCDIGZHTSFY-GOEBONIOSA-N 1 1 346.431 2.400 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC000582615392 468567153 /nfs/dbraw/zinc/56/71/53/468567153.db2.gz VNJSCDIGZHTSFY-GOEBONIOSA-N 1 1 346.431 2.400 20 5 EEBDMO CCCc1[nH]nc(C(=O)N2CC[NH+](C(C)(C)CC)CC2)c1[N+](=O)[O-] ZINC000594390419 468570117 /nfs/dbraw/zinc/57/01/17/468570117.db2.gz WNOVODDWSMXWFI-UHFFFAOYSA-N 1 1 337.424 2.217 20 5 EEBDMO Nc1c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc(F)cc1[N+](=O)[O-] ZINC000594418561 468579709 /nfs/dbraw/zinc/57/97/09/468579709.db2.gz KDNJFASVYGAOGC-STQMWFEESA-N 1 1 336.367 2.063 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c1 ZINC000597854996 468694021 /nfs/dbraw/zinc/69/40/21/468694021.db2.gz OSLXLMHIPFJVPA-LBPRGKRZSA-N 1 1 335.404 2.454 20 5 EEBDMO COc1ccc(CC(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000597860959 468696921 /nfs/dbraw/zinc/69/69/21/468696921.db2.gz QGZSWYYNFFXYKF-AWEZNQCLSA-N 1 1 349.431 2.383 20 5 EEBDMO Cc1cc(OCC(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000597920413 468711952 /nfs/dbraw/zinc/71/19/52/468711952.db2.gz BPXHVGZUKZMREH-CYBMUJFWSA-N 1 1 335.404 2.271 20 5 EEBDMO C[C@H]([NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C1(CO)CC1 ZINC000595071471 468753202 /nfs/dbraw/zinc/75/32/02/468753202.db2.gz ZUXDJAICJHBWCU-SWLSCSKDSA-N 1 1 330.388 2.168 20 5 EEBDMO CS(=O)(=O)[C@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601144789 468759152 /nfs/dbraw/zinc/75/91/52/468759152.db2.gz WUSJNZNOPKREIX-LBPRGKRZSA-N 1 1 335.385 2.156 20 5 EEBDMO CN(C)C(=O)N[C@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601171360 468769612 /nfs/dbraw/zinc/76/96/12/468769612.db2.gz JSRYELXLXSMKST-LBPRGKRZSA-N 1 1 343.387 2.383 20 5 EEBDMO CC(C)(O)C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C1CCOCC1 ZINC000595333053 468814647 /nfs/dbraw/zinc/81/46/47/468814647.db2.gz AEVJQSSERNOEDE-UHFFFAOYSA-N 1 1 326.368 2.486 20 5 EEBDMO Cc1noc(C[N@@H+]2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c1[N+](=O)[O-] ZINC000595405327 468840351 /nfs/dbraw/zinc/84/03/51/468840351.db2.gz WACWBJGUVJZLBC-LLVKDONJSA-N 1 1 332.364 2.266 20 5 EEBDMO Cc1noc(C[N@H+]2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c1[N+](=O)[O-] ZINC000595405327 468840357 /nfs/dbraw/zinc/84/03/57/468840357.db2.gz WACWBJGUVJZLBC-LLVKDONJSA-N 1 1 332.364 2.266 20 5 EEBDMO COC(=O)[C@H](Cc1ccccc1)[C@@H](C)[NH2+]Cc1onc(C)c1[N+](=O)[O-] ZINC000595476307 468869418 /nfs/dbraw/zinc/86/94/18/468869418.db2.gz NDVQKFICAOOSHH-BXUZGUMPSA-N 1 1 347.371 2.401 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H](C)[C@@H]1CCO ZINC000595694757 468958502 /nfs/dbraw/zinc/95/85/02/468958502.db2.gz FNQZKWATUODFEI-OCCSQVGLSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H](C)[C@@H]1CCO ZINC000595694757 468958508 /nfs/dbraw/zinc/95/85/08/468958508.db2.gz FNQZKWATUODFEI-OCCSQVGLSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cccc(C[N@@H+]2CC[C@@H](NC(=O)c3ccc([N+](=O)[O-])n3C)C2)c1 ZINC000601851584 469057396 /nfs/dbraw/zinc/05/73/96/469057396.db2.gz UFWIMNHXTYBCEB-OAHLLOKOSA-N 1 1 342.399 2.246 20 5 EEBDMO CC(=O)Nc1cccc2c1CC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])C2 ZINC000602767771 469061258 /nfs/dbraw/zinc/06/12/58/469061258.db2.gz JDLRYLGCCCFRKG-UHFFFAOYSA-N 1 1 343.387 2.116 20 5 EEBDMO CC(=O)Nc1cccc2c1CC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C2 ZINC000602767771 469061262 /nfs/dbraw/zinc/06/12/62/469061262.db2.gz JDLRYLGCCCFRKG-UHFFFAOYSA-N 1 1 343.387 2.116 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H](c2nncn2C(C)C)C1 ZINC000602800252 469083697 /nfs/dbraw/zinc/08/36/97/469083697.db2.gz XLCLKCQUCAQDGD-CQSZACIVSA-N 1 1 347.423 2.152 20 5 EEBDMO COc1cc(C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C2CC2)ccc1O ZINC000602798574 469084332 /nfs/dbraw/zinc/08/43/32/469084332.db2.gz LKVWSEJPZMGJEL-UHFFFAOYSA-N 1 1 346.387 2.479 20 5 EEBDMO O=C(CC[NH2+][C@@H]1CCCc2c[nH]nc21)Nc1ccccc1[N+](=O)[O-] ZINC000573236554 469089777 /nfs/dbraw/zinc/08/97/77/469089777.db2.gz DKQRFDAFTRWTMZ-CYBMUJFWSA-N 1 1 329.360 2.314 20 5 EEBDMO C[N@H+]1CCCC[C@H]1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000602110162 469194218 /nfs/dbraw/zinc/19/42/18/469194218.db2.gz YLVSJKGUHRCPLR-KRWDZBQOSA-N 1 1 347.415 2.449 20 5 EEBDMO C[N@H+]1CCC[C@H](N2CCN(C/C=C\c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000611270936 469215768 /nfs/dbraw/zinc/21/57/68/469215768.db2.gz UREYHTSPRSQEDE-GINYUPMKSA-N 1 1 344.459 2.320 20 5 EEBDMO O=[N+]([O-])c1ccc2ccnc(N3CCC[C@@H]([NH+]4CCOCC4)C3)c2c1 ZINC000596246484 469219232 /nfs/dbraw/zinc/21/92/32/469219232.db2.gz GDFSTYJKZTYKQW-MRXNPFEDSA-N 1 1 342.399 2.444 20 5 EEBDMO CCc1[nH+]ccn1Cc1cn(CCc2ccc([N+](=O)[O-])cc2)nn1 ZINC000603195402 469305346 /nfs/dbraw/zinc/30/53/46/469305346.db2.gz IRUPJVVQGIXQEE-UHFFFAOYSA-N 1 1 326.360 2.236 20 5 EEBDMO C[C@H]1CC(F)(F)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000599624074 469313698 /nfs/dbraw/zinc/31/36/98/469313698.db2.gz QJOAZASQPONZBJ-AAEUAGOBSA-N 1 1 330.331 2.454 20 5 EEBDMO CC(C)N1CCC([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CC1 ZINC000602502671 469341583 /nfs/dbraw/zinc/34/15/83/469341583.db2.gz MVFJNDORWXNYAZ-UHFFFAOYSA-N 1 1 347.463 2.421 20 5 EEBDMO O=[N+]([O-])c1ccc(CC[NH2+]C2CCN([C@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000602569315 469365583 /nfs/dbraw/zinc/36/55/83/469365583.db2.gz PSCLFLBDDOJGMN-OALUTQOASA-N 1 1 347.459 2.495 20 5 EEBDMO Cc1nnc(CC[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)[nH]1 ZINC000602600219 469379685 /nfs/dbraw/zinc/37/96/85/469379685.db2.gz UNJYMZDPRCREGG-UHFFFAOYSA-N 1 1 346.210 2.178 20 5 EEBDMO Cc1nc(CC[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)n[nH]1 ZINC000602600219 469379676 /nfs/dbraw/zinc/37/96/76/469379676.db2.gz UNJYMZDPRCREGG-UHFFFAOYSA-N 1 1 346.210 2.178 20 5 EEBDMO O=[N+]([O-])c1cccc(OCCN2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c1 ZINC000603662393 469422293 /nfs/dbraw/zinc/42/22/93/469422293.db2.gz WYGZCOIFZLMVJA-SFHVURJKSA-N 1 1 349.431 2.160 20 5 EEBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000610430480 470014346 /nfs/dbraw/zinc/01/43/46/470014346.db2.gz YSJNRRDZPPBMRR-AWEZNQCLSA-N 1 1 332.404 2.102 20 5 EEBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[N@H+]1CCCOCC1 ZINC000191337159 534055170 /nfs/dbraw/zinc/05/51/70/534055170.db2.gz RMLOGFCXPCJXKH-UHFFFAOYSA-N 1 1 336.392 2.055 20 5 EEBDMO CCC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCOC ZINC000130949067 527783199 /nfs/dbraw/zinc/78/31/99/527783199.db2.gz DJVRWIWLMZVXOP-MRXNPFEDSA-N 1 1 335.404 2.168 20 5 EEBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000183912860 528439614 /nfs/dbraw/zinc/43/96/14/528439614.db2.gz HDXWDGKNMNLJJL-CQSZACIVSA-N 1 1 345.403 2.204 20 5 EEBDMO CC(C)[C@@H](C[N@H+](C)Cc1ccccc1)NC(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000183912860 528439617 /nfs/dbraw/zinc/43/96/17/528439617.db2.gz HDXWDGKNMNLJJL-CQSZACIVSA-N 1 1 345.403 2.204 20 5 EEBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000183912860 528439621 /nfs/dbraw/zinc/43/96/21/528439621.db2.gz HDXWDGKNMNLJJL-CQSZACIVSA-N 1 1 345.403 2.204 20 5 EEBDMO CC[C@H]1C[N@@H+](CC)CCN1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000451728148 536140590 /nfs/dbraw/zinc/14/05/90/536140590.db2.gz DULCOXBMZRTJEL-AWEZNQCLSA-N 1 1 334.420 2.258 20 5 EEBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)[C@@H]2C1 ZINC000425048710 536488136 /nfs/dbraw/zinc/48/81/36/536488136.db2.gz CLNUDHDIFNQSDJ-XHDPSFHLSA-N 1 1 328.372 2.242 20 5 EEBDMO CC[C@@H]1CCC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000726586280 576277922 /nfs/dbraw/zinc/27/79/22/576277922.db2.gz JDCGZGQHTOMHLD-CYBMUJFWSA-N 1 1 346.387 2.443 20 5 EEBDMO CC[C@@H]1CCC[N@H+]1CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000727823770 576451646 /nfs/dbraw/zinc/45/16/46/576451646.db2.gz KIYFERMXSKFWCU-DYVFJYSZSA-N 1 1 346.387 2.194 20 5 EEBDMO CC[C@@H](C)C[N@@H+](C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000732182098 577153404 /nfs/dbraw/zinc/15/34/04/577153404.db2.gz CVCXMPWIQMIYPL-PXAZEXFGSA-N 1 1 348.403 2.297 20 5 EEBDMO C[N@@H+](CCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1)C1CCCC1 ZINC000771510046 577216535 /nfs/dbraw/zinc/21/65/35/577216535.db2.gz RDWHBRNDJGJHRC-UHFFFAOYSA-N 1 1 349.416 2.204 20 5 EEBDMO COc1ccc(C[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1O ZINC000776590531 577463599 /nfs/dbraw/zinc/46/35/99/577463599.db2.gz DUGXLAXRVQGOTN-INIZCTEOSA-N 1 1 332.356 2.474 20 5 EEBDMO Cc1nn(C[N@H+](C)CCc2cnccn2)c2cc([N+](=O)[O-])ccc12 ZINC000770662012 577601029 /nfs/dbraw/zinc/60/10/29/577601029.db2.gz ODGKJNJCWWUUKA-UHFFFAOYSA-N 1 1 326.360 2.175 20 5 EEBDMO Cc1nn(C[N@@H+](C)CCc2cnccn2)c2cc([N+](=O)[O-])ccc12 ZINC000770662012 577601030 /nfs/dbraw/zinc/60/10/30/577601030.db2.gz ODGKJNJCWWUUKA-UHFFFAOYSA-N 1 1 326.360 2.175 20 5 EEBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000761130248 577677618 /nfs/dbraw/zinc/67/76/18/577677618.db2.gz QIJHUTPYRQPQAQ-GFCCVEGCSA-N 1 1 330.388 2.219 20 5 EEBDMO C[C@@H](O)C[C@@H]1CCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000752143217 577766678 /nfs/dbraw/zinc/76/66/78/577766678.db2.gz MVGCDSBMJRLLBL-PWSUYJOCSA-N 1 1 341.795 2.422 20 5 EEBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000752143217 577766679 /nfs/dbraw/zinc/76/66/79/577766679.db2.gz MVGCDSBMJRLLBL-PWSUYJOCSA-N 1 1 341.795 2.422 20 5 EEBDMO CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)OCc1ccccc1[N+](=O)[O-] ZINC000748468499 577962486 /nfs/dbraw/zinc/96/24/86/577962486.db2.gz HGUWPQQUZQGPCV-MRXNPFEDSA-N 1 1 336.388 2.431 20 5 EEBDMO CC(C)[C@@H](C(=O)OCC(=O)c1cccc([N+](=O)[O-])c1)[NH+]1CCCC1 ZINC000741015015 578111068 /nfs/dbraw/zinc/11/10/68/578111068.db2.gz VKSBLKSQLLWOIS-INIZCTEOSA-N 1 1 334.372 2.441 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1ccc(-c2nn[nH]n2)o1 ZINC000826497842 609346858 /nfs/dbraw/zinc/34/68/58/609346858.db2.gz WIJRABJFEUGURS-UHFFFAOYSA-N 1 1 348.750 2.354 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(O)c(OC)c2[N+](=O)[O-])[C@H](C)C1 ZINC000892106469 678010396 /nfs/dbraw/zinc/01/03/96/678010396.db2.gz VVWMDNNCUICVRS-OCCSQVGLSA-N 1 1 337.420 2.471 20 5 EEBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)c1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000892840549 683124899 /nfs/dbraw/zinc/12/48/99/683124899.db2.gz PZASTJJIKKJPNC-JSGCOSHPSA-N 1 1 344.415 2.223 20 5 EEBDMO COc1c(O)ccc(C[NH2+][C@@H](CC(C)C)CN(C)C)c1[N+](=O)[O-] ZINC000892930148 683205889 /nfs/dbraw/zinc/20/58/89/683205889.db2.gz NEJHILMEQQERHG-ZDUSSCGKSA-N 1 1 325.409 2.375 20 5 EEBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000895191058 684265364 /nfs/dbraw/zinc/26/53/64/684265364.db2.gz DLOYQDVBRAWMGQ-QWHCGFSZSA-N 1 1 330.388 2.152 20 5 EEBDMO COC1CC[NH+](CCNCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000893360971 684898377 /nfs/dbraw/zinc/89/83/77/684898377.db2.gz HGXUKMYYFYMGAG-UHFFFAOYSA-N 1 1 327.812 2.449 20 5 EEBDMO C[N@@H+](CC1CC2(CCC2)C1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964285 688717268 /nfs/dbraw/zinc/71/72/68/688717268.db2.gz CXNMMRYHUWYGDZ-IAGOWNOFSA-N 1 1 349.475 2.402 20 5 EEBDMO C[N@H+](CC1CC2(CCC2)C1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964285 688717270 /nfs/dbraw/zinc/71/72/70/688717270.db2.gz CXNMMRYHUWYGDZ-IAGOWNOFSA-N 1 1 349.475 2.402 20 5 EEBDMO C[N@@H+](CC1CC2(CCC2)C1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964285 688717272 /nfs/dbraw/zinc/71/72/72/688717272.db2.gz CXNMMRYHUWYGDZ-IAGOWNOFSA-N 1 1 349.475 2.402 20 5 EEBDMO O=C(Cc1ccc[nH]1)N1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000989704419 692195059 /nfs/dbraw/zinc/19/50/59/692195059.db2.gz ZZGPNDVFQIXTIV-UHFFFAOYSA-N 1 1 342.399 2.200 20 5 EEBDMO O=C(Cc1ccc[nH]1)N1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000989704419 692195064 /nfs/dbraw/zinc/19/50/64/692195064.db2.gz ZZGPNDVFQIXTIV-UHFFFAOYSA-N 1 1 342.399 2.200 20 5 EEBDMO Cc1ncc(C(=O)N2CCC([NH2+]Cc3csc([N+](=O)[O-])c3)CC2)[nH]1 ZINC000990278972 692805013 /nfs/dbraw/zinc/80/50/13/692805013.db2.gz SYLDOKFJENMTCA-UHFFFAOYSA-N 1 1 349.416 2.082 20 5 EEBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC(=O)NCC(F)F ZINC000872068905 1198039736 /nfs/dbraw/zinc/03/97/36/1198039736.db2.gz KOUDKGYBRPGTST-QMMMGPOBSA-N 1 1 333.360 2.349 20 5 EEBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@H](CO)[C@H](CO)C2)s1 ZINC000877764388 1200079264 /nfs/dbraw/zinc/07/92/64/1200079264.db2.gz CTBGAHYRMWAPAW-BETUJISGSA-N 1 1 348.424 2.356 20 5 EEBDMO CNC(=O)C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000877773044 1200085563 /nfs/dbraw/zinc/08/55/63/1200085563.db2.gz YXKGYYCWVGYAGL-UHFFFAOYSA-N 1 1 327.384 2.386 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCCC[C@H]1O ZINC000879142655 1200886768 /nfs/dbraw/zinc/88/67/68/1200886768.db2.gz ZMVOWVSMCFFBJE-TZMCWYRMSA-N 1 1 341.795 2.422 20 5 EEBDMO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC([NH+]2CCN(C)CC2)CC1 ZINC000866212961 1201466942 /nfs/dbraw/zinc/46/69/42/1201466942.db2.gz LMFBQJBAKMKKOI-UHFFFAOYSA-N 1 1 346.431 2.014 20 5 EEBDMO CC(=O)N1C[C@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C[C@H]2C1 ZINC000882848556 1201956674 /nfs/dbraw/zinc/95/66/74/1201956674.db2.gz LIFDQWHYSWTMTE-BETUJISGSA-N 1 1 326.356 2.058 20 5 EEBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC000886600602 1202530992 /nfs/dbraw/zinc/53/09/92/1202530992.db2.gz YEZIUZWTRFYDII-CQSZACIVSA-N 1 1 337.395 2.465 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NCCCN(C)c1ccc([N+](=O)[O-])cc1 ZINC001095674178 1205910845 /nfs/dbraw/zinc/91/08/45/1205910845.db2.gz GGEXOXSICNIBJZ-UHFFFAOYSA-N 1 1 336.436 2.268 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000778268598 1208027656 /nfs/dbraw/zinc/02/76/56/1208027656.db2.gz GGOVKRNLGCOGIW-NSHDSACASA-N 1 1 349.416 2.204 20 5 EEBDMO Cc1cc(C)cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)N3C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1 ZINC001017544145 1227506757 /nfs/dbraw/zinc/50/67/57/1227506757.db2.gz LYYDVGSIVMBMOG-XMTFNYHQSA-N 1 1 343.427 2.144 20 5 EEBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050326340 1243352331 /nfs/dbraw/zinc/35/23/31/1243352331.db2.gz YAPZGONPKLXCKU-QBPKDAKJSA-N 1 1 331.416 2.116 20 5 EEBDMO O=C(C(F)F)N1CC2(C1)CC[NH+](Cc1csc([N+](=O)[O-])c1)CC2 ZINC001050398119 1243507302 /nfs/dbraw/zinc/50/73/02/1243507302.db2.gz MOLMXAWMAQJNDC-UHFFFAOYSA-N 1 1 345.371 2.346 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC001097211892 1243833228 /nfs/dbraw/zinc/83/32/28/1243833228.db2.gz ICYMZEABJWWZIN-TXEJJXNPSA-N 1 1 338.383 2.135 20 5 EEBDMO O=c1cc(O[C@H]2CC[NH2+]CC2(F)F)c2cc([N+](=O)[O-])ccc2[nH]1 ZINC001218005384 1297546128 /nfs/dbraw/zinc/54/61/28/1297546128.db2.gz FIMSUPBDURPGLX-LBPRGKRZSA-N 1 1 325.271 2.225 20 5 EEBDMO [NH3+][C@H]1CN(C(F)(F)c2ccc([N+](=O)[O-])c(Cl)n2)CCC1(F)F ZINC001164319335 1321350833 /nfs/dbraw/zinc/35/08/33/1321350833.db2.gz CURJAINLBMCWOH-ZETCQYMHSA-N 1 1 342.680 2.361 20 5 EEBDMO C[C@@H](O)[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000852559281 1292133627 /nfs/dbraw/zinc/13/36/27/1292133627.db2.gz IJEBYVXCSUBUCX-BXKDBHETSA-N 1 1 327.768 2.032 20 5 EEBDMO C[C@@H](O)[C@H]1CCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000852559281 1292133630 /nfs/dbraw/zinc/13/36/30/1292133630.db2.gz IJEBYVXCSUBUCX-BXKDBHETSA-N 1 1 327.768 2.032 20 5 EEBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@@H+](C)C1 ZINC000862789292 1295962080 /nfs/dbraw/zinc/96/20/80/1295962080.db2.gz KAWFOLFJCQODOY-ZDUSSCGKSA-N 1 1 334.420 2.123 20 5 EEBDMO CC(C)(C[NH2+]C/C=C/Cl)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001101541417 1299685547 /nfs/dbraw/zinc/68/55/47/1299685547.db2.gz DWXWTXUVMHGWMB-HNCOSLNKSA-N 1 1 343.855 2.259 20 5 EEBDMO Cc1cnc(C(=O)NCCC[N@@H+](C)Cc2csc([N+](=O)[O-])c2)cn1 ZINC001231408323 1303782336 /nfs/dbraw/zinc/78/23/36/1303782336.db2.gz BCNYGFIFTOKZFZ-UHFFFAOYSA-N 1 1 349.416 2.007 20 5 EEBDMO Cc1cnc(C(=O)NCCC[N@H+](C)Cc2csc([N+](=O)[O-])c2)cn1 ZINC001231408323 1303782339 /nfs/dbraw/zinc/78/23/39/1303782339.db2.gz BCNYGFIFTOKZFZ-UHFFFAOYSA-N 1 1 349.416 2.007 20 5 EEBDMO CC(=O)NC1CCC([N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000784542083 1304497832 /nfs/dbraw/zinc/49/78/32/1304497832.db2.gz PDQFNMLNFOVZFU-DQPZFDDXSA-N 1 1 335.404 2.007 20 5 EEBDMO CCOC(=O)C[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001117094103 1305987935 /nfs/dbraw/zinc/98/79/35/1305987935.db2.gz JWPTWMAZCIIKGQ-LBPRGKRZSA-N 1 1 337.332 2.421 20 5 EEBDMO CCOC(=O)C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001117094103 1305987938 /nfs/dbraw/zinc/98/79/38/1305987938.db2.gz JWPTWMAZCIIKGQ-LBPRGKRZSA-N 1 1 337.332 2.421 20 5 EEBDMO COc1ccc(C[C@H](C)[N@@H+]2CC[C@@H](N)[C@H](F)CC2)c([N+](=O)[O-])c1 ZINC001246584320 1310348551 /nfs/dbraw/zinc/34/85/51/1310348551.db2.gz IYRRXTJXXKZBHV-NILFDRSVSA-N 1 1 325.384 2.296 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](N)[C@H](F)CC2)c([N+](=O)[O-])c1 ZINC001246584320 1310348566 /nfs/dbraw/zinc/34/85/66/1310348566.db2.gz IYRRXTJXXKZBHV-NILFDRSVSA-N 1 1 325.384 2.296 20 5 EEBDMO O=[N+]([O-])c1ccc(OCC[NH+]2CCN(c3cccc(F)n3)CC2)cc1 ZINC000831477985 1314593864 /nfs/dbraw/zinc/59/38/64/1314593864.db2.gz SFJRKHVHROJAIS-UHFFFAOYSA-N 1 1 346.362 2.330 20 5 EEBDMO O=C1C[C@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000840036608 1315279708 /nfs/dbraw/zinc/27/97/08/1315279708.db2.gz SOTLJEVSAOXGAC-GUYCJALGSA-N 1 1 331.372 2.221 20 5 EEBDMO COC[C@@]1(C)CC[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000840107699 1315296714 /nfs/dbraw/zinc/29/67/14/1315296714.db2.gz ZURYOWWMLHGKBS-KRWDZBQOSA-N 1 1 348.403 2.153 20 5 EEBDMO COC[C@@]1(C)CC[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000840107699 1315296718 /nfs/dbraw/zinc/29/67/18/1315296718.db2.gz ZURYOWWMLHGKBS-KRWDZBQOSA-N 1 1 348.403 2.153 20 5 EEBDMO COc1cc(N2CCC([N@H+]3C[C@H]4CC[C@@H]3CO4)CC2)ccc1[N+](=O)[O-] ZINC001256104149 1318649012 /nfs/dbraw/zinc/64/90/12/1318649012.db2.gz XMBGBFAPYYQQLZ-HZPDHXFCSA-N 1 1 347.415 2.435 20 5 EEBDMO Cc1cc(NC(=N)N2CC[NH+](C)CC2)nc2ccc([N+](=O)[O-])cc12 ZINC001157915117 1318928286 /nfs/dbraw/zinc/92/82/86/1318928286.db2.gz QAUVRDKNCGXICA-UHFFFAOYSA-N 1 1 328.376 2.045 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](Nc2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])[C@@H](C)C1 ZINC001163366702 1321106429 /nfs/dbraw/zinc/10/64/29/1321106429.db2.gz WJEHZYBPBZIMER-CMPLNLGQSA-N 1 1 328.800 2.412 20 5 EEBDMO C[NH+](C)/C=C/c1cc(N2CCC[C@@](O)(CF)CC2)ncc1[N+](=O)[O-] ZINC001164087350 1321287619 /nfs/dbraw/zinc/28/76/19/1321287619.db2.gz LPDSUKOOSBPDNH-YCOJEUHLSA-N 1 1 338.383 2.213 20 5 EEBDMO Nc1cc(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)ncc1[N+](=O)[O-] ZINC001165084520 1321451695 /nfs/dbraw/zinc/45/16/95/1321451695.db2.gz LEOHZXRQSOUXPM-PBHICJAKSA-N 1 1 339.399 2.283 20 5 EEBDMO CC[N@H+]1CCN(c2cc(/C=C\N(C)C)c([N+](=O)[O-])cn2)C(C)(C)C1 ZINC001165200766 1321470896 /nfs/dbraw/zinc/47/08/96/1321470896.db2.gz AFGPIJIYCHFHGG-FPLPWBNLSA-N 1 1 333.436 2.443 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@](CO)(C(C)C)C1 ZINC000351925518 1321933816 /nfs/dbraw/zinc/93/38/16/1321933816.db2.gz LHJIPQNSWMPYHH-KRWDZBQOSA-N 1 1 335.404 2.182 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@](CO)(C(C)C)C1 ZINC000351925518 1321933818 /nfs/dbraw/zinc/93/38/18/1321933818.db2.gz LHJIPQNSWMPYHH-KRWDZBQOSA-N 1 1 335.404 2.182 20 5 EEBDMO COC(=O)[C@H]1CCC[C@@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC001320947440 1332984717 /nfs/dbraw/zinc/98/47/17/1332984717.db2.gz YHDFKUVNTOLUQM-STQMWFEESA-N 1 1 346.343 2.076 20 5 EEBDMO C[N@H+](CCC(F)(F)F)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001609274492 1351917777 /nfs/dbraw/zinc/91/77/77/1351917777.db2.gz QNEJQVKMADEXEZ-UHFFFAOYSA-N 1 1 330.270 2.159 20 5 EEBDMO C[N@@H+](CCC(F)(F)F)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001609274492 1351917778 /nfs/dbraw/zinc/91/77/78/1351917778.db2.gz QNEJQVKMADEXEZ-UHFFFAOYSA-N 1 1 330.270 2.159 20 5 EEBDMO C[N@H+]1CCCC[C@H](CNC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001328814252 1334528485 /nfs/dbraw/zinc/52/84/85/1334528485.db2.gz DUQVMWMTAHMIBH-CYBMUJFWSA-N 1 1 332.404 2.352 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H](O)CC1(O)CCCCC1)CC2 ZINC001331098617 1334962896 /nfs/dbraw/zinc/96/28/96/1334962896.db2.gz OFMHPUUJNFOHGA-QGZVFWFLSA-N 1 1 334.416 2.399 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@H](O)CC1(O)CCCCC1)CC2 ZINC001331098617 1334962898 /nfs/dbraw/zinc/96/28/98/1334962898.db2.gz OFMHPUUJNFOHGA-QGZVFWFLSA-N 1 1 334.416 2.399 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC001336804608 1336597646 /nfs/dbraw/zinc/59/76/46/1336597646.db2.gz NJLLYKKYIIIUEJ-MAUKXSAKSA-N 1 1 333.432 2.340 20 5 EEBDMO O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC001336804608 1336597648 /nfs/dbraw/zinc/59/76/48/1336597648.db2.gz NJLLYKKYIIIUEJ-MAUKXSAKSA-N 1 1 333.432 2.340 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC001336804610 1336597807 /nfs/dbraw/zinc/59/78/07/1336597807.db2.gz NJLLYKKYIIIUEJ-YJBOKZPZSA-N 1 1 333.432 2.340 20 5 EEBDMO O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC001336804610 1336597810 /nfs/dbraw/zinc/59/78/10/1336597810.db2.gz NJLLYKKYIIIUEJ-YJBOKZPZSA-N 1 1 333.432 2.340 20 5 EEBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001339467610 1337009708 /nfs/dbraw/zinc/00/97/08/1337009708.db2.gz ORDDYQJEHZRZFJ-GZBFAFLISA-N 1 1 348.451 2.089 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNc1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1 ZINC001590731778 1349393392 /nfs/dbraw/zinc/39/33/92/1349393392.db2.gz BCLMNZUPIAYYAN-LBPRGKRZSA-N 1 1 331.380 2.061 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC001593479931 1349812962 /nfs/dbraw/zinc/81/29/62/1349812962.db2.gz CLDSYFPTJZEQNT-CHWSQXEVSA-N 1 1 343.391 2.204 20 5 EEBDMO Cc1noc(CON=C(N)C[N@@H+]2[C@H](C)CCC[C@@H]2C)c1[N+](=O)[O-] ZINC000853699821 1369369328 /nfs/dbraw/zinc/36/93/28/1369369328.db2.gz PABQPGXLPTUTQL-AOOOYVTPSA-N 1 1 325.369 2.153 20 5 EEBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)OCC[NH+]1CCC1 ZINC000861387940 1369494012 /nfs/dbraw/zinc/49/40/12/1369494012.db2.gz DXIMBFLVJFYCTN-UHFFFAOYSA-N 1 1 340.401 2.196 20 5 EEBDMO Cc1cc(C(=O)N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(N)c([N+](=O)[O-])c1 ZINC000286338002 1369749688 /nfs/dbraw/zinc/74/96/88/1369749688.db2.gz VTTDTRWAFDLCPN-FUNVUKJBSA-N 1 1 332.404 2.183 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@]2(C)C[N@@H+](C)C[C@]2(C)C1 ZINC000931308751 1369887836 /nfs/dbraw/zinc/88/78/36/1369887836.db2.gz VBSTWRSMICKCIN-XWIAVFTESA-N 1 1 346.431 2.195 20 5 EEBDMO CC1([C@H]2CCC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)OCCO1 ZINC000784570253 1371419657 /nfs/dbraw/zinc/41/96/57/1371419657.db2.gz DBWJWCQSOVXLFE-HOCLYGCPSA-N 1 1 336.388 2.103 20 5 EEBDMO C/C(=C\C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21)C1CC1 ZINC001752842931 1406477227 /nfs/dbraw/zinc/47/72/27/1406477227.db2.gz CVNYEKQHQJJKMT-JGFNHJHJSA-N 1 1 341.411 2.498 20 5 EEBDMO COc1ccc(C(C)C)cc1C[NH2+]CCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001753187904 1406706395 /nfs/dbraw/zinc/70/63/95/1406706395.db2.gz AZZIIVLJYVWKGW-HZPDHXFCSA-N 1 1 349.431 2.032 20 5 EEBDMO CC(C)[C@](C)([NH2+]Cc1ccc([N+](=O)[O-])cc1Br)C(N)=O ZINC000312751090 1409820404 /nfs/dbraw/zinc/82/04/04/1409820404.db2.gz KUBZCODBQQRPGI-ZDUSSCGKSA-N 1 1 344.209 2.347 20 5 EEBDMO NC(=O)C[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000690817050 768849471 /nfs/dbraw/zinc/84/94/71/768849471.db2.gz YQQXTPAZNJXHHD-VIFPVBQESA-N 1 1 342.193 2.055 20 5 EEBDMO NC(=O)C[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000690817050 768849483 /nfs/dbraw/zinc/84/94/83/768849483.db2.gz YQQXTPAZNJXHHD-VIFPVBQESA-N 1 1 342.193 2.055 20 5 EEBDMO Cc1ccc(C(=O)NCC2C[NH+](Cc3ccc([N+](=O)[O-])cc3)C2)o1 ZINC001031534970 769457443 /nfs/dbraw/zinc/45/74/43/769457443.db2.gz IZGGARFPYGCYTQ-UHFFFAOYSA-N 1 1 329.356 2.358 20 5 EEBDMO O=C(NCC1C[NH+](Cc2cc3ccccc3s2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001031663035 770737415 /nfs/dbraw/zinc/73/74/15/770737415.db2.gz PAMOXYLKHWOURF-HUUCEWRRSA-N 1 1 345.424 2.115 20 5 EEBDMO C[C@@H]1CN(c2c([N+](=O)[O-])cnn2C)CC[N@@H+](Cc2ccccc2)C1 ZINC000894084194 780494517 /nfs/dbraw/zinc/49/45/17/780494517.db2.gz RWXWLVBRQFYUNT-AWEZNQCLSA-N 1 1 329.404 2.287 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)[C@@H](C)C1 ZINC000910275751 786604457 /nfs/dbraw/zinc/60/44/57/786604457.db2.gz XKPCGGPPLMLODT-AWEZNQCLSA-N 1 1 335.404 2.225 20 5 EEBDMO Cc1cc(NC/C=C\CNC(=O)C[N@H+](C)C2CCC2)ccc1[N+](=O)[O-] ZINC001107564772 787664827 /nfs/dbraw/zinc/66/48/27/787664827.db2.gz GGMKBVFGONJPSB-ARJAWSKDSA-N 1 1 346.431 2.472 20 5 EEBDMO CC[NH2+]Cc1noc(-c2cccc(Cn3nc([N+](=O)[O-])cc3C)c2)n1 ZINC000844905592 789445361 /nfs/dbraw/zinc/44/53/61/789445361.db2.gz DURJIBSHQRWYEH-UHFFFAOYSA-N 1 1 342.359 2.308 20 5 EEBDMO C[N@@H+]1CCN(C(=O)CCC(C)(C)[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC000844922290 789462652 /nfs/dbraw/zinc/46/26/52/789462652.db2.gz ANGOGBYXLCOOGL-INIZCTEOSA-N 1 1 333.432 2.207 20 5 EEBDMO C[N@H+]1CCN(C(=O)CCC(C)(C)[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC000844922290 789462657 /nfs/dbraw/zinc/46/26/57/789462657.db2.gz ANGOGBYXLCOOGL-INIZCTEOSA-N 1 1 333.432 2.207 20 5 EEBDMO CC(C)(C)[N@@H+](C[C@@H](O)CO)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172903683 797131142 /nfs/dbraw/zinc/13/11/42/797131142.db2.gz INCJPDSPXHLGJC-NVXWUHKLSA-N 1 1 336.432 2.296 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H](O)[C@H](C)C2)c1F ZINC001173180755 797278726 /nfs/dbraw/zinc/27/87/26/797278726.db2.gz MWSDUTIWRXXARN-UHIISALHSA-N 1 1 326.368 2.376 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2C[C@@H](OC)[C@@H](OC)C2)c1F ZINC001173183046 797280163 /nfs/dbraw/zinc/28/01/63/797280163.db2.gz VXGKBXZSWMIFEQ-NZVBXONLSA-N 1 1 342.367 2.019 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2C[C@@H](OC)[C@@H](OC)C2)c1F ZINC001173183046 797280166 /nfs/dbraw/zinc/28/01/66/797280166.db2.gz VXGKBXZSWMIFEQ-NZVBXONLSA-N 1 1 342.367 2.019 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1F ZINC001173198350 797284506 /nfs/dbraw/zinc/28/45/06/797284506.db2.gz YVWUBYGIBLWNGT-UPJWGTAASA-N 1 1 337.395 2.452 20 5 EEBDMO O=[N+]([O-])c1ccc(NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)c(OC(F)F)c1 ZINC000785802545 806604943 /nfs/dbraw/zinc/60/49/43/806604943.db2.gz VRROXYLROFBVSY-VXGBXAGGSA-N 1 1 343.330 2.471 20 5 EEBDMO O=C(NC[C@H]1C[C@H]([NH2+]Cc2cc3ccccc3o2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086363284 802829524 /nfs/dbraw/zinc/82/95/24/802829524.db2.gz LTZWHGBTBCKZQH-UIBBOPPKSA-N 1 1 343.383 2.082 20 5 EEBDMO CC(=O)N1CCC[C@H](CNc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)C1 ZINC001168783881 803325418 /nfs/dbraw/zinc/32/54/18/803325418.db2.gz IHXLQZLTFXRPQD-CQSZACIVSA-N 1 1 346.431 2.253 20 5 EEBDMO CC(=O)N1CCC[C@H](CNc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)C1 ZINC001168783881 803325424 /nfs/dbraw/zinc/32/54/24/803325424.db2.gz IHXLQZLTFXRPQD-CQSZACIVSA-N 1 1 346.431 2.253 20 5 EEBDMO COc1ccc(C2(N)CC[NH+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)CC2)cc1 ZINC001169006341 803568015 /nfs/dbraw/zinc/56/80/15/803568015.db2.gz XOVWAZKBNFIGLB-GDBMZVCRSA-N 1 1 333.432 2.390 20 5 EEBDMO COc1ccc(C2([NH3+])CCN([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)CC2)cc1 ZINC001169006341 803568018 /nfs/dbraw/zinc/56/80/18/803568018.db2.gz XOVWAZKBNFIGLB-GDBMZVCRSA-N 1 1 333.432 2.390 20 5 EEBDMO CC(C)n1nc(CN(C)C)c2c1C[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2 ZINC001169022218 803588322 /nfs/dbraw/zinc/58/83/22/803588322.db2.gz QTRMHRQVIZCSEW-CABCVRRESA-N 1 1 349.479 2.329 20 5 EEBDMO CCOC(=O)[C@@H]1CC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170345022 809916380 /nfs/dbraw/zinc/91/63/80/809916380.db2.gz GLNDUYMURQXPLI-GXTWGEPZSA-N 1 1 336.388 2.419 20 5 EEBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccccc1[N+](=O)[O-] ZINC000159914774 529846603 /nfs/dbraw/zinc/84/66/03/529846603.db2.gz QJQIGGLVPQRSAR-UHFFFAOYSA-N 1 1 335.404 2.025 20 5 EEBDMO Cc1ncsc1C[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181863855 234357142 /nfs/dbraw/zinc/35/71/42/234357142.db2.gz CWJVHBBBIXAPAI-LBPRGKRZSA-N 1 1 337.401 2.231 20 5 EEBDMO C[C@@H](C[C@@H]1COCC[NH2+]1)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000423087508 240359411 /nfs/dbraw/zinc/35/94/11/240359411.db2.gz OIFNCSDQKOEBLW-GXFFZTMASA-N 1 1 347.337 2.470 20 5 EEBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N)[N@@H+](C)Cc1ccccc1 ZINC000191532934 239171487 /nfs/dbraw/zinc/17/14/87/239171487.db2.gz HNMRKUGRTHJCET-CYBMUJFWSA-N 1 1 342.399 2.427 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H]1[C@H](C)CCN[C@@H]1C ZINC000420380222 239794681 /nfs/dbraw/zinc/79/46/81/239794681.db2.gz YFISKGNJRAODNO-PBFPGSCMSA-N 1 1 334.420 2.208 20 5 EEBDMO COc1cc(C(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000451162310 243017547 /nfs/dbraw/zinc/01/75/47/243017547.db2.gz MWJFUPIESSUYPW-CQSZACIVSA-N 1 1 339.367 2.155 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H]2C[C@H](O)CC[C@@H]2C1 ZINC000451693009 243207939 /nfs/dbraw/zinc/20/79/39/243207939.db2.gz GUKIVFPCLFQGEA-IIAWOOMASA-N 1 1 347.415 2.325 20 5 EEBDMO CN(C(=O)C[N@H+]1CC[C@@H]2C[C@H](O)CC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000451693930 243208058 /nfs/dbraw/zinc/20/80/58/243208058.db2.gz KANLDRANMDOYCC-CKEIUWERSA-N 1 1 347.415 2.041 20 5 EEBDMO CCOC[C@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000246360861 243237881 /nfs/dbraw/zinc/23/78/81/243237881.db2.gz KTRSJOJTOXETPT-GOEBONIOSA-N 1 1 338.404 2.083 20 5 EEBDMO Cn1cc(Cl)c(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)n1 ZINC000453311626 243433860 /nfs/dbraw/zinc/43/38/60/243433860.db2.gz GPGWUFZRSAKTDB-DGCLKSJQSA-N 1 1 338.799 2.452 20 5 EEBDMO CCNS(=O)(=O)c1cccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000459637600 245195481 /nfs/dbraw/zinc/19/54/81/245195481.db2.gz BAUMIMXYPJKPRE-UHFFFAOYSA-N 1 1 349.412 2.183 20 5 EEBDMO C[C@H](CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000110966931 220085537 /nfs/dbraw/zinc/08/55/37/220085537.db2.gz UXVOAXFZQNCWLL-CYBMUJFWSA-N 1 1 342.399 2.427 20 5 EEBDMO C[C@@H](C[NH+]1CCN(c2ccccn2)CC1)Nc1ncccc1[N+](=O)[O-] ZINC000265288527 247373433 /nfs/dbraw/zinc/37/34/33/247373433.db2.gz AFJSDAMOBOYJSY-AWEZNQCLSA-N 1 1 342.403 2.007 20 5 EEBDMO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266410006 248286304 /nfs/dbraw/zinc/28/63/04/248286304.db2.gz GISPNORVRPBBIZ-GXFFZTMASA-N 1 1 340.330 2.123 20 5 EEBDMO Cn1cc(C[N@@H+](C)C[C@@H]2CCOC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093839636 218252707 /nfs/dbraw/zinc/25/27/07/218252707.db2.gz FUMXRZBYFFSMNV-ZDUSSCGKSA-N 1 1 330.388 2.464 20 5 EEBDMO CCCC[N@@H+](CCOC)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000273405514 256293777 /nfs/dbraw/zinc/29/37/77/256293777.db2.gz WUMGFLWDSQTYSF-CQSZACIVSA-N 1 1 326.393 2.083 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](C(=O)NCC2CC2)C1 ZINC000078563000 292191908 /nfs/dbraw/zinc/19/19/08/292191908.db2.gz UCNPDIAMXXVZBV-CQSZACIVSA-N 1 1 347.415 2.342 20 5 EEBDMO COC(=O)c1ccc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1 ZINC000173473392 152167696 /nfs/dbraw/zinc/16/76/96/152167696.db2.gz LILDUNRTQFNBRS-NSHDSACASA-N 1 1 346.343 2.056 20 5 EEBDMO COC(=O)c1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1 ZINC000173473392 152167700 /nfs/dbraw/zinc/16/77/00/152167700.db2.gz LILDUNRTQFNBRS-NSHDSACASA-N 1 1 346.343 2.056 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000081364536 159152026 /nfs/dbraw/zinc/15/20/26/159152026.db2.gz ODSVMHQQSZYFEG-CQSZACIVSA-N 1 1 335.404 2.164 20 5 EEBDMO CCCC[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000341948127 161026584 /nfs/dbraw/zinc/02/65/84/161026584.db2.gz RKHBUQDPLXNYNS-CYBMUJFWSA-N 1 1 343.449 2.302 20 5 EEBDMO CNc1c(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)cccc1[N+](=O)[O-] ZINC000344682669 161235585 /nfs/dbraw/zinc/23/55/85/161235585.db2.gz OFIXJZPTGUPURR-AWEZNQCLSA-N 1 1 334.420 2.487 20 5 EEBDMO COC(=O)[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@@H]1C ZINC000346672357 161390651 /nfs/dbraw/zinc/39/06/51/161390651.db2.gz UGWFJLLPOZFGFE-OCCSQVGLSA-N 1 1 349.387 2.115 20 5 EEBDMO C[C@@H](CC[NH+]1CCOCC1)NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000351976031 162011150 /nfs/dbraw/zinc/01/11/50/162011150.db2.gz QEEFYZMNELIIBS-AWEZNQCLSA-N 1 1 349.431 2.099 20 5 EEBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C[C@H]1C ZINC000352476223 162150358 /nfs/dbraw/zinc/15/03/58/162150358.db2.gz HLXQQUJLZHIVOO-YPMHNXCESA-N 1 1 349.387 2.268 20 5 EEBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000352561388 162189288 /nfs/dbraw/zinc/18/92/88/162189288.db2.gz WPQRVIUPPMASRS-CYBMUJFWSA-N 1 1 343.449 2.302 20 5 EEBDMO COc1ccc(C[N@@H+](CCO)[C@H]2CCCSC2)cc1[N+](=O)[O-] ZINC000355470194 163201315 /nfs/dbraw/zinc/20/13/15/163201315.db2.gz JOLOYKIKRQOKJG-ZDUSSCGKSA-N 1 1 326.418 2.293 20 5 EEBDMO CCOc1ccc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-] ZINC000374871960 167056671 /nfs/dbraw/zinc/05/66/71/167056671.db2.gz CSBPIKMMBQEDHD-IUODEOHRSA-N 1 1 333.388 2.160 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCc1ccccn1 ZINC000123401752 222271316 /nfs/dbraw/zinc/27/13/16/222271316.db2.gz XMZVVEUGJXNXCU-UHFFFAOYSA-N 1 1 344.371 2.111 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCc1ccccn1 ZINC000123401752 222271320 /nfs/dbraw/zinc/27/13/20/222271320.db2.gz XMZVVEUGJXNXCU-UHFFFAOYSA-N 1 1 344.371 2.111 20 5 EEBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000269398004 268676957 /nfs/dbraw/zinc/67/69/57/268676957.db2.gz NFLYALHFSHGYNI-GFCCVEGCSA-N 1 1 337.424 2.436 20 5 EEBDMO O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272655231 269005252 /nfs/dbraw/zinc/00/52/52/269005252.db2.gz GFEADAPGVKCSLA-CQSZACIVSA-N 1 1 341.371 2.386 20 5 EEBDMO CCOc1ccc(C[NH+]2CCN(c3ncc([N+](=O)[O-])cn3)CC2)cc1 ZINC000273561578 269023380 /nfs/dbraw/zinc/02/33/80/269023380.db2.gz BTGJIABLDBBCCZ-UHFFFAOYSA-N 1 1 343.387 2.106 20 5 EEBDMO C[C@H]1C[N@@H+](CCCNc2nc3sccn3c2[N+](=O)[O-])CCCO1 ZINC000277977533 269203217 /nfs/dbraw/zinc/20/32/17/269203217.db2.gz KBPGDWSIOVXDTH-NSHDSACASA-N 1 1 339.421 2.217 20 5 EEBDMO O=[N+]([O-])c1cc(F)c(N2CC[NH+](C[C@@H]3CCOC3)CC2)c(F)c1 ZINC000269663191 274116345 /nfs/dbraw/zinc/11/63/45/274116345.db2.gz URJHDJRWVHGDNA-NSHDSACASA-N 1 1 327.331 2.032 20 5 EEBDMO CN(C(=O)NCCc1cccc([N+](=O)[O-])c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000288080779 275021665 /nfs/dbraw/zinc/02/16/65/275021665.db2.gz VVAMNIMKPICMRQ-FKEKPDDDSA-N 1 1 346.431 2.404 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000290531251 275215718 /nfs/dbraw/zinc/21/57/18/275215718.db2.gz OCQALCDAUJAKKY-GFCCVEGCSA-N 1 1 335.408 2.155 20 5 EEBDMO Cc1nnsc1C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000291753868 275336745 /nfs/dbraw/zinc/33/67/45/275336745.db2.gz QKYYUWFLVBGMHM-UHFFFAOYSA-N 1 1 344.400 2.445 20 5 EEBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000365389796 277209599 /nfs/dbraw/zinc/20/95/99/277209599.db2.gz LKGDXQFLCRCPTK-HNNXBMFYSA-N 1 1 341.367 2.277 20 5 EEBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000365389796 277209601 /nfs/dbraw/zinc/20/96/01/277209601.db2.gz LKGDXQFLCRCPTK-HNNXBMFYSA-N 1 1 341.367 2.277 20 5 EEBDMO CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2cc([O-])ccc2[N+](=O)[O-])C1 ZINC000339009875 279109866 /nfs/dbraw/zinc/10/98/66/279109866.db2.gz LFUOHLBGOTVORK-MRXNPFEDSA-N 1 1 337.420 2.233 20 5 EEBDMO CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2cc([O-])ccc2[N+](=O)[O-])C1 ZINC000339009875 279109868 /nfs/dbraw/zinc/10/98/68/279109868.db2.gz LFUOHLBGOTVORK-MRXNPFEDSA-N 1 1 337.420 2.233 20 5 EEBDMO CCOC1CC(C[NH+]2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000293063814 293115807 /nfs/dbraw/zinc/11/58/07/293115807.db2.gz INYKLXBKEHAKBT-UHFFFAOYSA-N 1 1 347.415 2.168 20 5 EEBDMO CCN1CCN(C[C@@H](C)C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000293748294 293285678 /nfs/dbraw/zinc/28/56/78/293285678.db2.gz NZGFRRQBDCYQFS-LSDHHAIUSA-N 1 1 349.479 2.101 20 5 EEBDMO CC[N@@H+](C)C[C@H]1CCN(c2ccc(CC(=O)OC)cc2[N+](=O)[O-])C1 ZINC000297174120 294171412 /nfs/dbraw/zinc/17/14/12/294171412.db2.gz POVVVKQXQJZQTA-CQSZACIVSA-N 1 1 335.404 2.088 20 5 EEBDMO COc1cccc(C(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000195425276 295288006 /nfs/dbraw/zinc/28/80/06/295288006.db2.gz GIEWZFCDTRYDME-OLZOCXBDSA-N 1 1 335.404 2.454 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1C[C@@H]2CCCC[N@@H+]2C[C@@H]1C ZINC000332511030 312017746 /nfs/dbraw/zinc/01/77/46/312017746.db2.gz UWBOGXDQGVIJTL-GJZGRUSLSA-N 1 1 346.431 2.400 20 5 EEBDMO [NH3+]CC(F)(F)CNC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000418512507 313834236 /nfs/dbraw/zinc/83/42/36/313834236.db2.gz LLKNUQXUTSGGBB-GFCCVEGCSA-N 1 1 342.346 2.078 20 5 EEBDMO Cc1nn(Cc2ccc(C[NH+]3CCOCC3)cc2)c(C)c1[N+](=O)[O-] ZINC000421184612 314061770 /nfs/dbraw/zinc/06/17/70/314061770.db2.gz PRQACUOMUKGZAA-UHFFFAOYSA-N 1 1 330.388 2.289 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(O[C@H]2CCOC2)CC1 ZINC000430195207 314502868 /nfs/dbraw/zinc/50/28/68/314502868.db2.gz NHRNYVUYQOULHL-INIZCTEOSA-N 1 1 336.388 2.373 20 5 EEBDMO COc1ccc(CC(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000524672492 317021132 /nfs/dbraw/zinc/02/11/32/317021132.db2.gz GJAGFJXUJQHRGB-AWEZNQCLSA-N 1 1 347.415 2.279 20 5 EEBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000527476750 317198637 /nfs/dbraw/zinc/19/86/37/317198637.db2.gz CASFDGZCPCAOLC-OAHLLOKOSA-N 1 1 342.399 2.185 20 5 EEBDMO Cc1[nH+]ccn1CCCCn1c(=O)onc1-c1cccc([N+](=O)[O-])c1 ZINC000574809293 320059227 /nfs/dbraw/zinc/05/92/27/320059227.db2.gz LJDHXRBDXYODCQ-UHFFFAOYSA-N 1 1 343.343 2.397 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@H](CNC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000578480021 320316484 /nfs/dbraw/zinc/31/64/84/320316484.db2.gz HVTPZFRXNAKHJY-WMLDXEAASA-N 1 1 349.431 2.171 20 5 EEBDMO C[N@@H+](CCCn1ccnc1)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000181080451 323338555 /nfs/dbraw/zinc/33/85/55/323338555.db2.gz MNJQFGAHZFLMEH-UHFFFAOYSA-N 1 1 331.376 2.142 20 5 EEBDMO CNc1ccc(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000581684663 324303325 /nfs/dbraw/zinc/30/33/25/324303325.db2.gz XGBTTYXPOYHYQK-XJKCOSOUSA-N 1 1 346.431 2.439 20 5 EEBDMO C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000295946789 465031393 /nfs/dbraw/zinc/03/13/93/465031393.db2.gz GSZXFROYWGXVHX-GFCCVEGCSA-N 1 1 334.376 2.419 20 5 EEBDMO Cc1cc(C)c(OC[C@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000153650644 462674595 /nfs/dbraw/zinc/67/45/95/462674595.db2.gz OHIASTZXHGXXLX-QLFBSQMISA-N 1 1 338.404 2.061 20 5 EEBDMO Cc1cc(C)c(OC[C@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000153650644 462674600 /nfs/dbraw/zinc/67/46/00/462674600.db2.gz OHIASTZXHGXXLX-QLFBSQMISA-N 1 1 338.404 2.061 20 5 EEBDMO COc1cc(C[N@@H+](C)CC(C)(C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000114728162 462676136 /nfs/dbraw/zinc/67/61/36/462676136.db2.gz MWYWBFRKBCSOJX-UHFFFAOYSA-N 1 1 334.319 2.408 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[N@H+](C(C)C)C1 ZINC000065519685 462787272 /nfs/dbraw/zinc/78/72/72/462787272.db2.gz GYNODZIOBLFYCR-GFCCVEGCSA-N 1 1 336.392 2.455 20 5 EEBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](CO)C(C)(C)C ZINC000134368229 463029577 /nfs/dbraw/zinc/02/95/77/463029577.db2.gz ODJDSBUSSHVWEH-CYBMUJFWSA-N 1 1 334.376 2.484 20 5 EEBDMO COC(=O)CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C[C@@H]1CCCO1 ZINC000093460645 463038521 /nfs/dbraw/zinc/03/85/21/463038521.db2.gz ZKJQQGFWRYQKRC-HNNXBMFYSA-N 1 1 336.388 2.447 20 5 EEBDMO CNC(=O)c1ccc(N2CCC[N@H+](C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000077994883 463078024 /nfs/dbraw/zinc/07/80/24/463078024.db2.gz WDPCYVRZDGLJFO-UHFFFAOYSA-N 1 1 346.431 2.409 20 5 EEBDMO O=C(NCC[NH+]1Cc2ccccc2C1)NCc1ccccc1[N+](=O)[O-] ZINC000068406574 463132755 /nfs/dbraw/zinc/13/27/55/463132755.db2.gz GOVFPUPDAAANKO-UHFFFAOYSA-N 1 1 340.383 2.410 20 5 EEBDMO CCOCC[N@H+](CC)[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000157550271 463142536 /nfs/dbraw/zinc/14/25/36/463142536.db2.gz ILXGDFIBAYFLNH-LBPRGKRZSA-N 1 1 339.392 2.289 20 5 EEBDMO CCOCC[N@@H+](CC)[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000157550271 463142540 /nfs/dbraw/zinc/14/25/40/463142540.db2.gz ILXGDFIBAYFLNH-LBPRGKRZSA-N 1 1 339.392 2.289 20 5 EEBDMO C[N@H+]1CC[C@@H](CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000079783554 463249112 /nfs/dbraw/zinc/24/91/12/463249112.db2.gz JYEWIIHFMUHBSP-VIFPVBQESA-N 1 1 342.193 2.039 20 5 EEBDMO Cc1ccc(NC(=O)N2CC[NH+](C[C@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000069462670 463253161 /nfs/dbraw/zinc/25/31/61/463253161.db2.gz ZTFAYYHAFROORW-OAHLLOKOSA-N 1 1 348.403 2.232 20 5 EEBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000055407047 463319008 /nfs/dbraw/zinc/31/90/08/463319008.db2.gz IAZWTWPOUYJBGN-VXGBXAGGSA-N 1 1 345.403 2.321 20 5 EEBDMO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000055407047 463319013 /nfs/dbraw/zinc/31/90/13/463319013.db2.gz IAZWTWPOUYJBGN-VXGBXAGGSA-N 1 1 345.403 2.321 20 5 EEBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000055407047 463319018 /nfs/dbraw/zinc/31/90/18/463319018.db2.gz IAZWTWPOUYJBGN-VXGBXAGGSA-N 1 1 345.403 2.321 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@@H+](CC(C)C)C1 ZINC000161849687 463462404 /nfs/dbraw/zinc/46/24/04/463462404.db2.gz CZSRTZJVPPMXLA-ZDUSSCGKSA-N 1 1 335.404 2.311 20 5 EEBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H](Cn3ccnn3)C2)cc1 ZINC000162603544 463524559 /nfs/dbraw/zinc/52/45/59/463524559.db2.gz WBUGGMZSALFYSA-OAHLLOKOSA-N 1 1 345.403 2.367 20 5 EEBDMO Cn1cc(Br)cc1C[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000151536407 463549941 /nfs/dbraw/zinc/54/99/41/463549941.db2.gz JTIHCHPQGRKCPB-UHFFFAOYSA-N 1 1 342.197 2.024 20 5 EEBDMO Cc1ccnc(N2CC[NH+](CCOc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000166101016 463651627 /nfs/dbraw/zinc/65/16/27/463651627.db2.gz NZHPKEYTEHTNAH-UHFFFAOYSA-N 1 1 342.399 2.499 20 5 EEBDMO O=C1CCCN1[C@H]1CCC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000111291465 463673834 /nfs/dbraw/zinc/67/38/34/463673834.db2.gz IPXRZFUAUKGBLP-HNNXBMFYSA-N 1 1 333.388 2.060 20 5 EEBDMO CC(C)N1CCC[C@H]([NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1=O ZINC000177672104 463762544 /nfs/dbraw/zinc/76/25/44/463762544.db2.gz OXGZEHPGVDSEBL-KRWDZBQOSA-N 1 1 346.431 2.116 20 5 EEBDMO CC1(C)C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccs1 ZINC000286983865 463763323 /nfs/dbraw/zinc/76/33/23/463763323.db2.gz OXXNMGPSQCFFND-OCCSQVGLSA-N 1 1 336.417 2.297 20 5 EEBDMO CCOc1cc(C[N@@H+]2CC[C@@H](N3CCCC3=O)C2)ccc1[N+](=O)[O-] ZINC000276836465 463775231 /nfs/dbraw/zinc/77/52/31/463775231.db2.gz BPPMLPKNJLZEHG-CQSZACIVSA-N 1 1 333.388 2.190 20 5 EEBDMO CCOc1cc(C[N@H+]2CC[C@@H](N3CCCC3=O)C2)ccc1[N+](=O)[O-] ZINC000276836465 463775238 /nfs/dbraw/zinc/77/52/38/463775238.db2.gz BPPMLPKNJLZEHG-CQSZACIVSA-N 1 1 333.388 2.190 20 5 EEBDMO COC(=O)[C@@H]1C[C@@H](C)CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283242654 463816670 /nfs/dbraw/zinc/81/66/70/463816670.db2.gz JKVGUDPGRWQQDC-WFASDCNBSA-N 1 1 349.387 2.197 20 5 EEBDMO COC(=O)[C@@H]1C[C@@H](C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283242654 463816673 /nfs/dbraw/zinc/81/66/73/463816673.db2.gz JKVGUDPGRWQQDC-WFASDCNBSA-N 1 1 349.387 2.197 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)C1 ZINC000277188840 463903548 /nfs/dbraw/zinc/90/35/48/463903548.db2.gz BEQQQSNCVNCSRD-CYBMUJFWSA-N 1 1 335.404 2.407 20 5 EEBDMO Cn1ccnc1[C@H](O)[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000269258560 463931717 /nfs/dbraw/zinc/93/17/17/463931717.db2.gz CQROPKUEXCBAIE-GOEBONIOSA-N 1 1 330.388 2.274 20 5 EEBDMO C[C@H]1CCSCC[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000279185409 464056269 /nfs/dbraw/zinc/05/62/69/464056269.db2.gz DJNKYUNOMRVIPX-LBPRGKRZSA-N 1 1 335.429 2.311 20 5 EEBDMO C[C@H]1CCSCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000279185409 464056277 /nfs/dbraw/zinc/05/62/77/464056277.db2.gz DJNKYUNOMRVIPX-LBPRGKRZSA-N 1 1 335.429 2.311 20 5 EEBDMO CN(C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1 ZINC000279253069 464078509 /nfs/dbraw/zinc/07/85/09/464078509.db2.gz IKGWHWBTMKHQOQ-NSHDSACASA-N 1 1 343.786 2.482 20 5 EEBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000263864477 464220301 /nfs/dbraw/zinc/22/03/01/464220301.db2.gz BIVPEBPKPFETAS-GFCCVEGCSA-N 1 1 338.408 2.133 20 5 EEBDMO O=[N+]([O-])c1cccc(Cl)c1N1CC[C@H](C[NH+]2CCOCC2)C1 ZINC000292468129 464243679 /nfs/dbraw/zinc/24/36/79/464243679.db2.gz KRGIIDCFULBOKJ-GFCCVEGCSA-N 1 1 325.796 2.407 20 5 EEBDMO C[N@H+]1CC[C@H]2OCCN(Cc3ccc([N+](=O)[O-])cc3Cl)[C@H]2C1 ZINC000284747466 464322912 /nfs/dbraw/zinc/32/29/12/464322912.db2.gz XFIJYLVMAOFEJQ-LSDHHAIUSA-N 1 1 325.796 2.153 20 5 EEBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000174038465 464353205 /nfs/dbraw/zinc/35/32/05/464353205.db2.gz YWGVWWXHFMIAJK-OAHLLOKOSA-N 1 1 348.447 2.364 20 5 EEBDMO COc1cc(CN2CCC[N@@H+](C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000284826193 464356814 /nfs/dbraw/zinc/35/68/14/464356814.db2.gz YASHUJZBTLGVHI-UHFFFAOYSA-N 1 1 345.346 2.342 20 5 EEBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000188745782 464360199 /nfs/dbraw/zinc/36/01/99/464360199.db2.gz IROPBGYDCWJOMW-VFADXPBXSA-N 1 1 333.432 2.385 20 5 EEBDMO CC[C@@H](C)[N@@H+](C)CCNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000264534176 464363020 /nfs/dbraw/zinc/36/30/20/464363020.db2.gz KZWFZSXRYQPMPO-SNVBAGLBSA-N 1 1 349.840 2.257 20 5 EEBDMO C[C@H]1CCC[N@@H+](CCNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000294278576 464453608 /nfs/dbraw/zinc/45/36/08/464453608.db2.gz AVTPUHCJIRIWMT-AWEZNQCLSA-N 1 1 347.415 2.406 20 5 EEBDMO C[N@@H+](CCC[NH+]1CCCC1)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000281469224 464467335 /nfs/dbraw/zinc/46/73/35/464467335.db2.gz VTWUOZFNHOTSCW-UHFFFAOYSA-N 1 1 334.420 2.341 20 5 EEBDMO CN(CCC[NH+]1CCCC1)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000281469224 464467340 /nfs/dbraw/zinc/46/73/40/464467340.db2.gz VTWUOZFNHOTSCW-UHFFFAOYSA-N 1 1 334.420 2.341 20 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CC[C@H](C)[N@@H+](C)CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000189803603 464551953 /nfs/dbraw/zinc/55/19/53/464551953.db2.gz GXLIGVVQBZNRFQ-NSHDSACASA-N 1 1 329.422 2.141 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000285450446 464568376 /nfs/dbraw/zinc/56/83/76/464568376.db2.gz SNYLNSDOAYBPSI-HIFRSBDPSA-N 1 1 346.387 2.285 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000285450446 464568381 /nfs/dbraw/zinc/56/83/81/464568381.db2.gz SNYLNSDOAYBPSI-HIFRSBDPSA-N 1 1 346.387 2.285 20 5 EEBDMO C[C@@H]1C[C@@H](C)CC[N@@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000265798395 464691040 /nfs/dbraw/zinc/69/10/40/464691040.db2.gz BDVKGWJOFCOIRW-WDEREUQCSA-N 1 1 335.360 2.382 20 5 EEBDMO C[C@@H]1C[C@@H](C)CC[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000265798395 464691043 /nfs/dbraw/zinc/69/10/43/464691043.db2.gz BDVKGWJOFCOIRW-WDEREUQCSA-N 1 1 335.360 2.382 20 5 EEBDMO COC[C@]1(C(=O)OC)CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 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335.404 2.210 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000601221724 468787078 /nfs/dbraw/zinc/78/70/78/468787078.db2.gz QKEZRZMNECSDHU-UKRRQHHQSA-N 1 1 342.399 2.421 20 5 EEBDMO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])c[nH]3)C2)c1 ZINC000601240986 468794256 /nfs/dbraw/zinc/79/42/56/468794256.db2.gz UAHYRFZIFORQAX-AWEZNQCLSA-N 1 1 328.372 2.236 20 5 EEBDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000595298248 468805427 /nfs/dbraw/zinc/80/54/27/468805427.db2.gz PIMGDAPWNRBANT-YPMHNXCESA-N 1 1 338.408 2.408 20 5 EEBDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000595298248 468805431 /nfs/dbraw/zinc/80/54/31/468805431.db2.gz PIMGDAPWNRBANT-YPMHNXCESA-N 1 1 338.408 2.408 20 5 EEBDMO Cn1ccnc1[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000560525325 468826390 /nfs/dbraw/zinc/82/63/90/468826390.db2.gz LZFITZFJIAQKTH-WMLDXEAASA-N 1 1 343.431 2.349 20 5 EEBDMO 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O=C(NCC1=CC[N@H+](Cc2ccccc2Cl)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001000675037 1240709764 /nfs/dbraw/zinc/70/97/64/1240709764.db2.gz QFHNSHXGOURWKO-GDBMZVCRSA-N 1 1 349.818 2.254 20 5 EEBDMO O=C(NCC1=CC[N@@H+](Cc2ccccc2Cl)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001000675037 1240709769 /nfs/dbraw/zinc/70/97/69/1240709769.db2.gz QFHNSHXGOURWKO-GDBMZVCRSA-N 1 1 349.818 2.254 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N[C@H]1C[C@H](Nc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001097053149 1243631555 /nfs/dbraw/zinc/63/15/55/1243631555.db2.gz LOQZFUVKXZICFS-JOCQHMNTSA-N 1 1 338.383 2.135 20 5 EEBDMO Cn1c(C(=O)OC[C@@H]2CC[N@@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000851465379 1277620953 /nfs/dbraw/zinc/62/09/53/1277620953.db2.gz FUYJEYYNIAJCND-AWEZNQCLSA-N 1 1 329.356 2.365 20 5 EEBDMO Cn1c(C(=O)OC[C@@H]2CC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000851465379 1277620959 /nfs/dbraw/zinc/62/09/59/1277620959.db2.gz FUYJEYYNIAJCND-AWEZNQCLSA-N 1 1 329.356 2.365 20 5 EEBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C2 ZINC000854738311 1292934539 /nfs/dbraw/zinc/93/45/39/1292934539.db2.gz ZKNWCYRSEWLPGL-INIZCTEOSA-N 1 1 348.359 2.061 20 5 EEBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](OCc3ccc([N+](=O)[O-])cc3)C[C@H]1[N@H+]2C ZINC001222791382 1299863774 /nfs/dbraw/zinc/86/37/74/1299863774.db2.gz PVBYFKYZUUETHQ-NXOAAHMSSA-N 1 1 334.372 2.278 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(O[C@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c1 ZINC001227049140 1301665702 /nfs/dbraw/zinc/66/57/02/1301665702.db2.gz OMADLUUIYHZKID-VIKVFOODSA-N 1 1 334.372 2.491 20 5 EEBDMO C[N@H+]1CCC[C@@H](Oc2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC001227498169 1301854067 /nfs/dbraw/zinc/85/40/67/1301854067.db2.gz LXEGUIGGKRRMTB-SNVBAGLBSA-N 1 1 340.292 2.274 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Oc1nc[nH]c(=O)c1[N+](=O)[O-] ZINC001228140598 1302122045 /nfs/dbraw/zinc/12/20/45/1302122045.db2.gz KDRQXCHDTUAWOA-JSGCOSHPSA-N 1 1 344.371 2.380 20 5 EEBDMO CC(C)[N@H+](C)CC(=O)NC1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001230374383 1303183108 /nfs/dbraw/zinc/18/31/08/1303183108.db2.gz URRFXOYXXKKRRP-UHFFFAOYSA-N 1 1 348.447 2.016 20 5 EEBDMO CC(C)[N@@H+](C)CC(=O)NC1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001230374383 1303183115 /nfs/dbraw/zinc/18/31/15/1303183115.db2.gz URRFXOYXXKKRRP-UHFFFAOYSA-N 1 1 348.447 2.016 20 5 EEBDMO Cc1ccc(C(=O)NCCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)n1C ZINC001233915873 1304639127 /nfs/dbraw/zinc/63/91/27/1304639127.db2.gz IIBYOPMFIOFBNA-UHFFFAOYSA-N 1 1 344.415 2.494 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](Oc2cc(N3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC001234359639 1304897974 /nfs/dbraw/zinc/89/79/74/1304897974.db2.gz IXVZTLRSTFYPJZ-OAHLLOKOSA-N 1 1 335.404 2.293 20 5 EEBDMO Cc1ccc(C[N@@H+]2CCCN(c3c([N+](=O)[O-])cnn3C)CC2)cc1 ZINC001120014735 1309283418 /nfs/dbraw/zinc/28/34/18/1309283418.db2.gz OPFJYRRYHMTJIQ-UHFFFAOYSA-N 1 1 329.404 2.349 20 5 EEBDMO O=C1C[C@@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000839986982 1315268998 /nfs/dbraw/zinc/26/89/98/1315268998.db2.gz CSURSXMQRQUNQE-NVXWUHKLSA-N 1 1 331.372 2.364 20 5 EEBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000840121438 1315301198 /nfs/dbraw/zinc/30/11/98/1315301198.db2.gz RWUWUDFESOTZPJ-OUCADQQQSA-N 1 1 347.371 2.086 20 5 EEBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000840121438 1315301200 /nfs/dbraw/zinc/30/12/00/1315301200.db2.gz RWUWUDFESOTZPJ-OUCADQQQSA-N 1 1 347.371 2.086 20 5 EEBDMO O=C(N[C@@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)C1CC1 ZINC001254610299 1318143352 /nfs/dbraw/zinc/14/33/52/1318143352.db2.gz JJBRUJUCROMIED-WBVHZDCISA-N 1 1 329.400 2.053 20 5 EEBDMO COc1cc(N2CCC([N@@H+](C)C(C)(C)CN)CC2)ccc1[N+](=O)[O-] ZINC001256090674 1318644257 /nfs/dbraw/zinc/64/42/57/1318644257.db2.gz WPCMDUSUJJLJLS-UHFFFAOYSA-N 1 1 336.436 2.241 20 5 EEBDMO COc1cc(N2CCC(N(C)C(C)(C)C[NH3+])CC2)ccc1[N+](=O)[O-] ZINC001256090674 1318644272 /nfs/dbraw/zinc/64/42/72/1318644272.db2.gz WPCMDUSUJJLJLS-UHFFFAOYSA-N 1 1 336.436 2.241 20 5 EEBDMO O=[N+]([O-])c1cc[n+]([O-])c(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c1 ZINC001161885239 1320661852 /nfs/dbraw/zinc/66/18/52/1320661852.db2.gz KCOXUGRWBLOLDB-INIZCTEOSA-N 1 1 328.372 2.305 20 5 EEBDMO C[N@@H+]1CCc2c(NCCN3CCCCC3=O)ccc([N+](=O)[O-])c2C1 ZINC001161942510 1320686239 /nfs/dbraw/zinc/68/62/39/1320686239.db2.gz DYFBJAFOJSLLNU-UHFFFAOYSA-N 1 1 332.404 2.007 20 5 EEBDMO C[N@H+]1CCc2c(NCCN3CCCCC3=O)ccc([N+](=O)[O-])c2C1 ZINC001161942510 1320686245 /nfs/dbraw/zinc/68/62/45/1320686245.db2.gz DYFBJAFOJSLLNU-UHFFFAOYSA-N 1 1 332.404 2.007 20 5 EEBDMO C[N@@H+]1CCO[C@@H](CNc2ccc(OC(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC001162687412 1320930482 /nfs/dbraw/zinc/93/04/82/1320930482.db2.gz BGEGLAXKZYLYBG-JTQLQIEISA-N 1 1 335.282 2.236 20 5 EEBDMO C[N@H+]1CCO[C@@H](CNc2ccc(OC(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC001162687412 1320930484 /nfs/dbraw/zinc/93/04/84/1320930484.db2.gz BGEGLAXKZYLYBG-JTQLQIEISA-N 1 1 335.282 2.236 20 5 EEBDMO C[NH+](C)/C=C/c1cc(N2CCC[C@](O)(CF)CC2)ncc1[N+](=O)[O-] ZINC001164087349 1321287595 /nfs/dbraw/zinc/28/75/95/1321287595.db2.gz LPDSUKOOSBPDNH-KZJSRBBCSA-N 1 1 338.383 2.213 20 5 EEBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1N[C@H]1CCC[N@@H+]2CCSC[C@H]12 ZINC001307208859 1329871649 /nfs/dbraw/zinc/87/16/49/1329871649.db2.gz RYKDIINYJLMVNA-GXFFZTMASA-N 1 1 338.389 2.495 20 5 EEBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC001307208859 1329871651 /nfs/dbraw/zinc/87/16/51/1329871651.db2.gz RYKDIINYJLMVNA-GXFFZTMASA-N 1 1 338.389 2.495 20 5 EEBDMO CC(C)[N@H+](C)C[C@H](C)Nc1cc(F)c(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001603319150 1350687284 /nfs/dbraw/zinc/68/72/84/1350687284.db2.gz LVWFDXSPKXTCJN-VIFPVBQESA-N 1 1 337.359 2.055 20 5 EEBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC001318058817 1332466277 /nfs/dbraw/zinc/46/62/77/1332466277.db2.gz ANPSRZGXTIBMOL-CQSZACIVSA-N 1 1 335.404 2.484 20 5 EEBDMO O=C(NCC[NH+]1CC=CC1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC001319982158 1332806246 /nfs/dbraw/zinc/80/62/46/1332806246.db2.gz QFYUTNFGMLCYBM-UHFFFAOYSA-N 1 1 329.278 2.215 20 5 EEBDMO Cn1c2ccccc2c(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1=O ZINC001333630859 1336091201 /nfs/dbraw/zinc/09/12/01/1336091201.db2.gz XEFFXTOEDMHQPL-QWHCGFSZSA-N 1 1 342.399 2.485 20 5 EEBDMO O=[N+]([O-])c1c(N2CC[NH+](CCCO)CC2)cccc1C(F)(F)F ZINC001333878643 1336159649 /nfs/dbraw/zinc/15/96/49/1336159649.db2.gz FDVDWYGGMUSIIE-UHFFFAOYSA-N 1 1 333.310 2.118 20 5 EEBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(c2cc(N)c([N+](=O)[O-])cn2)C1 ZINC001337875143 1336747126 /nfs/dbraw/zinc/74/71/26/1336747126.db2.gz FGKJRUGBRXFBNT-CQSZACIVSA-N 1 1 327.388 2.283 20 5 EEBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001339467612 1337009617 /nfs/dbraw/zinc/00/96/17/1337009617.db2.gz ORDDYQJEHZRZFJ-YDHLFZDLSA-N 1 1 348.451 2.089 20 5 EEBDMO CC(C)Oc1nc(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)ccc1[N+](=O)[O-] ZINC000848659642 1338737482 /nfs/dbraw/zinc/73/74/82/1338737482.db2.gz OJBOVNCTEDHQPO-QWHCGFSZSA-N 1 1 336.392 2.052 20 5 EEBDMO COCc1cnc(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)s1 ZINC001579093546 1344338599 /nfs/dbraw/zinc/33/85/99/1344338599.db2.gz AIEGICAWSRZJJN-CQSZACIVSA-N 1 1 336.373 2.010 20 5 EEBDMO [NH3+]Cc1nc(C(=O)NCc2cc(F)c(Cl)c([N+](=O)[O-])c2)cs1 ZINC001580352680 1344512651 /nfs/dbraw/zinc/51/26/51/1344512651.db2.gz BKGMKSNKROBENP-UHFFFAOYSA-N 1 1 344.755 2.233 20 5 EEBDMO Cc1ccc(NCCNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])[nH+]c1 ZINC001581209682 1344597230 /nfs/dbraw/zinc/59/72/30/1344597230.db2.gz QLXIGLJVWJXUEH-UHFFFAOYSA-N 1 1 340.347 2.002 20 5 EEBDMO C[C@H]1CCCC[N@H+]1CCNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590256992 1349232408 /nfs/dbraw/zinc/23/24/08/1349232408.db2.gz OTAKNHYWQLBIJS-NSHDSACASA-N 1 1 331.380 2.061 20 5 EEBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001116164865 1371721948 /nfs/dbraw/zinc/72/19/48/1371721948.db2.gz SKNGNNLHELUZSX-LBPRGKRZSA-N 1 1 330.388 2.104 20 5 EEBDMO NC(=O)C1([NH2+]Cc2cccc([N+](=O)[O-])c2Br)CCCC1 ZINC000839518231 1372906592 /nfs/dbraw/zinc/90/65/92/1372906592.db2.gz CEAOVNBUBRBWDX-UHFFFAOYSA-N 1 1 342.193 2.245 20 5 EEBDMO CC(=O)c1ccc(N2CCC[C@@H]([NH+]3CCOCC3)CC2)c([N+](=O)[O-])c1 ZINC000848792675 1373181411 /nfs/dbraw/zinc/18/14/11/1373181411.db2.gz APDFOCMLLJJUPI-MRXNPFEDSA-N 1 1 347.415 2.489 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)nc(N2CC[NH+](CCc3ccccn3)CC2)c1 ZINC001165054713 722008434 /nfs/dbraw/zinc/00/84/34/722008434.db2.gz ZBXBQWSNWIGBOU-UHFFFAOYSA-N 1 1 347.806 2.403 20 5 EEBDMO Cc1cccnc1C(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001031606786 770142909 /nfs/dbraw/zinc/14/29/09/770142909.db2.gz VVLNZLJHHALYTC-UHFFFAOYSA-N 1 1 340.383 2.160 20 5 EEBDMO CC(C)CC[N@H+](C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000068961240 775064594 /nfs/dbraw/zinc/06/45/94/775064594.db2.gz DUGCESWRXOLTSH-KRWDZBQOSA-N 1 1 348.403 2.297 20 5 EEBDMO CC(C)CC[N@@H+](C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000068961240 775064601 /nfs/dbraw/zinc/06/46/01/775064601.db2.gz DUGCESWRXOLTSH-KRWDZBQOSA-N 1 1 348.403 2.297 20 5 EEBDMO Cc1cocc1C(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001031901236 778993839 /nfs/dbraw/zinc/99/38/39/778993839.db2.gz OMSXQDLCTLWDPI-UHFFFAOYSA-N 1 1 329.356 2.358 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(N2CN=NC2=O)CC1 ZINC000846882062 790700320 /nfs/dbraw/zinc/70/03/20/790700320.db2.gz JNAWETPZECCCPR-UHFFFAOYSA-N 1 1 347.375 2.128 20 5 EEBDMO C[N@H+]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1(C)C ZINC000846888931 790711783 /nfs/dbraw/zinc/71/17/83/790711783.db2.gz LWYBLYFEVOMDTJ-UHFFFAOYSA-N 1 1 338.383 2.089 20 5 EEBDMO CN1CC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1(C)C ZINC000846888931 790711792 /nfs/dbraw/zinc/71/17/92/790711792.db2.gz LWYBLYFEVOMDTJ-UHFFFAOYSA-N 1 1 338.383 2.089 20 5 EEBDMO CN1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1(C)C ZINC000846888931 790711800 /nfs/dbraw/zinc/71/18/00/790711800.db2.gz LWYBLYFEVOMDTJ-UHFFFAOYSA-N 1 1 338.383 2.089 20 5 EEBDMO Cn1ncc([N+](=O)[O-])c1N1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000893829629 780207618 /nfs/dbraw/zinc/20/76/18/780207618.db2.gz QWGKKSZDDVKKON-GOSISDBHSA-N 1 1 341.415 2.431 20 5 EEBDMO CCn1nc(C)c(C[NH2+][C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000818345560 785249853 /nfs/dbraw/zinc/24/98/53/785249853.db2.gz WITYXNPESOXETG-LLVKDONJSA-N 1 1 346.391 2.022 20 5 EEBDMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC12CCCCC2 ZINC000908571556 785535368 /nfs/dbraw/zinc/53/53/68/785535368.db2.gz XPZGCFCNGVPEGA-UHFFFAOYSA-N 1 1 332.404 2.268 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)NC/C=C\CNc1ccc([N+](=O)[O-])cc1F ZINC001107200926 786373431 /nfs/dbraw/zinc/37/34/31/786373431.db2.gz XAZRWVDOLCGYKI-IHWYPQMZSA-N 1 1 347.350 2.023 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CCC([N@@H+](C)CCCO)CC1 ZINC000821354135 786712840 /nfs/dbraw/zinc/71/28/40/786712840.db2.gz FIYFIPNMWIQCKD-UHFFFAOYSA-N 1 1 349.431 2.130 20 5 EEBDMO 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CCC[N@@H+](CC)CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000174648778 464433618 /nfs/dbraw/zinc/43/36/18/464433618.db2.gz UPVPEONBMLGUGI-UHFFFAOYSA-N 1 1 345.403 2.242 20 5 EEBDMO Cc1[nH+]ccn1CCCCNC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000281453368 464459409 /nfs/dbraw/zinc/45/94/09/464459409.db2.gz RDDOSHGINDSKIQ-UHFFFAOYSA-N 1 1 346.387 2.384 20 5 EEBDMO O=[N+]([O-])c1cnc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)s1 ZINC000281728014 464561150 /nfs/dbraw/zinc/56/11/50/464561150.db2.gz AOARLOPPHQZAMO-UONOGXRCSA-N 1 1 348.428 2.346 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1CCCC[C@@H]1O ZINC000272454083 464617630 /nfs/dbraw/zinc/61/76/30/464617630.db2.gz CNWFJEWRLKADFN-WWGRRREGSA-N 1 1 335.404 2.405 20 5 EEBDMO CN(C(=O)C[N@@H+](C)C[C@H]1CCCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000272541780 464652800 /nfs/dbraw/zinc/65/28/00/464652800.db2.gz NRPUJKPYHDBTDN-CJNGLKHVSA-N 1 1 335.404 2.041 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@H]1CCCC[C@@H]1O ZINC000272606184 464675488 /nfs/dbraw/zinc/67/54/88/464675488.db2.gz VWMLGAVSMBTQKS-WWGRRREGSA-N 1 1 335.404 2.405 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[NH+]2CCN(Cc3ccc(Cl)cc3)CC2)n1 ZINC000176194718 464716655 /nfs/dbraw/zinc/71/66/55/464716655.db2.gz WIHKOWZLOLAULV-UHFFFAOYSA-N 1 1 349.822 2.263 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@H+](CCCO)[C@@H]2CCc3ccccc32)n1 ZINC000176242740 464729340 /nfs/dbraw/zinc/72/93/40/464729340.db2.gz IZIJGMURXRZLEC-MRXNPFEDSA-N 1 1 330.388 2.163 20 5 EEBDMO C[C@H]1CCN(CCn2ccc([N+](=O)[O-])n2)CC[N@H+]1Cc1ccccc1 ZINC000176286389 464740120 /nfs/dbraw/zinc/74/01/20/464740120.db2.gz CDDKPMMOKNBXIW-INIZCTEOSA-N 1 1 343.431 2.388 20 5 EEBDMO COCCOCCOCC[N@@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000276158342 464829189 /nfs/dbraw/zinc/82/91/89/464829189.db2.gz HIRNOJCUEKLXKD-CQSZACIVSA-N 1 1 326.393 2.267 20 5 EEBDMO C[C@H](CO)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000276427165 464928249 /nfs/dbraw/zinc/92/82/49/464928249.db2.gz JGFRLXORNWRQSO-CYBMUJFWSA-N 1 1 335.404 2.183 20 5 EEBDMO CC(C)c1ccc(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000251653824 464938582 /nfs/dbraw/zinc/93/85/82/464938582.db2.gz HQUUYUIYYCAXQK-KGLIPLIRSA-N 1 1 349.431 2.245 20 5 EEBDMO CC(C)c1ccc(C(=O)N2CC[N@H+](C[C@H](C)O)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000251653824 464938590 /nfs/dbraw/zinc/93/85/90/464938590.db2.gz HQUUYUIYYCAXQK-KGLIPLIRSA-N 1 1 349.431 2.245 20 5 EEBDMO CC[N@H+]1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000286584579 464968836 /nfs/dbraw/zinc/96/88/36/464968836.db2.gz QILNPFKGHLHNOB-NSHDSACASA-N 1 1 340.811 2.213 20 5 EEBDMO CC(C)(C)OC(=O)CC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000192834455 465007056 /nfs/dbraw/zinc/00/70/56/465007056.db2.gz HHKSOBZQRKBUDV-UHFFFAOYSA-N 1 1 335.404 2.449 20 5 EEBDMO COC(=O)c1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cn1C ZINC000348041072 465388757 /nfs/dbraw/zinc/38/87/57/465388757.db2.gz NDBBHTKTOYPMFI-UHFFFAOYSA-N 1 1 333.344 2.018 20 5 EEBDMO Cn1cc(CN[C@@H]2CCC[NH2+]CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000591278592 468437281 /nfs/dbraw/zinc/43/72/81/468437281.db2.gz UQRKYGYTJSDDMX-OAHLLOKOSA-N 1 1 329.404 2.227 20 5 EEBDMO C[C@@H]1[C@H](C)N(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@@H+]1C ZINC000356884031 465599514 /nfs/dbraw/zinc/59/95/14/465599514.db2.gz QVFCXNIEBPTRRB-NEPJUHHUSA-N 1 1 330.388 2.170 20 5 EEBDMO C[C@@H]1[C@H](C)N(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[N@@H+]1C ZINC000356970563 465668787 /nfs/dbraw/zinc/66/87/87/465668787.db2.gz FRLYRBFDIGKXDC-NEPJUHHUSA-N 1 1 331.376 2.169 20 5 EEBDMO C[C@@H]1[C@H](C)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC[N@@H+]1C ZINC000357012415 465700492 /nfs/dbraw/zinc/70/04/92/465700492.db2.gz YUNZGKSWWKSXEP-MNOVXSKESA-N 1 1 340.811 2.211 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000548747533 468466637 /nfs/dbraw/zinc/46/66/37/468466637.db2.gz KEVBDUUKVOYADS-ZDUSSCGKSA-N 1 1 343.387 2.055 20 5 EEBDMO CSc1cccc(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-] ZINC000346304875 466078048 /nfs/dbraw/zinc/07/80/48/466078048.db2.gz YQGDXFCGLFQDFE-INIZCTEOSA-N 1 1 335.429 2.485 20 5 EEBDMO C[C@H]1C[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[N@@H+]1C1CC1 ZINC000357533096 466108706 /nfs/dbraw/zinc/10/87/06/466108706.db2.gz PMEMAVUWVVSGKJ-JQWIXIFHSA-N 1 1 329.360 2.682 20 5 EEBDMO C[C@H]1C[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[N@H+]1C1CC1 ZINC000357533096 466108712 /nfs/dbraw/zinc/10/87/12/466108712.db2.gz PMEMAVUWVVSGKJ-JQWIXIFHSA-N 1 1 329.360 2.682 20 5 EEBDMO CC(C)(O)C[N@H+]1CCc2c(cccc2Nc2ncc([N+](=O)[O-])cn2)C1 ZINC000302217263 466121664 /nfs/dbraw/zinc/12/16/64/466121664.db2.gz KALLCHMLNHBZDT-UHFFFAOYSA-N 1 1 343.387 2.257 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@]2(CNC(=O)C2)C1 ZINC000353754698 466123298 /nfs/dbraw/zinc/12/32/98/466123298.db2.gz ZMOVNUHOPUDDDQ-KRWDZBQOSA-N 1 1 333.388 2.096 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@]2(CNC(=O)C2)C1 ZINC000353754698 466123305 /nfs/dbraw/zinc/12/33/05/466123305.db2.gz ZMOVNUHOPUDDDQ-KRWDZBQOSA-N 1 1 333.388 2.096 20 5 EEBDMO CC[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)c1ccc(F)cc1 ZINC000304326681 466283808 /nfs/dbraw/zinc/28/38/08/466283808.db2.gz STDNDWKJGHPXNT-LRDDRELGSA-N 1 1 336.367 2.374 20 5 EEBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000361784339 466287303 /nfs/dbraw/zinc/28/73/03/466287303.db2.gz DADCHYUNKQIMPV-HNNXBMFYSA-N 1 1 348.447 2.412 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]([C@H](C)CO)C1CCCC1 ZINC000347200000 466469770 /nfs/dbraw/zinc/46/97/70/466469770.db2.gz COAONOQRXIHOSA-CYBMUJFWSA-N 1 1 335.404 2.467 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC[N@H+]1C ZINC000332313129 466504016 /nfs/dbraw/zinc/50/40/16/466504016.db2.gz IGBBEQDZNFECHG-RYUDHWBXSA-N 1 1 328.372 2.356 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]([C@@H](C)CO)C1CCCC1 ZINC000347246797 466507153 /nfs/dbraw/zinc/50/71/53/466507153.db2.gz JOKROPJGOHCTFT-ZDUSSCGKSA-N 1 1 335.404 2.467 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C ZINC000332336424 466514802 /nfs/dbraw/zinc/51/48/02/466514802.db2.gz MEQGTUUUIVHLBS-WDEREUQCSA-N 1 1 344.371 2.061 20 5 EEBDMO COc1cc(CNc2[nH+]c3ccc(F)cc3n2C)c([N+](=O)[O-])cc1O ZINC000362082976 466541749 /nfs/dbraw/zinc/54/17/49/466541749.db2.gz KGRZAJOWIGJFOC-UHFFFAOYSA-N 1 1 346.318 2.947 20 5 EEBDMO CC(C)(C)OC(=O)[C@](C)(O)C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000362107577 466562454 /nfs/dbraw/zinc/56/24/54/466562454.db2.gz VRPUIPCLOKKHPZ-OAHLLOKOSA-N 1 1 344.795 2.431 20 5 EEBDMO O=C([C@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1)N1CCCC1 ZINC000347447321 466636213 /nfs/dbraw/zinc/63/62/13/466636213.db2.gz IJPCDPUZZUWWEM-NSHDSACASA-N 1 1 339.342 2.317 20 5 EEBDMO O=C([C@H]1CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1)N1CCCC1 ZINC000347447321 466636218 /nfs/dbraw/zinc/63/62/18/466636218.db2.gz IJPCDPUZZUWWEM-NSHDSACASA-N 1 1 339.342 2.317 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@](O)(C3CC3)C2)cccc1[N+](=O)[O-] ZINC000373280317 466751735 /nfs/dbraw/zinc/75/17/35/466751735.db2.gz WUWIPRHYYJCLNE-SJCJKPOMSA-N 1 1 333.388 2.077 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2Cc3ccccc3C3(CCC3)C2)c1 ZINC000375687620 466861961 /nfs/dbraw/zinc/86/19/61/466861961.db2.gz GIKZFCLEPCIPNU-INIZCTEOSA-N 1 1 342.399 2.090 20 5 EEBDMO COC(=O)[C@@H]1CN([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC[N@@H+](C)C1 ZINC000411908952 466930223 /nfs/dbraw/zinc/93/02/23/466930223.db2.gz FDAUJLBUTMPGLY-KGLIPLIRSA-N 1 1 335.404 2.001 20 5 EEBDMO COC(=O)[C@H]1CN(C)CC[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000411908952 466930224 /nfs/dbraw/zinc/93/02/24/466930224.db2.gz FDAUJLBUTMPGLY-KGLIPLIRSA-N 1 1 335.404 2.001 20 5 EEBDMO COC(=O)[C@H]1CN(C)CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000411908952 466930225 /nfs/dbraw/zinc/93/02/25/466930225.db2.gz FDAUJLBUTMPGLY-KGLIPLIRSA-N 1 1 335.404 2.001 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000412050052 466982767 /nfs/dbraw/zinc/98/27/67/466982767.db2.gz SCEUOZQXFWTEDQ-IATRGZMQSA-N 1 1 333.388 2.015 20 5 EEBDMO COC(=O)[C@@]1(C)CCC[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000412060685 466987745 /nfs/dbraw/zinc/98/77/45/466987745.db2.gz GPGFDEWLBNTCNM-PXAZEXFGSA-N 1 1 349.387 2.197 20 5 EEBDMO COC(=O)[C@@]1(C)CCC[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000412060685 466987750 /nfs/dbraw/zinc/98/77/50/466987750.db2.gz GPGFDEWLBNTCNM-PXAZEXFGSA-N 1 1 349.387 2.197 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(c2ccnc3c2cccc3[N+](=O)[O-])[C@H](C)C1 ZINC000432136678 467219066 /nfs/dbraw/zinc/21/90/66/467219066.db2.gz DNMMLUKCQYUGCP-CHWSQXEVSA-N 1 1 330.388 2.034 20 5 EEBDMO C[NH2+]Cc1noc(-c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)n1 ZINC000414503969 467415954 /nfs/dbraw/zinc/41/59/54/467415954.db2.gz RQJUQHYVARYKRR-UHFFFAOYSA-N 1 1 342.359 2.226 20 5 EEBDMO CC[N@@H+]1CCO[C@H](C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000452851720 467431362 /nfs/dbraw/zinc/43/13/62/467431362.db2.gz MYKDCOALCAESJF-WBVHZDCISA-N 1 1 347.415 2.022 20 5 EEBDMO CC[N@H+]1CCO[C@H](C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000452851720 467431365 /nfs/dbraw/zinc/43/13/65/467431365.db2.gz MYKDCOALCAESJF-WBVHZDCISA-N 1 1 347.415 2.022 20 5 EEBDMO C[N@H+]1CCC[C@H](CCNC(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000457529179 467643616 /nfs/dbraw/zinc/64/36/16/467643616.db2.gz LZSIACJQXRDNKQ-CQSZACIVSA-N 1 1 349.435 2.038 20 5 EEBDMO Cc1cc(OCC(=O)NCC[N@H+]2CCCC2(C)C)ccc1[N+](=O)[O-] ZINC000457046339 467738538 /nfs/dbraw/zinc/73/85/38/467738538.db2.gz BUMNHMWKKTUWDN-UHFFFAOYSA-N 1 1 335.404 2.273 20 5 EEBDMO COc1cc(C(=O)NCC[C@H]2CCC[N@@H+](C)C2)cc([N+](=O)[O-])c1C ZINC000458224746 467792419 /nfs/dbraw/zinc/79/24/19/467792419.db2.gz RPPWXQQGROOPJD-CYBMUJFWSA-N 1 1 335.404 2.374 20 5 EEBDMO CC[C@@H]1C[N@H+](CCNc2nccc3cc([N+](=O)[O-])ccc32)CCO1 ZINC000450484515 467857284 /nfs/dbraw/zinc/85/72/84/467857284.db2.gz MFPCYJNKILCOHS-OAHLLOKOSA-N 1 1 330.388 2.666 20 5 EEBDMO CC[C@@H]1C[N@@H+](CCNc2nccc3cc([N+](=O)[O-])ccc32)CCO1 ZINC000450484515 467857286 /nfs/dbraw/zinc/85/72/86/467857286.db2.gz MFPCYJNKILCOHS-OAHLLOKOSA-N 1 1 330.388 2.666 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCNc2nccc3c2cccc3[N+](=O)[O-])CCCO1 ZINC000450486208 467857977 /nfs/dbraw/zinc/85/79/77/467857977.db2.gz KRUKDJNJSBKZLM-CQSZACIVSA-N 1 1 344.415 3.056 20 5 EEBDMO COC(=O)c1cc(N2CC[N@@H+](C)[C@@H](C(C)C)C2)cc(C)c1[N+](=O)[O-] ZINC000487107528 468023053 /nfs/dbraw/zinc/02/30/53/468023053.db2.gz CMSYEDGGUBOIBH-OAHLLOKOSA-N 1 1 335.404 2.466 20 5 EEBDMO O=C(CCN[C@H]1CC[N@H+]2CCCC[C@H]12)Nc1ccccc1[N+](=O)[O-] ZINC000517732881 468095022 /nfs/dbraw/zinc/09/50/22/468095022.db2.gz RDQHWOAOPBLSJI-DZGCQCFKSA-N 1 1 332.404 2.140 20 5 EEBDMO O=C(CC[NH2+][C@H]1CCN2CCCC[C@H]12)Nc1ccccc1[N+](=O)[O-] ZINC000517732881 468095030 /nfs/dbraw/zinc/09/50/30/468095030.db2.gz RDQHWOAOPBLSJI-DZGCQCFKSA-N 1 1 332.404 2.140 20 5 EEBDMO O=C(C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)Nc1ccc(F)cc1 ZINC000488976020 468114829 /nfs/dbraw/zinc/11/48/29/468114829.db2.gz JZGKDOVNYWBEJO-UHFFFAOYSA-N 1 1 347.350 2.206 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](c2nccn2C)C1 ZINC000534581012 468265313 /nfs/dbraw/zinc/26/53/13/468265313.db2.gz ZWLBAKCGLAAVHN-QWHCGFSZSA-N 1 1 343.387 2.145 20 5 EEBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2nccn2C)C1 ZINC000534581012 468265318 /nfs/dbraw/zinc/26/53/18/468265318.db2.gz ZWLBAKCGLAAVHN-QWHCGFSZSA-N 1 1 343.387 2.145 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000520710199 468266404 /nfs/dbraw/zinc/26/64/04/468266404.db2.gz TYYJHDMSJKUWQZ-ZDUSSCGKSA-N 1 1 331.376 2.171 20 5 EEBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594195154 468507894 /nfs/dbraw/zinc/50/78/94/468507894.db2.gz CMDRULAZNYWQNF-LSDHHAIUSA-N 1 1 335.379 2.410 20 5 EEBDMO O=C(CCN[C@H]1CC[N@@H+]2CCC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000591726556 468510969 /nfs/dbraw/zinc/51/09/69/468510969.db2.gz MRTYLJKKDVPPAB-UONOGXRCSA-N 1 1 332.404 2.140 20 5 EEBDMO O=C(CCN[C@H]1CC[N@H+]2CCC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000591726556 468510975 /nfs/dbraw/zinc/51/09/75/468510975.db2.gz MRTYLJKKDVPPAB-UONOGXRCSA-N 1 1 332.404 2.140 20 5 EEBDMO Cc1c(CNC[C@@H](O)C[N@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000591763484 468517403 /nfs/dbraw/zinc/51/74/03/468517403.db2.gz LNGBZIRQAMVGOT-GOSISDBHSA-N 1 1 343.427 2.486 20 5 EEBDMO Cc1c(C[NH2+]C[C@@H](O)CN(C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000591763484 468517408 /nfs/dbraw/zinc/51/74/08/468517408.db2.gz LNGBZIRQAMVGOT-GOSISDBHSA-N 1 1 343.427 2.486 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H](c3cccnc3)C2)c1 ZINC000592140012 468633887 /nfs/dbraw/zinc/63/38/87/468633887.db2.gz SYENEIWQCWTTSX-DOTOQJQBSA-N 1 1 343.383 2.219 20 5 EEBDMO C[C@H]1CC2(C[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-])CCOCC2 ZINC000592182220 468647689 /nfs/dbraw/zinc/64/76/89/468647689.db2.gz MUFSLCXGAVBHBY-ZDUSSCGKSA-N 1 1 333.388 2.424 20 5 EEBDMO CNc1ccc(C(=O)N2CCC[C@]3(CC[N@@H+](C)C3)C2)cc1[N+](=O)[O-] ZINC000597716738 468648590 /nfs/dbraw/zinc/64/85/90/468648590.db2.gz TVHYWTRHMPWMAK-QGZVFWFLSA-N 1 1 332.404 2.194 20 5 EEBDMO CC(C)[C@@H]1CN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC[N@H+]1C ZINC000601156195 468764124 /nfs/dbraw/zinc/76/41/24/468764124.db2.gz SXAQFGWJKNTGQK-VIFPVBQESA-N 1 1 335.330 2.124 20 5 EEBDMO C[C@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C[C@H](C)S1(=O)=O ZINC000601167066 468768094 /nfs/dbraw/zinc/76/80/94/468768094.db2.gz YZMWEWHXANTEBJ-QWRGUYRKSA-N 1 1 335.385 2.155 20 5 EEBDMO CCOC(=O)c1ccnc(N2CCC[N@@H+](C)C[C@@H]2CC)c1[N+](=O)[O-] ZINC000601190107 468776351 /nfs/dbraw/zinc/77/63/51/468776351.db2.gz ZSSUCNLIKKQZLI-LBPRGKRZSA-N 1 1 336.392 2.087 20 5 EEBDMO CC[N@H+]1CCCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)[C@@H](C)C1 ZINC000601439885 468874934 /nfs/dbraw/zinc/87/49/34/468874934.db2.gz XCNNRHQJKSSSAV-ZDUSSCGKSA-N 1 1 341.433 2.008 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](C)[C@H](CO)C2)cccc1[N+](=O)[O-] ZINC000598650127 468944636 /nfs/dbraw/zinc/94/46/36/468944636.db2.gz MLBAKNFJCUIHBS-XBFCOCLRSA-N 1 1 335.404 2.181 20 5 EEBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C)[C@H](CO)C2)cccc1[N+](=O)[O-] ZINC000598650127 468944644 /nfs/dbraw/zinc/94/46/44/468944644.db2.gz MLBAKNFJCUIHBS-XBFCOCLRSA-N 1 1 335.404 2.181 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000595705591 468963092 /nfs/dbraw/zinc/96/30/92/468963092.db2.gz WXFAOWVGQQSSNM-CQSZACIVSA-N 1 1 349.435 2.179 20 5 EEBDMO CCN1C[C@@H](C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)Oc2ccccc21 ZINC000610484841 468981245 /nfs/dbraw/zinc/98/12/45/468981245.db2.gz OOUMUVMBPGNAKI-CQSZACIVSA-N 1 1 345.403 2.011 20 5 EEBDMO CC[C@H](C)[C@H](C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)OC ZINC000602674924 469004970 /nfs/dbraw/zinc/00/49/70/469004970.db2.gz FYIOPDLILHTEFB-YOEHRIQHSA-N 1 1 349.431 2.414 20 5 EEBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000593518969 469013248 /nfs/dbraw/zinc/01/32/48/469013248.db2.gz WWLIUCDTHXOHCT-CYBMUJFWSA-N 1 1 337.395 2.371 20 5 EEBDMO CC1(C)CC[N@@H+](CC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)C1 ZINC000573136019 469068438 /nfs/dbraw/zinc/06/84/38/469068438.db2.gz NAGVBNYRCIFJGR-UHFFFAOYSA-N 1 1 333.388 2.048 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000602839722 469110121 /nfs/dbraw/zinc/11/01/21/469110121.db2.gz JHGOJDARYGORTJ-CABCVRRESA-N 1 1 334.420 2.381 20 5 EEBDMO C[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC[C@H]1C(=O)OC(C)(C)C ZINC000599587013 469301257 /nfs/dbraw/zinc/30/12/57/469301257.db2.gz KGUPLAHXGTXUDU-CHWSQXEVSA-N 1 1 338.408 2.091 20 5 EEBDMO O=C(C[N@@H+](CCCO)C1CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609849144 469965718 /nfs/dbraw/zinc/96/57/18/469965718.db2.gz GHIPSKNHCMERCG-UHFFFAOYSA-N 1 1 327.768 2.034 20 5 EEBDMO O=C(C[N@H+](CCCO)C1CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609849144 469965722 /nfs/dbraw/zinc/96/57/22/469965722.db2.gz GHIPSKNHCMERCG-UHFFFAOYSA-N 1 1 327.768 2.034 20 5 EEBDMO CC(C)COC[C@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1ccco1 ZINC000184218938 528110367 /nfs/dbraw/zinc/11/03/67/528110367.db2.gz CHWLRCQEZTUBBM-HNNXBMFYSA-N 1 1 349.387 2.353 20 5 EEBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@@H](n4ccnc4)C3)c2c1 ZINC000738160913 578002004 /nfs/dbraw/zinc/00/20/04/578002004.db2.gz ZWWDHBYEIFEYEU-OAHLLOKOSA-N 1 1 326.360 2.436 20 5 EEBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@@H](n4ccnc4)C3)c2c1 ZINC000738160913 578002005 /nfs/dbraw/zinc/00/20/05/578002005.db2.gz ZWWDHBYEIFEYEU-OAHLLOKOSA-N 1 1 326.360 2.436 20 5 EEBDMO C[N@@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1CCCC1 ZINC000726585119 576277848 /nfs/dbraw/zinc/27/78/48/576277848.db2.gz MKWAUWIKMHFGMS-UHFFFAOYSA-N 1 1 332.360 2.195 20 5 EEBDMO CC1(C2CC[NH+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)OCCO1 ZINC000769754682 577583563 /nfs/dbraw/zinc/58/35/63/577583563.db2.gz XVKJNEWTZVSOEG-UHFFFAOYSA-N 1 1 346.387 2.446 20 5 EEBDMO C[N@@H+](CC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CCSC1 ZINC000764568592 577739045 /nfs/dbraw/zinc/73/90/45/577739045.db2.gz LWEGASCZVPZNEQ-LBPRGKRZSA-N 1 1 343.836 2.302 20 5 EEBDMO Cc1cn(C[N@H+]2C[C@H](C)[C@H](C)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000751926021 577762445 /nfs/dbraw/zinc/76/24/45/577762445.db2.gz SSGRXSNYFKTECI-BETUJISGSA-N 1 1 330.388 2.401 20 5 EEBDMO Cc1cn(C[N@@H+]2C[C@H](C)[C@H](C)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000751926021 577762446 /nfs/dbraw/zinc/76/24/46/577762446.db2.gz SSGRXSNYFKTECI-BETUJISGSA-N 1 1 330.388 2.401 20 5 EEBDMO Cc1c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000748713185 577966006 /nfs/dbraw/zinc/96/60/06/577966006.db2.gz QXJRSSOJCGAIDQ-KBPBESRZSA-N 1 1 348.359 2.168 20 5 EEBDMO Cc1nn(C[NH+]2CCC(OC(C)C)CC2)c2ncc([N+](=O)[O-])cc12 ZINC000749951255 577984443 /nfs/dbraw/zinc/98/44/43/577984443.db2.gz PIVYFVIUOYNCDI-UHFFFAOYSA-N 1 1 333.392 2.495 20 5 EEBDMO C[C@@H]1C[C@H](C)C[N@@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000740859772 578108197 /nfs/dbraw/zinc/10/81/97/578108197.db2.gz MQNCDWKQKXYKNE-NWDGAFQWSA-N 1 1 332.360 2.051 20 5 EEBDMO CCO[C@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000932972142 676385400 /nfs/dbraw/zinc/38/54/00/676385400.db2.gz CIHAOUXSYRAYTB-ZDUSSCGKSA-N 1 1 335.360 2.004 20 5 EEBDMO C[C@H](CNC(=O)NC[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000891980375 677838799 /nfs/dbraw/zinc/83/87/99/677838799.db2.gz FJVBPTQZTPNEEJ-ZIAGYGMSSA-N 1 1 346.431 2.482 20 5 EEBDMO C[C@H](c1cccc(Nc2c([N+](=O)[O-])cnn2C)c1)[NH+]1CCOCC1 ZINC000892332784 679091254 /nfs/dbraw/zinc/09/12/54/679091254.db2.gz BRAKKAHMQXLDBB-GFCCVEGCSA-N 1 1 331.376 2.465 20 5 EEBDMO C[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC000180397519 681995445 /nfs/dbraw/zinc/99/54/45/681995445.db2.gz ZITDJEJFTDCWOY-JTQLQIEISA-N 1 1 344.327 2.453 20 5 EEBDMO COC(=O)[C@@H]1[C@H](C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1(F)F ZINC000894331928 682509126 /nfs/dbraw/zinc/50/91/26/682509126.db2.gz KHDCQMSXGQSXOV-ONGXEEELSA-N 1 1 334.706 2.392 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCC2(C[C@H]1F)OCCO2 ZINC000892939699 683232343 /nfs/dbraw/zinc/23/23/43/683232343.db2.gz UYEVKESIDXEABU-KGLIPLIRSA-N 1 1 340.351 2.327 20 5 EEBDMO CCC(=O)c1ccc(N[C@H](C)[C@H]2C[N@H+](C)CCN2C)c([N+](=O)[O-])c1 ZINC000895245219 684369245 /nfs/dbraw/zinc/36/92/45/684369245.db2.gz DKCARPTWDMKPAU-MLGOLLRUSA-N 1 1 334.420 2.234 20 5 EEBDMO CCC(=O)c1ccc(N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])c1 ZINC000895245219 684369251 /nfs/dbraw/zinc/36/92/51/684369251.db2.gz DKCARPTWDMKPAU-MLGOLLRUSA-N 1 1 334.420 2.234 20 5 EEBDMO CCC[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C(=O)OC ZINC000897835592 691797864 /nfs/dbraw/zinc/79/78/64/691797864.db2.gz PKCBMGAEINEBJI-MRXNPFEDSA-N 1 1 335.404 2.495 20 5 EEBDMO C[N@H+](CCn1cccn1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000111168554 692978836 /nfs/dbraw/zinc/97/88/36/692978836.db2.gz DWZZEGLVYQUXAU-UHFFFAOYSA-N 1 1 326.360 2.244 20 5 EEBDMO C[N@@H+](CCn1cccn1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000111168554 692978842 /nfs/dbraw/zinc/97/88/42/692978842.db2.gz DWZZEGLVYQUXAU-UHFFFAOYSA-N 1 1 326.360 2.244 20 5 EEBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000813630123 1199110313 /nfs/dbraw/zinc/11/03/13/1199110313.db2.gz HTWKUHCVFLWPDO-CYBMUJFWSA-N 1 1 346.431 2.265 20 5 EEBDMO O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)O[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000810839558 1199773408 /nfs/dbraw/zinc/77/34/08/1199773408.db2.gz XIRQTUDLDQZJFS-DZGCQCFKSA-N 1 1 344.371 2.115 20 5 EEBDMO CONC(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000877786789 1200105437 /nfs/dbraw/zinc/10/54/37/1200105437.db2.gz YTIWSHOVQSXKTJ-UHFFFAOYSA-N 1 1 327.768 2.138 20 5 EEBDMO COCC1(C)CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1 ZINC000870913206 1200948004 /nfs/dbraw/zinc/94/80/04/1200948004.db2.gz WERGBTMKAHCDQN-QGZVFWFLSA-N 1 1 335.404 2.044 20 5 EEBDMO CC(=O)NC[C@H]1CCC[N@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000121121750 1201555620 /nfs/dbraw/zinc/55/56/20/1201555620.db2.gz LSQIXUFLKYRJDF-CQSZACIVSA-N 1 1 345.403 2.059 20 5 EEBDMO CC(=O)NC[C@H]1CCC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000121121750 1201555625 /nfs/dbraw/zinc/55/56/25/1201555625.db2.gz LSQIXUFLKYRJDF-CQSZACIVSA-N 1 1 345.403 2.059 20 5 EEBDMO C[C@]([NH3+])(C(=O)N1CCc2ccc(F)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000867977161 1201718542 /nfs/dbraw/zinc/71/85/42/1201718542.db2.gz AGNQPWSKZYENBE-GOSISDBHSA-N 1 1 343.358 2.493 20 5 EEBDMO CC[N@H+]1CC[C@H]1CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000890065612 1204775014 /nfs/dbraw/zinc/77/50/14/1204775014.db2.gz KZDZRHZIPUHALY-INIZCTEOSA-N 1 1 332.404 2.363 20 5 EEBDMO C[N@@H+]1CC[C@H]1CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000928563810 1206400073 /nfs/dbraw/zinc/40/00/73/1206400073.db2.gz SBMRBGXCYIQUPN-LBPRGKRZSA-N 1 1 332.385 2.152 20 5 EEBDMO C[N@H+]1CC[C@H]1CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000928563810 1206400075 /nfs/dbraw/zinc/40/00/75/1206400075.db2.gz SBMRBGXCYIQUPN-LBPRGKRZSA-N 1 1 332.385 2.152 20 5 EEBDMO CC(C)(C)NC(=O)[C@H]1CCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000932440962 1207607313 /nfs/dbraw/zinc/60/73/13/1207607313.db2.gz XCGPBGMMCLITGH-OAHLLOKOSA-N 1 1 335.404 2.353 20 5 EEBDMO O=C(/C=C\C1CC1)N1C[C@@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@@H]2C1 ZINC001048746856 1238502434 /nfs/dbraw/zinc/50/24/34/1238502434.db2.gz YRORTIVETPBNEC-NBAKUHIDSA-N 1 1 341.411 2.451 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001097231200 1243857703 /nfs/dbraw/zinc/85/77/03/1243857703.db2.gz UMTMFCCPYNQMRE-OKILXGFUSA-N 1 1 334.420 2.384 20 5 EEBDMO CC[C@@H](C)C[N@@H+](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000111254846 1292361932 /nfs/dbraw/zinc/36/19/32/1292361932.db2.gz CWWGSCHZCDRMQC-OAHLLOKOSA-N 1 1 348.447 2.221 20 5 EEBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC[N@H+]1CC[C@@H](O)C1 ZINC000862532083 1295869022 /nfs/dbraw/zinc/86/90/22/1295869022.db2.gz PBPPTXBXVRIROJ-LLVKDONJSA-N 1 1 334.203 2.058 20 5 EEBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC[N@@H+]1CC[C@@H](O)C1 ZINC000862532083 1295869028 /nfs/dbraw/zinc/86/90/28/1295869028.db2.gz PBPPTXBXVRIROJ-LLVKDONJSA-N 1 1 334.203 2.058 20 5 EEBDMO CCCSc1nc(O[C@@H]2C[NH2+]CCC[C@H]2F)c([N+](=O)[O-])c(=O)[nH]1 ZINC001217977798 1297540367 /nfs/dbraw/zinc/54/03/67/1297540367.db2.gz BMCNGYMRFKLCFR-RKDXNWHRSA-N 1 1 346.384 2.061 20 5 EEBDMO COC(=O)c1cccc([N+](=O)[O-])c1CO[C@H]1CCc2[nH+]ccn2C1 ZINC001222778261 1299849881 /nfs/dbraw/zinc/84/98/81/1299849881.db2.gz VKRJOSFVPYWBDK-NSHDSACASA-N 1 1 331.328 2.110 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N1C[C@H]2CC[C@@H](C1)N2c1ccc([N+](=O)[O-])cc1 ZINC001102198588 1300549438 /nfs/dbraw/zinc/54/94/38/1300549438.db2.gz FYIJXQLHYYAOKJ-CALCHBBNSA-N 1 1 346.431 2.116 20 5 EEBDMO COC(=O)c1ccc(O[C@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c([N+](=O)[O-])c1 ZINC001227298364 1301771147 /nfs/dbraw/zinc/77/11/47/1301771147.db2.gz PFXRNKLQYSJHRU-VIKVFOODSA-N 1 1 334.372 2.491 20 5 EEBDMO CC[N@H+](C)CCC(=O)NC1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC001229895128 1302979004 /nfs/dbraw/zinc/97/90/04/1302979004.db2.gz DPUOPDIKTSMNKM-UHFFFAOYSA-N 1 1 348.447 2.017 20 5 EEBDMO CC[N@@H+](C)CCC(=O)NC1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC001229895128 1302979008 /nfs/dbraw/zinc/97/90/08/1302979008.db2.gz DPUOPDIKTSMNKM-UHFFFAOYSA-N 1 1 348.447 2.017 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+](C(C)(C)C)C1 ZINC001118778066 1308941165 /nfs/dbraw/zinc/94/11/65/1308941165.db2.gz RECYWKSXUXXNTG-LBPRGKRZSA-N 1 1 334.420 2.487 20 5 EEBDMO C[C@H](COC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C[NH+]1CCOCC1 ZINC001123322909 1310522408 /nfs/dbraw/zinc/52/24/08/1310522408.db2.gz RRQUQGYMDSIJLN-NSHDSACASA-N 1 1 342.779 2.373 20 5 EEBDMO COc1cncc(-c2noc([C@@H]([NH3+])Cc3ccccc3[N+](=O)[O-])n2)c1 ZINC001247673385 1310672283 /nfs/dbraw/zinc/67/22/83/1310672283.db2.gz PWTZQWWYZCAESX-ZDUSSCGKSA-N 1 1 341.327 2.291 20 5 EEBDMO CC1(C)CCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000837177047 1315059318 /nfs/dbraw/zinc/05/93/18/1315059318.db2.gz KSEVKWPQPOLVCG-UHFFFAOYSA-N 1 1 336.348 2.107 20 5 EEBDMO O=[N+]([O-])c1cccc(C[N@H+]2C[C@H]3[C@H](CO)[C@H]3C2)c1Br ZINC000839606366 1315219109 /nfs/dbraw/zinc/21/91/09/1315219109.db2.gz PRIAERNZZBKGJR-URLYPYJESA-N 1 1 327.178 2.027 20 5 EEBDMO O=[N+]([O-])c1cccc(C[N@@H+]2C[C@H]3[C@H](CO)[C@H]3C2)c1Br ZINC000839606366 1315219112 /nfs/dbraw/zinc/21/91/12/1315219112.db2.gz PRIAERNZZBKGJR-URLYPYJESA-N 1 1 327.178 2.027 20 5 EEBDMO C[C@H]1[C@@H](CO)CCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000839668618 1315228628 /nfs/dbraw/zinc/22/86/28/1315228628.db2.gz DEBAEYVOHFRXGV-WDEREUQCSA-N 1 1 341.795 2.280 20 5 EEBDMO C[C@H]1[C@@H](CO)CCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000839668618 1315228632 /nfs/dbraw/zinc/22/86/32/1315228632.db2.gz DEBAEYVOHFRXGV-WDEREUQCSA-N 1 1 341.795 2.280 20 5 EEBDMO CO[C@@H]1C[C@H]([N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C12CCC2 ZINC000840141150 1315307806 /nfs/dbraw/zinc/30/78/06/1315307806.db2.gz QBWJGKGFDQXRAT-LSDHHAIUSA-N 1 1 345.403 2.495 20 5 EEBDMO CN1C(=O)CC[C@@H]2C[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC[C@H]21 ZINC001254606093 1318142434 /nfs/dbraw/zinc/14/24/34/1318142434.db2.gz DNYSXGACPPKHGL-XOKHGSTOSA-N 1 1 329.400 2.005 20 5 EEBDMO Cc1ccc(CC[NH2+]CC2(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001164494792 1321396164 /nfs/dbraw/zinc/39/61/64/1321396164.db2.gz SGALDKNYQMHKPP-IAGOWNOFSA-N 1 1 345.443 2.079 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(c3ccc(-c4ccc(F)c([N+](=O)[O-])c4)nn3)C[C@H]2C1 ZINC001165151287 1321466081 /nfs/dbraw/zinc/46/60/81/1321466081.db2.gz QNUMONLUCIAQQD-BETUJISGSA-N 1 1 343.362 2.189 20 5 EEBDMO Cc1ccc(C[N@@H+]2CCCN(c3nn(C)cc3[N+](=O)[O-])CC2)cc1 ZINC001306919913 1331499095 /nfs/dbraw/zinc/49/90/95/1331499095.db2.gz JNVZEXGNXYPVRG-UHFFFAOYSA-N 1 1 329.404 2.349 20 5 EEBDMO CCC[N@H+]1CC[C@@H](Nc2c3cc(OC)ccc3ncc2[N+](=O)[O-])C1 ZINC001307175587 1331514907 /nfs/dbraw/zinc/51/49/07/1331514907.db2.gz NDBACPDIRPXZJY-GFCCVEGCSA-N 1 1 330.388 2.470 20 5 EEBDMO Cc1ccc(C[N@H+]2CC[C@@H](c3cc(=O)[nH]c(=O)[nH]3)C2)cc1[N+](=O)[O-] ZINC001307890826 1331554323 /nfs/dbraw/zinc/55/43/23/1331554323.db2.gz NIYWTOXIMGSSML-GFCCVEGCSA-N 1 1 330.344 2.094 20 5 EEBDMO Nc1ccc(NC(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC001310991963 1331740774 /nfs/dbraw/zinc/74/07/74/1331740774.db2.gz IHOOVTSYFXBOLA-ZDUSSCGKSA-N 1 1 333.392 2.315 20 5 EEBDMO COC(=O)[C@H]1CCC[C@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001324859270 1333775374 /nfs/dbraw/zinc/77/53/74/1333775374.db2.gz SRJSLHFIPIGEBV-QWHCGFSZSA-N 1 1 346.343 2.076 20 5 EEBDMO Cc1ccc(C[N@H+]2CCCN(CCn3cc([N+](=O)[O-])cn3)CC2)cc1 ZINC001330693557 1334887694 /nfs/dbraw/zinc/88/76/94/1334887694.db2.gz CUUSALCSCCBGEQ-UHFFFAOYSA-N 1 1 343.431 2.308 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC001334844270 1336302889 /nfs/dbraw/zinc/30/28/89/1336302889.db2.gz KZYILCILXHEHGQ-DZGCQCFKSA-N 1 1 333.388 2.343 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC001334844270 1336302891 /nfs/dbraw/zinc/30/28/91/1336302891.db2.gz KZYILCILXHEHGQ-DZGCQCFKSA-N 1 1 333.388 2.343 20 5 EEBDMO O=[N+]([O-])c1ccc(C(F)(F)F)cc1N1CC[NH+](CCCO)CC1 ZINC001335843633 1336436060 /nfs/dbraw/zinc/43/60/60/1336436060.db2.gz QETXOJSRDXDOFS-UHFFFAOYSA-N 1 1 333.310 2.118 20 5 EEBDMO CC[C@H]([NH2+]Cc1ccc(-c2nn[nH]n2)cn1)c1cccc([N+](=O)[O-])c1 ZINC001604061735 1350843334 /nfs/dbraw/zinc/84/33/34/1350843334.db2.gz NXLDXQWUWAEPBO-HNNXBMFYSA-N 1 1 339.359 2.411 20 5 EEBDMO CCn1c(-c2c[nH]c([N+](=O)[O-])c2)nnc1N1C[C@H](C)[N@@H+](CC)C[C@H]1C ZINC001121720005 1371918887 /nfs/dbraw/zinc/91/88/87/1371918887.db2.gz LECVGLQLQHLCLC-NWDGAFQWSA-N 1 1 347.423 2.120 20 5 EEBDMO C[C@@]([NH3+])(C(=O)Nc1cc(C(F)(F)F)no1)c1cccc([N+](=O)[O-])c1 ZINC001576086398 1403559874 /nfs/dbraw/zinc/55/98/74/1403559874.db2.gz ROXKMQWTGXZGHY-LBPRGKRZSA-N 1 1 344.249 2.414 20 5 EEBDMO CC[C@@H]1C[N@@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])CCS1 ZINC001590521325 1403883935 /nfs/dbraw/zinc/88/39/35/1403883935.db2.gz CEQNNIQQKNAYJL-SNVBAGLBSA-N 1 1 334.405 2.102 20 5 EEBDMO COc1cc2ncnc(N3C[C@H](C)[N@@H+](C)C[C@H]3C)c2cc1[N+](=O)[O-] ZINC001164642509 719202250 /nfs/dbraw/zinc/20/22/50/719202250.db2.gz WAZMNJJEVHNCSB-WDEREUQCSA-N 1 1 331.376 2.075 20 5 EEBDMO CCN(CCNc1ccc(F)cc1[N+](=O)[O-])C(=O)Cn1c[nH+]cc1C ZINC001106892742 769430861 /nfs/dbraw/zinc/43/08/61/769430861.db2.gz YHWOODRRYKOJSJ-UHFFFAOYSA-N 1 1 349.366 2.199 20 5 EEBDMO Cc1[nH+]ccn1CC(=O)N(C)CCN(C)c1ccc([N+](=O)[O-])c(C)c1 ZINC001105405344 782750244 /nfs/dbraw/zinc/75/02/44/782750244.db2.gz YSHLPZXUXXNFNE-UHFFFAOYSA-N 1 1 345.403 2.003 20 5 EEBDMO Cc1ccc(C(=O)NCC2C[NH+](Cc3cccc([N+](=O)[O-])c3)C2)o1 ZINC001031533241 769444407 /nfs/dbraw/zinc/44/44/07/769444407.db2.gz VLGKJRNDDKLLJC-UHFFFAOYSA-N 1 1 329.356 2.358 20 5 EEBDMO Cc1ccc(C(=O)NCC2C[NH+](Cc3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC001031547412 769524192 /nfs/dbraw/zinc/52/41/92/769524192.db2.gz NQVXTHYSJAWTBK-UHFFFAOYSA-N 1 1 340.383 2.160 20 5 EEBDMO C[C@@H](NC(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000919627661 770090098 /nfs/dbraw/zinc/09/00/98/770090098.db2.gz OUOSAQRMOXWGCN-IUODEOHRSA-N 1 1 332.404 2.439 20 5 EEBDMO Cc1cnccc1C(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001031652745 770657950 /nfs/dbraw/zinc/65/79/50/770657950.db2.gz QEYKEJHPDLXXIQ-UHFFFAOYSA-N 1 1 340.383 2.160 20 5 EEBDMO O=C(NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)[C@H]1C[C@H]2C[C@H]2C1 ZINC001031909929 779323887 /nfs/dbraw/zinc/32/38/87/779323887.db2.gz DNCSINDJKNHTHT-ZSHCYNCHSA-N 1 1 329.400 2.189 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)NC[C@H]1C[C@H](Nc2ccccc2[N+](=O)[O-])C1 ZINC001091491226 791003897 /nfs/dbraw/zinc/00/38/97/791003897.db2.gz MHYDBOBHMHVAEF-HDJSIYSDSA-N 1 1 343.387 2.107 20 5 EEBDMO Cc1ccc(C)c(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC000996429293 786396002 /nfs/dbraw/zinc/39/60/02/786396002.db2.gz OLBXBIGGXVCWAO-IAGOWNOFSA-N 1 1 331.416 2.049 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]Cc2sccc2Cl)CC1 ZINC000996429310 786396039 /nfs/dbraw/zinc/39/60/39/786396039.db2.gz OZSRMVCHOPKLJL-ZYHUDNBSSA-N 1 1 343.836 2.147 20 5 EEBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C[C@@](C)(O)c1ccccc1 ZINC000823606200 787829827 /nfs/dbraw/zinc/82/98/27/787829827.db2.gz QZIUSXDUAACVCW-QZTJIDSGSA-N 1 1 330.384 2.468 20 5 EEBDMO Nc1ccc(NC(=O)NCc2c[nH+]c3n2CCCC3)cc1[N+](=O)[O-] ZINC000823944601 787995229 /nfs/dbraw/zinc/99/52/29/787995229.db2.gz AKSZLDYYNHKETQ-UHFFFAOYSA-N 1 1 330.348 2.032 20 5 EEBDMO Cc1cc(NCCNC(=O)C[N@H+]2CCC(C)(C)C2)ccc1[N+](=O)[O-] ZINC001094140354 795958250 /nfs/dbraw/zinc/95/82/50/795958250.db2.gz IDPUUZIAZKJVGJ-UHFFFAOYSA-N 1 1 334.420 2.163 20 5 EEBDMO Cc1[nH+]ccn1CCCC(=O)NCCCNc1ccc([N+](=O)[O-])cc1 ZINC001094488841 796278912 /nfs/dbraw/zinc/27/89/12/796278912.db2.gz HEOBAFQGEVSYOY-UHFFFAOYSA-N 1 1 345.403 2.498 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)C[NH+]1[C@@H](C)CC[C@@H]1C ZINC000785730479 806558874 /nfs/dbraw/zinc/55/88/74/806558874.db2.gz KCFNUUWQAHWSES-STQMWFEESA-N 1 1 349.387 2.258 20 5 EEBDMO O=C1NC[C@@]2(CCC[N@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C2)O1 ZINC001172922493 797153447 /nfs/dbraw/zinc/15/34/47/797153447.db2.gz YGTWFGAHXXOYFR-CRAIPNDOSA-N 1 1 345.399 2.417 20 5 EEBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(C[C@H]2CCCO2)CC1 ZINC001173225994 797309792 /nfs/dbraw/zinc/30/97/92/797309792.db2.gz GWROZBXPMIZOOE-MAUKXSAKSA-N 1 1 333.432 2.322 20 5 EEBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](Oc2cnccn2)C1 ZINC001173238542 797324651 /nfs/dbraw/zinc/32/46/51/797324651.db2.gz VEDZVOPOPPXQSA-CJNGLKHVSA-N 1 1 328.372 2.469 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N1CCC(Nc2ncc([N+](=O)[O-])cc2C)CC1 ZINC001095233881 797565820 /nfs/dbraw/zinc/56/58/20/797565820.db2.gz XCWJJIPLWNRNKF-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO O=C(NC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1)c1ccncc1 ZINC001002238521 797757501 /nfs/dbraw/zinc/75/75/01/797757501.db2.gz KWTDDFFZEZJTKL-UHFFFAOYSA-N 1 1 340.383 2.384 20 5 EEBDMO CCc1[nH]nc(C(=O)N2CCCC[C@H]2[C@@H](C)C[NH+](C)C)c1[N+](=O)[O-] ZINC000823484748 798737874 /nfs/dbraw/zinc/73/78/74/798737874.db2.gz XELQPFMDBMBOND-AAEUAGOBSA-N 1 1 337.424 2.073 20 5 EEBDMO CC[N@H+]([C@@H]1CCOC1)C1CCN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169033667 803578578 /nfs/dbraw/zinc/57/85/78/803578578.db2.gz DEXHSGPMTPHMHQ-USXIJHARSA-N 1 1 325.453 2.007 20 5 EEBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169033667 803578583 /nfs/dbraw/zinc/57/85/83/803578583.db2.gz DEXHSGPMTPHMHQ-USXIJHARSA-N 1 1 325.453 2.007 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2Cc3cncn3C[C@@H](COCC3CC3)C2)C1 ZINC001169021699 803588613 /nfs/dbraw/zinc/58/86/13/803588613.db2.gz PQOJAFAECSEDHV-IKGGRYGDSA-N 1 1 348.447 2.187 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2Cc3nccn3C[C@H](COCC3CC3)C2)C1 ZINC001169026215 803591755 /nfs/dbraw/zinc/59/17/55/803591755.db2.gz VTBWXUVKMFLYRL-IKGGRYGDSA-N 1 1 348.447 2.187 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2Cc3nccn3C[C@H](COCC3CC3)C2)C1 ZINC001169026215 803591758 /nfs/dbraw/zinc/59/17/58/803591758.db2.gz VTBWXUVKMFLYRL-IKGGRYGDSA-N 1 1 348.447 2.187 20 5 EEBDMO C[C@H]1CC[N@@H+](CCNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000791130888 809066839 /nfs/dbraw/zinc/06/68/39/809066839.db2.gz DNRFWOZCMOFTOE-JTQLQIEISA-N 1 1 343.786 2.388 20 5 EEBDMO CCc1[nH]nc(C(=O)N2CC[NH+](CCC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000171804121 529466537 /nfs/dbraw/zinc/46/65/37/529466537.db2.gz HHANSAPPUFBBEI-UHFFFAOYSA-N 1 1 337.424 2.074 20 5 EEBDMO CCCC[N@H+](CCO)CC(=O)Nc1ccc(OCC)cc1[N+](=O)[O-] ZINC000072950561 216331076 /nfs/dbraw/zinc/33/10/76/216331076.db2.gz WUDGNONKNSYAPE-UHFFFAOYSA-N 1 1 339.392 2.026 20 5 EEBDMO CCCC[N@@H+](CCO)CC(=O)Nc1ccc(OCC)cc1[N+](=O)[O-] ZINC000072950561 216331079 /nfs/dbraw/zinc/33/10/79/216331079.db2.gz WUDGNONKNSYAPE-UHFFFAOYSA-N 1 1 339.392 2.026 20 5 EEBDMO COC(=O)[C@H]1CCCC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000073502094 216391342 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2.467 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCCC[C@H]1C[C@H](C)O ZINC000447839134 242325014 /nfs/dbraw/zinc/32/50/14/242325014.db2.gz HRQLQWKCEHCXQR-KBPBESRZSA-N 1 1 335.404 2.467 20 5 EEBDMO COC(=O)Cc1ccc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000450253488 242766305 /nfs/dbraw/zinc/76/63/05/242766305.db2.gz OIWCMJXWAWVBCX-ZIAGYGMSSA-N 1 1 333.388 2.349 20 5 EEBDMO CCCNC(=O)NC(=O)C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451555776 243156985 /nfs/dbraw/zinc/15/69/85/243156985.db2.gz CEBZTKJLSZBWFQ-CQSZACIVSA-N 1 1 348.403 2.010 20 5 EEBDMO CCCNC(=O)NC(=O)C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451555776 243156990 /nfs/dbraw/zinc/15/69/90/243156990.db2.gz CEBZTKJLSZBWFQ-CQSZACIVSA-N 1 1 348.403 2.010 20 5 EEBDMO O=C(CC[N@H+]1CC[C@@H]2C[C@H](O)CC[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000451700630 243213964 /nfs/dbraw/zinc/21/39/64/243213964.db2.gz YBOCSNKENDVOPX-QLFBSQMISA-N 1 1 347.415 2.406 20 5 EEBDMO C[C@@H]1CN(Cc2c([N+](=O)[O-])ncn2C)CC[N@@H+](Cc2ccccc2)C1 ZINC000451714871 243223335 /nfs/dbraw/zinc/22/33/35/243223335.db2.gz WAYABYRSYXUZGR-HNNXBMFYSA-N 1 1 343.431 2.282 20 5 EEBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@H]2Cc2ccccc2)c1 ZINC000266528396 248347069 /nfs/dbraw/zinc/34/70/69/248347069.db2.gz LEFPNSAJAPSSQG-FUHWJXTLSA-N 1 1 344.415 2.249 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCS1 ZINC000117339177 221054772 /nfs/dbraw/zinc/05/47/72/221054772.db2.gz ADLBOKNDWLYOKP-LLVKDONJSA-N 1 1 337.401 2.330 20 5 EEBDMO Cc1cc(N(C)S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc[nH+]1 ZINC000274239659 256366838 /nfs/dbraw/zinc/36/68/38/256366838.db2.gz SWHGCQHTXFZKKU-UHFFFAOYSA-N 1 1 335.385 2.307 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000119773726 142377152 /nfs/dbraw/zinc/37/71/52/142377152.db2.gz HWJGWGVOYTYQGT-OAHLLOKOSA-N 1 1 346.431 2.453 20 5 EEBDMO COC(=O)[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000191830516 152277281 /nfs/dbraw/zinc/27/72/81/152277281.db2.gz YOXIPKCQGZQWOF-DOMZBBRYSA-N 1 1 349.387 2.054 20 5 EEBDMO C[C@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000249747202 160384934 /nfs/dbraw/zinc/38/49/34/160384934.db2.gz ODKBNDBWDZUCLX-HZSPNIEDSA-N 1 1 334.420 2.384 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1C(C)(C)O ZINC000305439521 160516279 /nfs/dbraw/zinc/51/62/79/160516279.db2.gz LGXBVWBWAMVIBL-HNNXBMFYSA-N 1 1 335.404 2.467 20 5 EEBDMO C[C@H](c1ccccn1)[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000245738423 160250386 /nfs/dbraw/zinc/25/03/86/160250386.db2.gz VDXXWTIJQRLGJR-UKRRQHHQSA-N 1 1 331.372 2.423 20 5 EEBDMO CC(C)C[C@H]1COCC[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248439854 160346056 /nfs/dbraw/zinc/34/60/56/160346056.db2.gz CQTFOGYXUBHBMR-LSDHHAIUSA-N 1 1 338.404 2.081 20 5 EEBDMO CC(C)C[C@H]1COCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248439854 160346057 /nfs/dbraw/zinc/34/60/57/160346057.db2.gz CQTFOGYXUBHBMR-LSDHHAIUSA-N 1 1 338.404 2.081 20 5 EEBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2ccccc2F)cc1 ZINC000342355859 161059141 /nfs/dbraw/zinc/05/91/41/161059141.db2.gz KOUUNPVCQODOFA-UHFFFAOYSA-N 1 1 338.360 2.297 20 5 EEBDMO CC[C@H](NC(=O)[C@@H]1CC[NH2+]CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000342664182 161081599 /nfs/dbraw/zinc/08/15/99/161081599.db2.gz YLYJBWSOSLQZBC-STQMWFEESA-N 1 1 327.331 2.407 20 5 EEBDMO Cc1cccc(C[N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])n1 ZINC000342744348 161087480 /nfs/dbraw/zinc/08/74/80/161087480.db2.gz XZKVHNDXPZWIFD-OAHLLOKOSA-N 1 1 331.372 2.170 20 5 EEBDMO C[C@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CCC[N@H+]1C ZINC000343575273 161148125 /nfs/dbraw/zinc/14/81/25/161148125.db2.gz WSXBAMIZZIJFAP-CABZTGNLSA-N 1 1 343.330 2.409 20 5 EEBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)N1CCN(C)CC1 ZINC000344851193 161250904 /nfs/dbraw/zinc/25/09/04/161250904.db2.gz LEWRHHOPQDYELT-SFKKXYGYSA-N 1 1 332.448 2.224 20 5 EEBDMO C[C@H]1[C@@H]([NH+]2CCOCC2)CCN1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351998377 162020126 /nfs/dbraw/zinc/02/01/26/162020126.db2.gz UZARRQNJSONKCL-ZBEGNZNMSA-N 1 1 341.358 2.168 20 5 EEBDMO C[NH+](C)Cc1ccc(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)cc1 ZINC000355380490 163168624 /nfs/dbraw/zinc/16/86/24/163168624.db2.gz NMZFOTUCZQEHMR-UHFFFAOYSA-N 1 1 329.356 2.292 20 5 EEBDMO O=C1CCCN1C[C@H]1CCCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000363525401 164905442 /nfs/dbraw/zinc/90/54/42/164905442.db2.gz NYYQCIFYTZGLPW-MRXNPFEDSA-N 1 1 347.415 2.451 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CC[C@H](n4cncn4)C3)co2)cc1 ZINC000364452691 165141637 /nfs/dbraw/zinc/14/16/37/165141637.db2.gz HJPFVYXCFAQJPE-HNNXBMFYSA-N 1 1 340.343 2.288 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@H](n4cncn4)C3)co2)cc1 ZINC000364452691 165141640 /nfs/dbraw/zinc/14/16/40/165141640.db2.gz HJPFVYXCFAQJPE-HNNXBMFYSA-N 1 1 340.343 2.288 20 5 EEBDMO C[C@@H](NC(=O)NCCc1cccc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1 ZINC000272768726 269018425 /nfs/dbraw/zinc/01/84/25/269018425.db2.gz PTOALRWLVCZAIC-CYBMUJFWSA-N 1 1 332.404 2.087 20 5 EEBDMO COc1cc(N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000275600964 269129531 /nfs/dbraw/zinc/12/95/31/269129531.db2.gz SEFIOCNRBAARDE-NSHDSACASA-N 1 1 341.383 2.024 20 5 EEBDMO CO[C@]1(C)CCC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000280615941 269379615 /nfs/dbraw/zinc/37/96/15/269379615.db2.gz WGTFWHVXSXGYNS-GOSISDBHSA-N 1 1 347.415 2.375 20 5 EEBDMO O=C(NC1CC[NH+](CC2CC2)CC1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000194241188 274069469 /nfs/dbraw/zinc/06/94/69/274069469.db2.gz JOPPOQFTCWJZIG-UHFFFAOYSA-N 1 1 343.387 2.075 20 5 EEBDMO Cc1noc([C@H]2CCC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000269663624 274116774 /nfs/dbraw/zinc/11/67/74/274116774.db2.gz RJWDPTJZQCDEEA-DZGCQCFKSA-N 1 1 332.360 2.199 20 5 EEBDMO C[N@@H+]1CC=C(CNc2ncc(Br)cc2[N+](=O)[O-])CC1 ZINC000271793614 274153326 /nfs/dbraw/zinc/15/33/26/274153326.db2.gz JOLUKWBWWAKRIK-UHFFFAOYSA-N 1 1 327.182 2.426 20 5 EEBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)C(F)(F)c3ccc([N+](=O)[O-])cc3)[C@H]2C1 ZINC000272600411 274177100 /nfs/dbraw/zinc/17/71/00/274177100.db2.gz YLTXODAJMGBIEP-RISCZKNCSA-N 1 1 339.342 2.239 20 5 EEBDMO C[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)C1=CC[N@@H+](C)CC1 ZINC000272750024 274180722 /nfs/dbraw/zinc/18/07/22/274180722.db2.gz NJJQPFZTIMTLPG-CYBMUJFWSA-N 1 1 332.404 2.087 20 5 EEBDMO C[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000342419987 274213193 /nfs/dbraw/zinc/21/31/93/274213193.db2.gz RXWFQGLNMBOVGB-ZDUSSCGKSA-N 1 1 330.388 2.184 20 5 EEBDMO CC(=O)c1ccc(N2CC[N@@H+](CC(C)(C)O)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000275849233 274269202 /nfs/dbraw/zinc/26/92/02/274269202.db2.gz RHIADAUCHMXFRK-GFCCVEGCSA-N 1 1 335.404 2.079 20 5 EEBDMO CC(=O)c1ccc(N2CC[N@H+](CC(C)(C)O)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000275849233 274269206 /nfs/dbraw/zinc/26/92/06/274269206.db2.gz RHIADAUCHMXFRK-GFCCVEGCSA-N 1 1 335.404 2.079 20 5 EEBDMO 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YUJXBBPIHXRVQG-NEPJUHHUSA-N 1 1 332.404 2.334 20 5 EEBDMO C[C@@H]1[C@H](C)N(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000356914597 465624179 /nfs/dbraw/zinc/62/41/79/465624179.db2.gz YUJXBBPIHXRVQG-NEPJUHHUSA-N 1 1 332.404 2.334 20 5 EEBDMO Cc1sc(S(=O)(=O)N[C@@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000353098871 465635280 /nfs/dbraw/zinc/63/52/80/465635280.db2.gz SCYHWGPDSSAEAK-JTQLQIEISA-N 1 1 347.462 2.117 20 5 EEBDMO C[N@H+](CCOc1ccccc1[N+](=O)[O-])CC(=O)NCc1cccs1 ZINC000353153474 465677200 /nfs/dbraw/zinc/67/72/00/465677200.db2.gz YFVODHGBZJYLHH-UHFFFAOYSA-N 1 1 349.412 2.283 20 5 EEBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CC(=O)NCc1cccs1 ZINC000353153474 465677206 /nfs/dbraw/zinc/67/72/06/465677206.db2.gz YFVODHGBZJYLHH-UHFFFAOYSA-N 1 1 349.412 2.283 20 5 EEBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 ZINC000554859408 468446777 /nfs/dbraw/zinc/44/67/77/468446777.db2.gz KFOLWBPYAANUHT-QWHCGFSZSA-N 1 1 335.408 2.045 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000330598333 465723327 /nfs/dbraw/zinc/72/33/27/465723327.db2.gz SSSKGYUBDYRJMO-WDEREUQCSA-N 1 1 340.811 2.211 20 5 EEBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NCCCCn1cc[nH+]c1C ZINC000361112620 465771987 /nfs/dbraw/zinc/77/19/87/465771987.db2.gz VCRDUTPDWUTGMT-UHFFFAOYSA-N 1 1 331.376 2.352 20 5 EEBDMO C[C@@H]1C[C@H](NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000338053789 465783862 /nfs/dbraw/zinc/78/38/62/465783862.db2.gz XJEUHJSYNCRUQN-UKRRQHHQSA-N 1 1 334.420 2.261 20 5 EEBDMO Cn1cc([C@@H](O)C[C@@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])cn1 ZINC000371469010 465816043 /nfs/dbraw/zinc/81/60/43/465816043.db2.gz CLHBQNGLCBVCMW-RDJZCZTQSA-N 1 1 330.388 2.416 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C)C[C@H]1C(C)C ZINC000331006347 465895626 /nfs/dbraw/zinc/89/56/26/465895626.db2.gz ZKTLSVSZBCQHHP-INIZCTEOSA-N 1 1 334.420 2.114 20 5 EEBDMO C[C@@H]1C[C@@H](N[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000353523864 465952205 /nfs/dbraw/zinc/95/22/05/465952205.db2.gz CIDQFVBLCCZPNH-KMFMINBZSA-N 1 1 343.431 2.490 20 5 EEBDMO CCOc1cc(C[N@H+]2CCC[C@H](N3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000569256394 468465233 /nfs/dbraw/zinc/46/52/33/468465233.db2.gz NKDHIGJQDWLJFL-INIZCTEOSA-N 1 1 349.431 2.290 20 5 EEBDMO C[C@H](C(=O)N1CC[C@@]2(CC[N@@H+](C)C2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000346274175 466049323 /nfs/dbraw/zinc/04/93/23/466049323.db2.gz SBOPVTPHKSNZCG-YVEFUNNKSA-N 1 1 335.379 2.392 20 5 EEBDMO CCOc1cc(N2CC[C@H]([NH+]3CCOCC3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000357605234 466171885 /nfs/dbraw/zinc/17/18/85/466171885.db2.gz WDJVJCYPOOMEQO-HIFRSBDPSA-N 1 1 335.404 2.293 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1CO ZINC000361658305 466184411 /nfs/dbraw/zinc/18/44/11/466184411.db2.gz FKTQPQXOSPVKOX-IUODEOHRSA-N 1 1 330.388 2.056 20 5 EEBDMO C[C@H](O)C[C@H]1CCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000305236265 466389139 /nfs/dbraw/zinc/38/91/39/466389139.db2.gz XKZXTKOZDPQNPH-QWHCGFSZSA-N 1 1 349.387 2.128 20 5 EEBDMO C[C@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1CO ZINC000305465263 466410858 /nfs/dbraw/zinc/41/08/58/466410858.db2.gz WQWOHNNFXYOHIQ-SMDDNHRTSA-N 1 1 332.360 2.238 20 5 EEBDMO COc1c(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)cccc1[N+](=O)[O-] ZINC000332229943 466458342 /nfs/dbraw/zinc/45/83/42/466458342.db2.gz PSSYHEOBRIUVQJ-JSGCOSHPSA-N 1 1 333.388 2.160 20 5 EEBDMO C[C@H](C(=O)N1CC[C@@H]2CC[N@@H+](C)C[C@H]21)c1ccc([N+](=O)[O-])cc1F ZINC000332237519 466462461 /nfs/dbraw/zinc/46/24/61/466462461.db2.gz HKWRAPCIHHVSRG-MQIPJXDCSA-N 1 1 335.379 2.390 20 5 EEBDMO C[N@@H+](C[C@@H]1CCCC[C@@H]1O)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000305786445 466464385 /nfs/dbraw/zinc/46/43/85/466464385.db2.gz BCTLVVMEWNKJCU-JQFCIGGWSA-N 1 1 347.415 2.183 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000363938022 466661979 /nfs/dbraw/zinc/66/19/79/466661979.db2.gz NCHGCHPTDKWVNS-QWHCGFSZSA-N 1 1 348.359 2.168 20 5 EEBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000411965638 466950376 /nfs/dbraw/zinc/95/03/76/466950376.db2.gz KIVOHVLHZVCZMT-SFHVURJKSA-N 1 1 325.368 2.224 20 5 EEBDMO O=C1CCCCN1[C@H]1CCC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000370901149 467037740 /nfs/dbraw/zinc/03/77/40/467037740.db2.gz WAXKVIQNDXNNRM-HNNXBMFYSA-N 1 1 347.415 2.451 20 5 EEBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000378236329 467237503 /nfs/dbraw/zinc/23/75/03/467237503.db2.gz XLRLFUMDTGQTNY-AWEZNQCLSA-N 1 1 343.387 2.075 20 5 EEBDMO C[N@H+]1CCC[C@H](CCNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000413438765 467243125 /nfs/dbraw/zinc/24/31/25/467243125.db2.gz MHYSRWIXHNPYTK-GFCCVEGCSA-N 1 1 341.433 2.142 20 5 EEBDMO CC[N@H+]1CC[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000413460866 467247129 /nfs/dbraw/zinc/24/71/29/467247129.db2.gz TVPNIPPBUUKIJY-LLVKDONJSA-N 1 1 326.784 2.142 20 5 EEBDMO Cc1sc(S(=O)(=O)N(C)[C@H]2CC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000452106267 467324107 /nfs/dbraw/zinc/32/41/07/467324107.db2.gz PQJACBSQODXMLY-NSHDSACASA-N 1 1 347.462 2.068 20 5 EEBDMO Cc1sc(S(=O)(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000452106267 467324112 /nfs/dbraw/zinc/32/41/12/467324112.db2.gz PQJACBSQODXMLY-NSHDSACASA-N 1 1 347.462 2.068 20 5 EEBDMO COc1ccc(C[N@@H+](C)CCCNC(=O)C2CCC2)cc1[N+](=O)[O-] ZINC000429549899 467344671 /nfs/dbraw/zinc/34/46/71/467344671.db2.gz VRDNSKNRJNVFEJ-UHFFFAOYSA-N 1 1 335.404 2.342 20 5 EEBDMO CC(C)c1ccc(C(=O)NC[C@@H]2CCC[N@H+]2CCCO)cc1[N+](=O)[O-] ZINC000452368209 467360721 /nfs/dbraw/zinc/36/07/21/467360721.db2.gz QMGWYXZUNYZHKC-HNNXBMFYSA-N 1 1 349.431 2.295 20 5 EEBDMO O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000434444573 467398650 /nfs/dbraw/zinc/39/86/50/467398650.db2.gz DHGLXQPBLOHRCN-OAHLLOKOSA-N 1 1 335.379 2.410 20 5 EEBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000448980856 467610168 /nfs/dbraw/zinc/61/01/68/467610168.db2.gz QUNYNCIQZNTPGG-GFCCVEGCSA-N 1 1 343.387 2.151 20 5 EEBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@@H](SC)C2)cc1[N+](=O)[O-] ZINC000449446347 467646995 /nfs/dbraw/zinc/64/69/95/467646995.db2.gz PMHPDAJEDCIPPS-GFCCVEGCSA-N 1 1 340.401 2.084 20 5 EEBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c2c(c1)COCO2 ZINC000449558508 467661809 /nfs/dbraw/zinc/66/18/09/467661809.db2.gz WLLPUTFPXJUNIT-IIYDPXPESA-N 1 1 348.399 2.444 20 5 EEBDMO Cc1cc(OCC(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000457095191 467751601 /nfs/dbraw/zinc/75/16/01/467751601.db2.gz PWQXVGPPDOFVKI-AWEZNQCLSA-N 1 1 335.404 2.223 20 5 EEBDMO C[C@H]1CC[N@@H+](CCNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000550618725 468220140 /nfs/dbraw/zinc/22/01/40/468220140.db2.gz GDQRXQHCGKAJMM-LBPRGKRZSA-N 1 1 330.388 2.077 20 5 EEBDMO O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594420427 468579176 /nfs/dbraw/zinc/57/91/76/468579176.db2.gz TUYFNDSAPFPLDG-HUUCEWRRSA-N 1 1 332.404 2.140 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(c3cc4nc[nH]c(=O)c4cc3[N+](=O)[O-])C2)C1 ZINC000582917998 468617207 /nfs/dbraw/zinc/61/72/07/468617207.db2.gz UXLHMOKTBYBRNT-KRWDZBQOSA-N 1 1 343.387 2.166 20 5 EEBDMO Cc1[nH]nc(C(=O)N2CCC3(CCC([NH+](C)C)CC3)CC2)c1[N+](=O)[O-] ZINC000597704261 468644756 /nfs/dbraw/zinc/64/47/56/468644756.db2.gz QKDFTNMMOOAPNC-UHFFFAOYSA-N 1 1 349.435 2.353 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2cc(-c3nc([C@H]4CCC[NH2+]4)no3)[nH]n2)cc1 ZINC000592356357 468682696 /nfs/dbraw/zinc/68/26/96/468682696.db2.gz OGGXMHLBASIWBT-LLVKDONJSA-N 1 1 326.316 2.459 20 5 EEBDMO Cc1ccc(C[N@@H+]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])cn3C)C2)cc1 ZINC000601246404 468796472 /nfs/dbraw/zinc/79/64/72/468796472.db2.gz SGPMFIRVTYYGTA-HNNXBMFYSA-N 1 1 342.399 2.246 20 5 EEBDMO CC(C)(C(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1)n1cc([N+](=O)[O-])cn1 ZINC000598220438 468796974 /nfs/dbraw/zinc/79/69/74/468796974.db2.gz PDRPLABTFDOQBO-CYBMUJFWSA-N 1 1 349.435 2.050 20 5 EEBDMO O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000598221921 468798133 /nfs/dbraw/zinc/79/81/33/468798133.db2.gz YOFIWVQHPMXSGD-CQSZACIVSA-N 1 1 347.415 2.497 20 5 EEBDMO CC[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](CC)CO1 ZINC000593058798 468855610 /nfs/dbraw/zinc/85/56/10/468855610.db2.gz OTYUGGPJHRUSHZ-FVQBIDKESA-N 1 1 338.404 2.224 20 5 EEBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H](N3CCOCC3)CC2)cc1 ZINC000595470855 468866323 /nfs/dbraw/zinc/86/63/23/468866323.db2.gz UAOSNNRQTLARAC-INIZCTEOSA-N 1 1 349.431 2.160 20 5 EEBDMO CN(C(=O)C[N@H+]1CCC[C@H]1[C@H]1CCCOC1)c1ccc([N+](=O)[O-])cc1 ZINC000571996869 468869434 /nfs/dbraw/zinc/86/94/34/468869434.db2.gz IXBBCDAEZQKYHP-YOEHRIQHSA-N 1 1 347.415 2.449 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000593187831 468898796 /nfs/dbraw/zinc/89/87/96/468898796.db2.gz 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RESVWJRFJOSRRQ-DZGCQCFKSA-N 1 1 335.379 2.362 20 5 EEBDMO C[C@@H](NC(=O)NC[C@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000080008276 463271652 /nfs/dbraw/zinc/27/16/52/463271652.db2.gz LXIWAFDXHRIPGA-CHWSQXEVSA-N 1 1 332.404 2.439 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1N1CCC[N@@H+](CC(=O)N2CCCC2)CC1 ZINC000080552280 463331143 /nfs/dbraw/zinc/33/11/43/463331143.db2.gz UMMWRFDEOJNLBM-UHFFFAOYSA-N 1 1 346.431 2.038 20 5 EEBDMO C[N@@H+]1CCC[C@H]2CN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000139826105 463333532 /nfs/dbraw/zinc/33/35/32/463333532.db2.gz QAITVPCUPNIGJA-YOEHRIQHSA-N 1 1 346.431 2.340 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000139826105 463333534 /nfs/dbraw/zinc/33/35/34/463333534.db2.gz QAITVPCUPNIGJA-YOEHRIQHSA-N 1 1 346.431 2.340 20 5 EEBDMO COCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000144585425 463376572 /nfs/dbraw/zinc/37/65/72/463376572.db2.gz ASHMTOFZPSHGCV-BBRMVZONSA-N 1 1 349.431 2.266 20 5 EEBDMO 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2.021 20 5 EEBDMO O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1n[nH]cc1[N+](=O)[O-] ZINC000126828203 463665379 /nfs/dbraw/zinc/66/53/79/463665379.db2.gz QYPAEBUDNKRTJH-LLVKDONJSA-N 1 1 349.416 2.021 20 5 EEBDMO CCOC(=O)c1cc(NCCC[N@@H+](C)CCOC)ccc1[N+](=O)[O-] ZINC000277170514 463896901 /nfs/dbraw/zinc/89/69/01/463896901.db2.gz ULUONANEGIRLFY-UHFFFAOYSA-N 1 1 339.392 2.152 20 5 EEBDMO O=C([C@H]1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1)N1CCCC1 ZINC000287508312 463909459 /nfs/dbraw/zinc/90/94/59/463909459.db2.gz UJDMQHVDCCHSKI-HNNXBMFYSA-N 1 1 347.415 2.308 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000287565579 463929422 /nfs/dbraw/zinc/92/94/22/463929422.db2.gz QJNJJVNGMBWIAO-GXTWGEPZSA-N 1 1 343.387 2.101 20 5 EEBDMO Cc1ccc(CN(CC[NH+](C)C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)o1 ZINC000269295263 463944385 /nfs/dbraw/zinc/94/43/85/463944385.db2.gz RHERVBHNWCWBBP-UHFFFAOYSA-N 1 1 347.371 2.406 20 5 EEBDMO COc1cc(C(=O)NC[C@@H](C)Cn2cc[nH+]c2C)ccc1[N+](=O)[O-] ZINC000195490463 464059123 /nfs/dbraw/zinc/05/91/23/464059123.db2.gz HXFJFKWULSCWEX-LLVKDONJSA-N 1 1 332.360 2.174 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H]1C[C@H](C)O ZINC000269783483 464092806 /nfs/dbraw/zinc/09/28/06/464092806.db2.gz HDAQIDQQBYGMTD-KBPBESRZSA-N 1 1 335.404 2.467 20 5 EEBDMO CC(C)(C)[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1 ZINC000279740402 464138670 /nfs/dbraw/zinc/13/86/70/464138670.db2.gz KLDNQCQJSORNMF-BBRMVZONSA-N 1 1 338.404 2.081 20 5 EEBDMO CC(C)(C)[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1 ZINC000279740402 464138676 /nfs/dbraw/zinc/13/86/76/464138676.db2.gz KLDNQCQJSORNMF-BBRMVZONSA-N 1 1 338.404 2.081 20 5 EEBDMO CCCc1n[nH]c(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000172839718 464152009 /nfs/dbraw/zinc/15/20/09/464152009.db2.gz BLDYXTMOSILGFE-LBPRGKRZSA-N 1 1 337.424 2.217 20 5 EEBDMO CCCc1[nH]nc(C(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)c1[N+](=O)[O-] ZINC000172839718 464152014 /nfs/dbraw/zinc/15/20/14/464152014.db2.gz BLDYXTMOSILGFE-LBPRGKRZSA-N 1 1 337.424 2.217 20 5 EEBDMO CCCc1[nH]nc(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000172839718 464152018 /nfs/dbraw/zinc/15/20/18/464152018.db2.gz BLDYXTMOSILGFE-LBPRGKRZSA-N 1 1 337.424 2.217 20 5 EEBDMO Cn1cc(CNC2CC[NH+](C)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237167725 464276761 /nfs/dbraw/zinc/27/67/61/464276761.db2.gz AYVVZQQLGPZLNC-UHFFFAOYSA-N 1 1 329.404 2.179 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1S(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000281096271 464330224 /nfs/dbraw/zinc/33/02/24/464330224.db2.gz DUBUPMJJWRQWCQ-CYBMUJFWSA-N 1 1 341.433 2.008 20 5 EEBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1 ZINC000180563749 464337252 /nfs/dbraw/zinc/33/72/52/464337252.db2.gz OCGNSVMPPDDPQD-LBPRGKRZSA-N 1 1 349.435 2.202 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)CCN1CC[NH+](C)CC1 ZINC000188855959 464384075 /nfs/dbraw/zinc/38/40/75/464384075.db2.gz LMQXMHAWHLEFGP-AWEZNQCLSA-N 1 1 349.435 2.051 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](CO)CC1 ZINC000293346754 464401851 /nfs/dbraw/zinc/40/18/51/464401851.db2.gz ZBIXSLQTNXDIHD-AWEZNQCLSA-N 1 1 335.404 2.326 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)C2)C1 ZINC000294310856 464462478 /nfs/dbraw/zinc/46/24/78/464462478.db2.gz WKKWJDFJTDYHAY-INIZCTEOSA-N 1 1 348.359 2.061 20 5 EEBDMO C[C@@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)[NH+]1CCN(C)CC1 ZINC000264798753 464470086 /nfs/dbraw/zinc/47/00/86/464470086.db2.gz CAFAVRBBAXSHQY-ZDUSSCGKSA-N 1 1 329.404 2.191 20 5 EEBDMO COC(=O)c1cnc(N(C)CC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC000189326813 464477196 /nfs/dbraw/zinc/47/71/96/464477196.db2.gz SWVDHYZVXLPXOT-ZDUSSCGKSA-N 1 1 336.392 2.087 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000175396419 464540793 /nfs/dbraw/zinc/54/07/93/464540793.db2.gz HLHHFCQIRFWVJC-AWEZNQCLSA-N 1 1 341.433 2.008 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000182136857 464579984 /nfs/dbraw/zinc/57/99/84/464579984.db2.gz ULEGJTPTJAQKFO-VXGBXAGGSA-N 1 1 327.812 2.135 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+](CCCO)C2)c2ccncc21 ZINC000294926648 464650563 /nfs/dbraw/zinc/65/05/63/464650563.db2.gz JRIOUOFBUHFJQG-ZDUSSCGKSA-N 1 1 330.388 2.402 20 5 EEBDMO COC(=O)[C@H](C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCC1 ZINC000282229277 464745013 /nfs/dbraw/zinc/74/50/13/464745013.db2.gz ZFJMYGGIXZROKX-LBPRGKRZSA-N 1 1 349.387 2.339 20 5 EEBDMO C[C@@H]1CN(c2ccccc2F)CC[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000191633119 464823922 /nfs/dbraw/zinc/82/39/22/464823922.db2.gz XOTVOMPIYAWNTF-CYBMUJFWSA-N 1 1 333.367 2.141 20 5 EEBDMO C[C@@H]1CN(c2ccccc2F)CC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000191633119 464823928 /nfs/dbraw/zinc/82/39/28/464823928.db2.gz XOTVOMPIYAWNTF-CYBMUJFWSA-N 1 1 333.367 2.141 20 5 EEBDMO COCCOCCOCC[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000276158340 464828937 /nfs/dbraw/zinc/82/89/37/464828937.db2.gz HIRNOJCUEKLXKD-AWEZNQCLSA-N 1 1 326.393 2.267 20 5 EEBDMO C[C@H]1C[C@@H](N2CCOCC2)C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000286231444 464847866 /nfs/dbraw/zinc/84/78/66/464847866.db2.gz ZDXACXXNTJRQRL-GXTWGEPZSA-N 1 1 346.387 2.031 20 5 EEBDMO C[C@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000286231444 464847869 /nfs/dbraw/zinc/84/78/69/464847869.db2.gz ZDXACXXNTJRQRL-GXTWGEPZSA-N 1 1 346.387 2.031 20 5 EEBDMO CCC[C@H](O)C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000295753360 464953222 /nfs/dbraw/zinc/95/32/22/464953222.db2.gz OALLMJNRAWJVRI-AWEZNQCLSA-N 1 1 347.419 2.144 20 5 EEBDMO CC[C@@H](C)[N@@H+](CCO)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000286730774 465016940 /nfs/dbraw/zinc/01/69/40/465016940.db2.gz BORHHSUILNZFDR-LLVKDONJSA-N 1 1 327.356 2.155 20 5 EEBDMO CS(=O)(=O)c1ccc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000298720432 465482845 /nfs/dbraw/zinc/48/28/45/465482845.db2.gz NVPDYMRRQOYHOS-KGLIPLIRSA-N 1 1 339.417 2.037 20 5 EEBDMO C[C@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC000359816070 465492430 /nfs/dbraw/zinc/49/24/30/465492430.db2.gz VWFBFEGHGKKTPX-ZFWWWQNUSA-N 1 1 342.399 2.326 20 5 EEBDMO O=C(NCCC[N@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])[nH]1 ZINC000298863701 465527858 /nfs/dbraw/zinc/52/78/58/465527858.db2.gz DNIYWQOCNDCGBG-UHFFFAOYSA-N 1 1 328.372 2.101 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000298944950 465547066 /nfs/dbraw/zinc/54/70/66/465547066.db2.gz RBCFMMSLXCHCPN-GJZGRUSLSA-N 1 1 348.403 2.029 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000330615628 465732492 /nfs/dbraw/zinc/73/24/92/465732492.db2.gz UUBMJSKVTYDZCC-GHMZBOCLSA-N 1 1 325.796 2.342 20 5 EEBDMO CC[C@H]1C[C@H](C)C[N@@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000330843277 465827123 /nfs/dbraw/zinc/82/71/23/465827123.db2.gz MVTYEOMWCHXXKY-STQMWFEESA-N 1 1 326.418 2.489 20 5 EEBDMO CC[C@H]1C[C@H](C)C[N@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000330843277 465827128 /nfs/dbraw/zinc/82/71/28/465827128.db2.gz MVTYEOMWCHXXKY-STQMWFEESA-N 1 1 326.418 2.489 20 5 EEBDMO O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc([N+](=O)[O-])c[nH]1 ZINC000340252072 465922583 /nfs/dbraw/zinc/92/25/83/465922583.db2.gz RZQFPAUSQAAOCJ-OAHLLOKOSA-N 1 1 342.399 2.217 20 5 EEBDMO Cn1ccnc1[C@@H](N[C@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000353498360 465932795 /nfs/dbraw/zinc/93/27/95/465932795.db2.gz RDIBCNSIHPHDEO-YOEHRIQHSA-N 1 1 341.415 2.244 20 5 EEBDMO C[C@@H]1C[C@H](N[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000353535673 465959584 /nfs/dbraw/zinc/95/95/84/465959584.db2.gz WNYRHXPRZMYKOS-FRFSOERESA-N 1 1 343.431 2.490 20 5 EEBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 ZINC000301688000 466010083 /nfs/dbraw/zinc/01/00/83/466010083.db2.gz WINUFXHWOLBAAT-CYBMUJFWSA-N 1 1 348.451 2.448 20 5 EEBDMO C[C@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccncc1F ZINC000338338774 466040949 /nfs/dbraw/zinc/04/09/49/466040949.db2.gz AITCDNTUCXEUOC-NSHDSACASA-N 1 1 344.346 2.369 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](CC1CCC1)[C@H](C)CO ZINC000361497719 466047837 /nfs/dbraw/zinc/04/78/37/466047837.db2.gz QGNZDQDZBANZRE-CYBMUJFWSA-N 1 1 335.404 2.325 20 5 EEBDMO C[C@@H]1C[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[N@@H+]1C1CC1 ZINC000357533099 466107619 /nfs/dbraw/zinc/10/76/19/466107619.db2.gz PMEMAVUWVVSGKJ-PWSUYJOCSA-N 1 1 329.360 2.682 20 5 EEBDMO C[C@@H]1C[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[N@H+]1C1CC1 ZINC000357533099 466107626 /nfs/dbraw/zinc/10/76/26/466107626.db2.gz PMEMAVUWVVSGKJ-PWSUYJOCSA-N 1 1 329.360 2.682 20 5 EEBDMO COC(=O)c1cnc(NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000302660406 466163077 /nfs/dbraw/zinc/16/30/77/466163077.db2.gz AVYFQNQEYVMYDK-VXGBXAGGSA-N 1 1 336.392 2.309 20 5 EEBDMO O=C1CCCN1C[C@@H]1CCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000362998094 466168036 /nfs/dbraw/zinc/16/80/36/466168036.db2.gz QWCSQJDMNBFKOS-HNNXBMFYSA-N 1 1 347.415 2.451 20 5 EEBDMO CCC[C@]1(CO)CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000367362435 466289389 /nfs/dbraw/zinc/28/93/89/466289389.db2.gz XLMWPMPTXAYIAI-KRWDZBQOSA-N 1 1 335.404 2.042 20 5 EEBDMO CCC[C@]1(CO)CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000367362435 466289394 /nfs/dbraw/zinc/28/93/94/466289394.db2.gz XLMWPMPTXAYIAI-KRWDZBQOSA-N 1 1 335.404 2.042 20 5 EEBDMO CCn1c(C)nc([N+](=O)[O-])c1NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000340900947 466419597 /nfs/dbraw/zinc/41/95/97/466419597.db2.gz JGEDEYXJYNUBJU-GFCCVEGCSA-N 1 1 325.413 2.032 20 5 EEBDMO C[N@H+]1CC[C@@](O)(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000358144918 466493468 /nfs/dbraw/zinc/49/34/68/466493468.db2.gz VCRWNEBCECUXNT-QGZVFWFLSA-N 1 1 331.372 2.011 20 5 EEBDMO CN1CC[C@@](O)(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000358144918 466493476 /nfs/dbraw/zinc/49/34/76/466493476.db2.gz VCRWNEBCECUXNT-QGZVFWFLSA-N 1 1 331.372 2.011 20 5 EEBDMO COC(=O)c1cnc(NC[C@@H](C)[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000358150400 466496829 /nfs/dbraw/zinc/49/68/29/466496829.db2.gz MZYWVOXEIJOWDJ-VXGBXAGGSA-N 1 1 336.392 2.451 20 5 EEBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@](O)(C(F)(F)F)C2)c1 ZINC000354380765 466520963 /nfs/dbraw/zinc/52/09/63/466520963.db2.gz CWMSBTUPXRMMOC-ZDUSSCGKSA-N 1 1 334.294 2.363 20 5 EEBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@@](O)(C(F)(F)F)C2)c1 ZINC000354380765 466520965 /nfs/dbraw/zinc/52/09/65/466520965.db2.gz CWMSBTUPXRMMOC-ZDUSSCGKSA-N 1 1 334.294 2.363 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(F)c([N+](=O)[O-])cc1F ZINC000322295097 466630922 /nfs/dbraw/zinc/63/09/22/466630922.db2.gz TWIMDMKYPLIWKF-NXEZZACHSA-N 1 1 325.315 2.230 20 5 EEBDMO CN(C(=O)C[NH+]1CCC([C@@H]2CCOC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000374612541 466692226 /nfs/dbraw/zinc/69/22/26/466692226.db2.gz MHXPSBQFHMJAQU-OAHLLOKOSA-N 1 1 347.415 2.306 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCn1cc([N+](=O)[O-])cn1 ZINC000373140246 466705321 /nfs/dbraw/zinc/70/53/21/466705321.db2.gz MNUBPXHNQPEPED-QAPCUYQASA-N 1 1 343.431 2.292 20 5 EEBDMO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCn1cc([N+](=O)[O-])cn1 ZINC000373140246 466705324 /nfs/dbraw/zinc/70/53/24/466705324.db2.gz MNUBPXHNQPEPED-QAPCUYQASA-N 1 1 343.431 2.292 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000373583101 466854898 /nfs/dbraw/zinc/85/48/98/466854898.db2.gz PGBRRGQHMQKRNG-QGZVFWFLSA-N 1 1 328.372 2.350 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000373583101 466854902 /nfs/dbraw/zinc/85/49/02/466854902.db2.gz PGBRRGQHMQKRNG-QGZVFWFLSA-N 1 1 328.372 2.350 20 5 EEBDMO C[C@@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@]2(CCCOC2)O1 ZINC000373809803 466927109 /nfs/dbraw/zinc/92/71/09/466927109.db2.gz KFWNZFMELOVHLR-PBHICJAKSA-N 1 1 336.388 2.244 20 5 EEBDMO C[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@]2(CCCOC2)O1 ZINC000373809803 466927112 /nfs/dbraw/zinc/92/71/12/466927112.db2.gz KFWNZFMELOVHLR-PBHICJAKSA-N 1 1 336.388 2.244 20 5 EEBDMO C[C@@H]1[C@@H](CO)CCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000412088490 467002293 /nfs/dbraw/zinc/00/22/93/467002293.db2.gz PMKHKXAAWSEBSU-DGCLKSJQSA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@@H]1[C@@H](CO)CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000412088490 467002299 /nfs/dbraw/zinc/00/22/99/467002299.db2.gz PMKHKXAAWSEBSU-DGCLKSJQSA-N 1 1 332.360 2.238 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000427919512 467186145 /nfs/dbraw/zinc/18/61/45/467186145.db2.gz XYCPLLONVOXPPJ-INIZCTEOSA-N 1 1 347.346 2.472 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(NC[C@@H]3CCCC[N@H+]3C3CC3)n2)cc1 ZINC000433810539 467355029 /nfs/dbraw/zinc/35/50/29/467355029.db2.gz KTZHBTSVDGAHJF-HNNXBMFYSA-N 1 1 343.387 3.074 20 5 EEBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](n2cc(C[NH3+])nn2)C1 ZINC000420376150 467384605 /nfs/dbraw/zinc/38/46/05/467384605.db2.gz JQGKKHTWIRWRKD-GXTWGEPZSA-N 1 1 330.392 2.043 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](CCC(N)=O)Cc1ccccc1 ZINC000430219993 467408591 /nfs/dbraw/zinc/40/85/91/467408591.db2.gz AWVXSTGUKGJQLZ-UHFFFAOYSA-N 1 1 343.383 2.481 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCC(N)=O)Cc1ccccc1 ZINC000430219993 467408595 /nfs/dbraw/zinc/40/85/95/467408595.db2.gz AWVXSTGUKGJQLZ-UHFFFAOYSA-N 1 1 343.383 2.481 20 5 EEBDMO CC[NH2+]CC1CCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000430592231 467447923 /nfs/dbraw/zinc/44/79/23/467447923.db2.gz PUBJQIFJUJNTDI-KRWDZBQOSA-N 1 1 346.431 2.022 20 5 EEBDMO C[C@@H]1CN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](C)C[N@H+]1C ZINC000408074932 467504931 /nfs/dbraw/zinc/50/49/31/467504931.db2.gz XXGOAXYLXQOAQJ-MNOVXSKESA-N 1 1 344.371 2.013 20 5 EEBDMO CCN1CCN([C@@H](C)C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449080237 467617084 /nfs/dbraw/zinc/61/70/84/467617084.db2.gz UNEFGRRWUMAOOM-CVEARBPZSA-N 1 1 334.464 2.141 20 5 EEBDMO CCC1(C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)COC1 ZINC000449602883 467668800 /nfs/dbraw/zinc/66/88/00/467668800.db2.gz UWHWOKDSFSSJKH-HNNXBMFYSA-N 1 1 330.388 2.434 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)/C=C\c3ccc(F)cc3[N+](=O)[O-])C2)C1 ZINC000492921880 467795477 /nfs/dbraw/zinc/79/54/77/467795477.db2.gz MFLSJWSUFRXHOL-MAVJXHJTSA-N 1 1 333.363 2.301 20 5 EEBDMO COc1ccc(C[N@H+]2CC[C@H](Cc3cnn(C)c3)C2)cc1[N+](=O)[O-] ZINC000530866805 468013617 /nfs/dbraw/zinc/01/36/17/468013617.db2.gz FWRRXFCFKNWTFW-CQSZACIVSA-N 1 1 330.388 2.402 20 5 EEBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000531540378 468058783 /nfs/dbraw/zinc/05/87/83/468058783.db2.gz FSFGFZPKCNECTB-GFCCVEGCSA-N 1 1 349.387 2.031 20 5 EEBDMO COCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCO[C@H]1C ZINC000489429479 468135540 /nfs/dbraw/zinc/13/55/40/468135540.db2.gz NXIKZRTUINQHBC-NHYWBVRUSA-N 1 1 334.376 2.097 20 5 EEBDMO COCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCO[C@H]1C ZINC000489429479 468135542 /nfs/dbraw/zinc/13/55/42/468135542.db2.gz NXIKZRTUINQHBC-NHYWBVRUSA-N 1 1 334.376 2.097 20 5 EEBDMO C[C@H](C(=O)NCCCC[N@H+]1CCC[C@H]1CO)c1cccc([N+](=O)[O-])c1 ZINC000519517414 468164423 /nfs/dbraw/zinc/16/44/23/468164423.db2.gz DFIFTXXKEQEMPY-YOEHRIQHSA-N 1 1 349.431 2.051 20 5 EEBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594195151 468507294 /nfs/dbraw/zinc/50/72/94/468507294.db2.gz CMDRULAZNYWQNF-CABCVRRESA-N 1 1 335.379 2.410 20 5 EEBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCCC[N@@H+](C)C1 ZINC000600313034 468530055 /nfs/dbraw/zinc/53/00/55/468530055.db2.gz HEFNKWRLRLKTEA-CYBMUJFWSA-N 1 1 335.404 2.455 20 5 EEBDMO CNc1c(C(=O)N2CCC[C@@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000597710848 468647385 /nfs/dbraw/zinc/64/73/85/468647385.db2.gz PGSUBJBUMZJTMJ-KRWDZBQOSA-N 1 1 332.404 2.194 20 5 EEBDMO Cc1cc(S(=O)(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000594800009 468690720 /nfs/dbraw/zinc/69/07/20/468690720.db2.gz AKFKVWMSXFYNQX-LBPRGKRZSA-N 1 1 341.433 2.054 20 5 EEBDMO Cc1ccc(S(=O)(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000594801464 468691582 /nfs/dbraw/zinc/69/15/82/468691582.db2.gz OXQCEISWPIJQOZ-GFCCVEGCSA-N 1 1 341.433 2.054 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000597856092 468694112 /nfs/dbraw/zinc/69/41/12/468694112.db2.gz XBUZFGHSDDCPTE-CYBMUJFWSA-N 1 1 335.404 2.210 20 5 EEBDMO COc1cc(C(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000597921950 468711323 /nfs/dbraw/zinc/71/13/23/468711323.db2.gz IGCUPGMLFLOXLT-SNVBAGLBSA-N 1 1 339.367 2.345 20 5 EEBDMO CC(C)Cn1nccc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000592513965 468717787 /nfs/dbraw/zinc/71/77/87/468717787.db2.gz LOVKEHORXCWELY-UHFFFAOYSA-N 1 1 332.408 2.481 20 5 EEBDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000595294011 468802628 /nfs/dbraw/zinc/80/26/28/468802628.db2.gz HQFMDHBRHGMJPC-YPMHNXCESA-N 1 1 338.408 2.408 20 5 EEBDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000595294011 468802634 /nfs/dbraw/zinc/80/26/34/468802634.db2.gz HQFMDHBRHGMJPC-YPMHNXCESA-N 1 1 338.408 2.408 20 5 EEBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000584386470 468858390 /nfs/dbraw/zinc/85/83/90/468858390.db2.gz GSVOFAXTNNKLKN-JJRVBVJISA-N 1 1 346.431 2.467 20 5 EEBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000593101228 468871491 /nfs/dbraw/zinc/87/14/91/468871491.db2.gz NSVKHWUWWUFLIS-HIFRSBDPSA-N 1 1 335.379 2.219 20 5 EEBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000593101229 468871852 /nfs/dbraw/zinc/87/18/52/468871852.db2.gz NSVKHWUWWUFLIS-UKRRQHHQSA-N 1 1 335.379 2.219 20 5 EEBDMO COC(=O)c1ccnc(N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000598587834 468924145 /nfs/dbraw/zinc/92/41/45/468924145.db2.gz DPBPQYXFSCKKLQ-NEPJUHHUSA-N 1 1 336.392 2.309 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3C[C@@H]4C[C@H](O)CC[C@@H]4C3)n2)c1 ZINC000595633059 468931849 /nfs/dbraw/zinc/93/18/49/468931849.db2.gz KFZNBJBNYNLEAF-VNHYZAJKSA-N 1 1 344.371 2.238 20 5 EEBDMO C[C@H](C(=O)N1CC[N@@H+](CC(C)(C)O)C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000562301309 468933552 /nfs/dbraw/zinc/93/35/52/468933552.db2.gz LINDRQLKJLIFEK-KGLIPLIRSA-N 1 1 349.431 2.002 20 5 EEBDMO COc1ccc(OCC[N@H+]2CC(C)(C)CC[C@@H]2CO)c([N+](=O)[O-])c1 ZINC000598646604 468943527 /nfs/dbraw/zinc/94/35/27/468943527.db2.gz HXRHWGRZRMZCND-CYBMUJFWSA-N 1 1 338.404 2.465 20 5 EEBDMO C[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1CO ZINC000598646785 468944241 /nfs/dbraw/zinc/94/42/41/468944241.db2.gz ZHMNYNCPPVUZMN-WCQYABFASA-N 1 1 332.360 2.095 20 5 EEBDMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1CO ZINC000598646785 468944245 /nfs/dbraw/zinc/94/42/45/468944245.db2.gz ZHMNYNCPPVUZMN-WCQYABFASA-N 1 1 332.360 2.095 20 5 EEBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593413844 468967492 /nfs/dbraw/zinc/96/74/92/468967492.db2.gz DWPPKKLSHLVPOH-NSHDSACASA-N 1 1 334.351 2.234 20 5 EEBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2NC(=O)CC[C@H]2C1 ZINC000595743894 468983533 /nfs/dbraw/zinc/98/35/33/468983533.db2.gz SCOIFVIJFOSYAT-XJKSGUPXSA-N 1 1 347.415 2.483 20 5 EEBDMO CCN1C[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1=O ZINC000602683510 469009948 /nfs/dbraw/zinc/00/99/48/469009948.db2.gz CGEGOTKUEXVICS-NSHDSACASA-N 1 1 331.294 2.324 20 5 EEBDMO O=[N+]([O-])c1cnn(CC[NH+]2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c1 ZINC000610604939 469015725 /nfs/dbraw/zinc/01/57/25/469015725.db2.gz RGMIJSDCTMTFSK-IUCAKERBSA-N 1 1 346.231 2.464 20 5 EEBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@H](N2CCOCC2)CC1 ZINC000585718767 469021027 /nfs/dbraw/zinc/02/10/27/469021027.db2.gz XFMLMGPEOPNKFP-AWEZNQCLSA-N 1 1 337.395 2.421 20 5 EEBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H](N2CCOCC2)CC1 ZINC000585718767 469021032 /nfs/dbraw/zinc/02/10/32/469021032.db2.gz XFMLMGPEOPNKFP-AWEZNQCLSA-N 1 1 337.395 2.421 20 5 EEBDMO C[C@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@]1(C)CO ZINC000595874524 469057280 /nfs/dbraw/zinc/05/72/80/469057280.db2.gz PGKGRMAXRVOLIH-ZBEGNZNMSA-N 1 1 332.360 2.095 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@]1(C)CO ZINC000595874524 469057287 /nfs/dbraw/zinc/05/72/87/469057287.db2.gz PGKGRMAXRVOLIH-ZBEGNZNMSA-N 1 1 332.360 2.095 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000610921328 469112194 /nfs/dbraw/zinc/11/21/94/469112194.db2.gz RNDWITCOJOBROO-UHFFFAOYSA-N 1 1 337.424 2.388 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CCC[N@@H+](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000610921328 469112198 /nfs/dbraw/zinc/11/21/98/469112198.db2.gz RNDWITCOJOBROO-UHFFFAOYSA-N 1 1 337.424 2.388 20 5 EEBDMO CC(C)c1[nH]nc(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000610921328 469112202 /nfs/dbraw/zinc/11/22/02/469112202.db2.gz RNDWITCOJOBROO-UHFFFAOYSA-N 1 1 337.424 2.388 20 5 EEBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2N[C@@H]1CC[N@H+](C2CC2)C1 ZINC000596091927 469151935 /nfs/dbraw/zinc/15/19/35/469151935.db2.gz PUUIMQWFRGGFCJ-LLVKDONJSA-N 1 1 328.372 2.222 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCOC2)c([N+](=O)[O-])c1 ZINC000563066367 469158172 /nfs/dbraw/zinc/15/81/72/469158172.db2.gz NJCPSYXAKNAEMN-LSDHHAIUSA-N 1 1 333.388 2.085 20 5 EEBDMO NC(=O)c1cc(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000596169052 469184279 /nfs/dbraw/zinc/18/42/79/469184279.db2.gz DHYQJKQAVKDWTN-WBMJQRKESA-N 1 1 344.415 2.147 20 5 EEBDMO C[N@@H+]1C[C@H]2CN(c3c(Br)cccc3[N+](=O)[O-])C[C@H]2C1 ZINC000596213741 469206465 /nfs/dbraw/zinc/20/64/65/469206465.db2.gz DXZYUDLJMOHHMA-AOOOYVTPSA-N 1 1 326.194 2.355 20 5 EEBDMO C[C@@H](C(=O)N(C)CC[N@@H+]1CCOC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000573859520 469220114 /nfs/dbraw/zinc/22/01/14/469220114.db2.gz MGNIPXBQCMMAEU-CQSZACIVSA-N 1 1 349.431 2.268 20 5 EEBDMO C[C@@H](C(=O)N(C)CC[N@H+]1CCOC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000573859520 469220118 /nfs/dbraw/zinc/22/01/18/469220118.db2.gz MGNIPXBQCMMAEU-CQSZACIVSA-N 1 1 349.431 2.268 20 5 EEBDMO Nc1ccc(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)nc1[N+](=O)[O-] ZINC000596280575 469231114 /nfs/dbraw/zinc/23/11/14/469231114.db2.gz HWWXEBZEHPSYFP-GOEBONIOSA-N 1 1 339.399 2.283 20 5 EEBDMO CCOC(=O)c1ccnc(N[C@@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000596336704 469246512 /nfs/dbraw/zinc/24/65/12/469246512.db2.gz RSONGVLDBOZOJG-LLVKDONJSA-N 1 1 336.392 2.451 20 5 EEBDMO C[N@H+]1CCCC[C@@H]1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000611505730 469266052 /nfs/dbraw/zinc/26/60/52/469266052.db2.gz POHLNXLNPGAXMI-CYBMUJFWSA-N 1 1 325.796 2.391 20 5 EEBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(c2ccc(N)c([N+](=O)[O-])n2)C1 ZINC000596463453 469275515 /nfs/dbraw/zinc/27/55/15/469275515.db2.gz ZYYUFVHCTORQRS-HNNXBMFYSA-N 1 1 341.415 2.325 20 5 EEBDMO CCOc1cc(C[N@@H+]2CCCC[C@@H]2CNC(C)=O)ccc1[N+](=O)[O-] ZINC000599688936 469339647 /nfs/dbraw/zinc/33/96/47/469339647.db2.gz GRFDMEILOIGOFP-OAHLLOKOSA-N 1 1 335.404 2.484 20 5 EEBDMO CCOc1cc(C[N@H+]2CCCC[C@@H]2CNC(C)=O)ccc1[N+](=O)[O-] ZINC000599688936 469339650 /nfs/dbraw/zinc/33/96/50/469339650.db2.gz GRFDMEILOIGOFP-OAHLLOKOSA-N 1 1 335.404 2.484 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000604532707 469487752 /nfs/dbraw/zinc/48/77/52/469487752.db2.gz VGNSFXBZFWMCNH-CYBMUJFWSA-N 1 1 335.404 2.186 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](n2ccnc2)C1 ZINC000609157370 469897245 /nfs/dbraw/zinc/89/72/45/469897245.db2.gz GSUDEEZRZBQDAW-BBRMVZONSA-N 1 1 343.387 2.455 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](n2ccnc2)C1 ZINC000609157370 469897249 /nfs/dbraw/zinc/89/72/49/469897249.db2.gz GSUDEEZRZBQDAW-BBRMVZONSA-N 1 1 343.387 2.455 20 5 EEBDMO CCc1cc(NC[C@H]2CC[N@@H+](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000609156927 469897677 /nfs/dbraw/zinc/89/76/77/469897677.db2.gz RPGSGEMMSAQXLE-CYBMUJFWSA-N 1 1 341.415 2.400 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H](CCO)C3)n2)cc1 ZINC000609848955 469965457 /nfs/dbraw/zinc/96/54/57/469965457.db2.gz SEHSZQGEGBHDDL-LBPRGKRZSA-N 1 1 332.360 2.239 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H](CCO)C3)n2)cc1 ZINC000609848955 469965460 /nfs/dbraw/zinc/96/54/60/469965460.db2.gz SEHSZQGEGBHDDL-LBPRGKRZSA-N 1 1 332.360 2.239 20 5 EEBDMO COc1ccc(NC(=O)C[NH2+][C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000181381950 534082356 /nfs/dbraw/zinc/08/23/56/534082356.db2.gz DZYNEZCEIBNOPM-LLVKDONJSA-N 1 1 330.344 2.288 20 5 EEBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246845980 535519849 /nfs/dbraw/zinc/51/98/49/535519849.db2.gz QIIGADLGLNJELY-GOEBONIOSA-N 1 1 349.431 2.462 20 5 EEBDMO CCOc1cc(C(=O)OCCn2cc[nH+]c2C)c([N+](=O)[O-])cc1OC ZINC000771870107 577235250 /nfs/dbraw/zinc/23/52/50/577235250.db2.gz LMOACZSUSUETRV-UHFFFAOYSA-N 1 1 349.343 2.364 20 5 EEBDMO Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)CCCC[NH+]1CCOCC1)CC2 ZINC000773990819 577377171 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O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000754784468 577812934 /nfs/dbraw/zinc/81/29/34/577812934.db2.gz QDJSDQVVPLODOK-ZDUSSCGKSA-N 1 1 347.371 2.209 20 5 EEBDMO COc1cc(CN2CCC3(C2)CC[NH2+]CC3)c([N+](=O)[O-])cc1OC ZINC000261929106 676608760 /nfs/dbraw/zinc/60/87/60/676608760.db2.gz CNXSEONUKUZSCI-UHFFFAOYSA-N 1 1 335.404 2.188 20 5 EEBDMO Cn1c2ccccc2c(NC[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1=O ZINC000892421199 679793496 /nfs/dbraw/zinc/79/34/96/679793496.db2.gz GFVJVUCYPGIIEA-LBPRGKRZSA-N 1 1 330.388 2.200 20 5 EEBDMO COc1c(O)ccc(C[NH+]2CCC3(CC2)OCCCO3)c1[N+](=O)[O-] ZINC000894627332 682999137 /nfs/dbraw/zinc/99/91/37/682999137.db2.gz GBXMJERHKMHBDC-UHFFFAOYSA-N 1 1 338.360 2.038 20 5 EEBDMO C[C@]1(CO)C[C@H](O)C[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000895330350 684505816 /nfs/dbraw/zinc/50/58/16/684505816.db2.gz LJYFSRKUKHVKQZ-GOEBONIOSA-N 1 1 349.412 2.036 20 5 EEBDMO C[C@]1(CO)C[C@H](O)C[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000895330350 684505819 /nfs/dbraw/zinc/50/58/19/684505819.db2.gz LJYFSRKUKHVKQZ-GOEBONIOSA-N 1 1 349.412 2.036 20 5 EEBDMO CNC(=O)c1ccc(N2CC[N@@H+](C)C[C@H]2CC(C)C)c([N+](=O)[O-])c1 ZINC000896650840 685153250 /nfs/dbraw/zinc/15/32/50/685153250.db2.gz NFTFKLQXGXFXKO-CQSZACIVSA-N 1 1 334.420 2.121 20 5 EEBDMO CSCC(=O)N1CCC([N@@H+](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000985250874 686141639 /nfs/dbraw/zinc/14/16/39/686141639.db2.gz GNCXZRIKKSHXEN-UHFFFAOYSA-N 1 1 337.445 2.381 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)N[C@@H]1C[C@H](Nc2cc(C)ccc2[N+](=O)[O-])C1 ZINC001059769239 689390632 /nfs/dbraw/zinc/39/06/32/689390632.db2.gz HOBAWBOZDIPYJU-OKILXGFUSA-N 1 1 343.387 2.167 20 5 EEBDMO O=C(NCC[NH2+]Cc1ccc(-c2ccccc2)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001126943984 1189128227 /nfs/dbraw/zinc/12/82/27/1189128227.db2.gz YWTPKOWKMGEPJX-QZTJIDSGSA-N 1 1 339.395 2.225 20 5 EEBDMO Cc1ccccc1C[NH+]1CCC(N(C)C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001005375643 1195291773 /nfs/dbraw/zinc/29/17/73/1195291773.db2.gz NPZGQFVJFJVXNJ-IAGOWNOFSA-N 1 1 331.416 2.083 20 5 EEBDMO CC(C)(Cn1cc([C@@H]([NH3+])c2ccc(Cl)cc2F)nn1)[N+](=O)[O-] ZINC000864642646 1197861019 /nfs/dbraw/zinc/86/10/19/1197861019.db2.gz UFZWFRKGLXXBOR-LBPRGKRZSA-N 1 1 327.747 2.174 20 5 EEBDMO CON(C)C(=O)[C@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872091124 1198044502 /nfs/dbraw/zinc/04/45/02/1198044502.db2.gz VYEZNNWMJHCDKG-ZJUUUORDSA-N 1 1 327.406 2.376 20 5 EEBDMO O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[N@H+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000872712470 1198346751 /nfs/dbraw/zinc/34/67/51/1198346751.db2.gz PFAABRFCTIDACG-TXEJJXNPSA-N 1 1 327.340 2.046 20 5 EEBDMO O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[N@@H+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000872712470 1198346760 /nfs/dbraw/zinc/34/67/60/1198346760.db2.gz PFAABRFCTIDACG-TXEJJXNPSA-N 1 1 327.340 2.046 20 5 EEBDMO CC[C@@H]1C[N@@H+](C)CCCN1c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000865925838 1198426571 /nfs/dbraw/zinc/42/65/71/1198426571.db2.gz NJMHZGGZCKARPY-CYBMUJFWSA-N 1 1 332.404 2.400 20 5 EEBDMO O=C(Cc1ccccc1[N+](=O)[O-])N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000870078703 1200447872 /nfs/dbraw/zinc/44/78/72/1200447872.db2.gz HGNSVPFLYWEWNL-MRXNPFEDSA-N 1 1 341.367 2.016 20 5 EEBDMO CC(C)(O)[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000879962300 1201325429 /nfs/dbraw/zinc/32/54/29/1201325429.db2.gz MHTZFZYNKFVOGS-CYBMUJFWSA-N 1 1 335.404 2.406 20 5 EEBDMO CC(C)O[C@H]1CCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1 ZINC000867982578 1201719814 /nfs/dbraw/zinc/71/98/14/1201719814.db2.gz UBIGBRRKVNENJZ-DOTOQJQBSA-N 1 1 335.404 2.185 20 5 EEBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000129273420 1201769162 /nfs/dbraw/zinc/76/91/62/1201769162.db2.gz WPKHVQAGCLCTIG-CJNGLKHVSA-N 1 1 329.404 2.318 20 5 EEBDMO CC1CC[NH+](Cc2cn(C[C@H](O)c3cccc([N+](=O)[O-])c3)nn2)CC1 ZINC000883994080 1202193254 /nfs/dbraw/zinc/19/32/54/1202193254.db2.gz KUTRTFMWRCGNTQ-KRWDZBQOSA-N 1 1 345.403 2.152 20 5 EEBDMO CC1(C)CC[N@@H+](CCNC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000890079379 1204779627 /nfs/dbraw/zinc/77/96/27/1204779627.db2.gz VXZDJGZITBGQNC-UHFFFAOYSA-N 1 1 335.404 2.212 20 5 EEBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000930369126 1206552898 /nfs/dbraw/zinc/55/28/98/1206552898.db2.gz YMZXLCVBZKCRMZ-ZLIFDBKOSA-N 1 1 329.400 2.299 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](N(C)C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000931041303 1206602187 /nfs/dbraw/zinc/60/21/87/1206602187.db2.gz CEUSYCOHKDNXRD-CJNGLKHVSA-N 1 1 334.420 2.256 20 5 EEBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](N(C)C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000931041303 1206602188 /nfs/dbraw/zinc/60/21/88/1206602188.db2.gz CEUSYCOHKDNXRD-CJNGLKHVSA-N 1 1 334.420 2.256 20 5 EEBDMO CC(C)[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000075609993 1208781865 /nfs/dbraw/zinc/78/18/65/1208781865.db2.gz UDHFLQZIUYKSIG-UHFFFAOYSA-N 1 1 346.431 2.116 20 5 EEBDMO O=C(c1ccco1)N1C[C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001048648439 1238187022 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/nfs/dbraw/zinc/69/83/28/1240698328.db2.gz MEKBVGRMAUCOTA-QZTJIDSGSA-N 1 1 343.427 2.217 20 5 EEBDMO Cc1ccc(C)c(C[N@@H+]2CC=C(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001000669794 1240698332 /nfs/dbraw/zinc/69/83/32/1240698332.db2.gz MEKBVGRMAUCOTA-QZTJIDSGSA-N 1 1 343.427 2.217 20 5 EEBDMO O=C(N1CC2(C1)CC[N@H+](Cc1ccccc1[N+](=O)[O-])C2)C1(CF)CC1 ZINC001072970022 1255531466 /nfs/dbraw/zinc/53/14/66/1255531466.db2.gz ZLYYYHQLSRLIFZ-UHFFFAOYSA-N 1 1 347.390 2.379 20 5 EEBDMO CCOCCCC(=O)N1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001194971058 1283381751 /nfs/dbraw/zinc/38/17/51/1283381751.db2.gz QILZXLUEHMLDNY-UHFFFAOYSA-N 1 1 349.431 2.446 20 5 EEBDMO CCOCCCC(=O)N1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001194971058 1283381762 /nfs/dbraw/zinc/38/17/62/1283381762.db2.gz QILZXLUEHMLDNY-UHFFFAOYSA-N 1 1 349.431 2.446 20 5 EEBDMO CC(C)(C)OCC(=O)N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001195562175 1283621929 /nfs/dbraw/zinc/62/19/29/1283621929.db2.gz DZIAJHKAFWKDRO-UHFFFAOYSA-N 1 1 349.431 2.444 20 5 EEBDMO CC(C)(C)OCC(=O)N1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001195562175 1283621943 /nfs/dbraw/zinc/62/19/43/1283621943.db2.gz DZIAJHKAFWKDRO-UHFFFAOYSA-N 1 1 349.431 2.444 20 5 EEBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000825550041 1292705404 /nfs/dbraw/zinc/70/54/04/1292705404.db2.gz XWVFPCXDTRLSNV-IRXDYDNUSA-N 1 1 349.431 2.399 20 5 EEBDMO Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)OCC[NH+]2CCC2)c1 ZINC000861390039 1295386042 /nfs/dbraw/zinc/38/60/42/1295386042.db2.gz HKTCMNUICPFQPC-UHFFFAOYSA-N 1 1 344.371 2.011 20 5 EEBDMO COC(=O)c1cccc(CO[C@H]2CCc3[nH+]ccn3C2)c1[N+](=O)[O-] ZINC001223662127 1300216619 /nfs/dbraw/zinc/21/66/19/1300216619.db2.gz BCNJKDLUZUKCTH-LBPRGKRZSA-N 1 1 331.328 2.110 20 5 EEBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cc([N+](=O)[O-])ccc3F)C[C@H]1[N@H+]2C ZINC001226271416 1301330796 /nfs/dbraw/zinc/33/07/96/1301330796.db2.gz ZFTUAAFSVPMGJS-GMZLATJGSA-N 1 1 338.335 2.280 20 5 EEBDMO 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CCOc1cc(C[N@H+]2C[C@@H](N3CCOCC3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000285630932 464634975 /nfs/dbraw/zinc/63/49/75/464634975.db2.gz CVDNTABRUQYJBQ-HOCLYGCPSA-N 1 1 349.431 2.289 20 5 EEBDMO CC(C)(CCC(=O)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)[N+](=O)[O-] ZINC000295120278 464712115 /nfs/dbraw/zinc/71/21/15/464712115.db2.gz ISQXZIAZXSDWPJ-CALCHBBNSA-N 1 1 345.443 2.412 20 5 EEBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)n1 ZINC000285974111 464760639 /nfs/dbraw/zinc/76/06/39/464760639.db2.gz BLEODSCHDBZDCO-RYUDHWBXSA-N 1 1 336.392 2.309 20 5 EEBDMO CSc1ccc(C(=O)N2CC[NH2+]C[C@](C)(F)C2)cc1[N+](=O)[O-] ZINC000295346090 464796718 /nfs/dbraw/zinc/79/67/18/464796718.db2.gz YOLDNTNQWKTMCX-AWEZNQCLSA-N 1 1 327.381 2.090 20 5 EEBDMO COC(=O)[C@]1(C)C[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000282565361 464867831 /nfs/dbraw/zinc/86/78/31/464867831.db2.gz SXRIQZXHEXKPDV-PSTGCABASA-N 1 1 349.387 2.053 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC000192246432 464893053 /nfs/dbraw/zinc/89/30/53/464893053.db2.gz GTBNZWBQTSOJMR-UHFFFAOYSA-N 1 1 333.775 2.468 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCc2cc(Cl)ccc2C1 ZINC000192246432 464893062 /nfs/dbraw/zinc/89/30/62/464893062.db2.gz GTBNZWBQTSOJMR-UHFFFAOYSA-N 1 1 333.775 2.468 20 5 EEBDMO COc1ccc(CNC(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000339860004 465554796 /nfs/dbraw/zinc/55/47/96/465554796.db2.gz QYMAXUWFFUGDIB-KBPBESRZSA-N 1 1 348.403 2.029 20 5 EEBDMO C[NH+](C)Cc1cnc(CNCc2nc3cc([N+](=O)[O-])ccc3[nH]2)s1 ZINC000348396656 465579577 /nfs/dbraw/zinc/57/95/77/465579577.db2.gz QIDQDYKGOUURMF-UHFFFAOYSA-N 1 1 346.416 2.279 20 5 EEBDMO CNC(=O)c1ccc(NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000299071641 465587187 /nfs/dbraw/zinc/58/71/87/465587187.db2.gz PAEZEGMWFMIYNX-CHWSQXEVSA-N 1 1 334.420 2.487 20 5 EEBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000299078795 465591501 /nfs/dbraw/zinc/59/15/01/465591501.db2.gz IREDOTNTEBHKCG-KGLIPLIRSA-N 1 1 335.404 2.210 20 5 EEBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]([C@H]2CCOC2)C1 ZINC000371233172 465658791 /nfs/dbraw/zinc/65/87/91/465658791.db2.gz WUSKTIRUJCQBKC-RDBSUJKOSA-N 1 1 333.388 2.280 20 5 EEBDMO C[C@@H]1C[N@@H+](C[C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000299277741 465679796 /nfs/dbraw/zinc/67/97/96/465679796.db2.gz ARGKPVWMDHOVOP-JKIFEVAISA-N 1 1 347.415 2.309 20 5 EEBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000299277741 465679806 /nfs/dbraw/zinc/67/98/06/465679806.db2.gz ARGKPVWMDHOVOP-JKIFEVAISA-N 1 1 347.415 2.309 20 5 EEBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000330590580 465720368 /nfs/dbraw/zinc/72/03/68/465720368.db2.gz OAAPUZVQIFLUEP-RYUDHWBXSA-N 1 1 331.376 2.169 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)c1 ZINC000345313536 465854220 /nfs/dbraw/zinc/85/42/20/465854220.db2.gz JKIPCELLCJSCTK-MRXNPFEDSA-N 1 1 349.431 2.471 20 5 EEBDMO CC(C)[N@@H+](C)CCN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000353495559 465929664 /nfs/dbraw/zinc/92/96/64/465929664.db2.gz IPKQGFLLGDHRJR-INIZCTEOSA-N 1 1 331.420 2.348 20 5 EEBDMO CC(C)[C@@](C)(O)C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000353523473 465951466 /nfs/dbraw/zinc/95/14/66/465951466.db2.gz ULWMRDSNGFWVCY-WBVHZDCISA-N 1 1 332.404 2.414 20 5 EEBDMO CC[C@H](C)[C@H](O)C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000353528375 465954416 /nfs/dbraw/zinc/95/44/16/465954416.db2.gz GVBVQYINMTUOGN-MAZHCROVSA-N 1 1 332.404 2.414 20 5 EEBDMO CC[N@H+]1CCCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])CC1 ZINC000301518834 465977258 /nfs/dbraw/zinc/97/72/58/465977258.db2.gz KOKGRYIPWMVMEA-UHFFFAOYSA-N 1 1 334.420 2.265 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CC1CCC1)[C@@H](C)CO ZINC000361500454 466048837 /nfs/dbraw/zinc/04/88/37/466048837.db2.gz FAXNWDCDNCOJKT-ZDUSSCGKSA-N 1 1 335.404 2.325 20 5 EEBDMO O=[N+]([O-])c1ccsc1NCCC[NH+]1CCN(c2ncccn2)CC1 ZINC000301938252 466064278 /nfs/dbraw/zinc/06/42/78/466064278.db2.gz RVRANFTYSQBCEP-UHFFFAOYSA-N 1 1 348.432 2.071 20 5 EEBDMO CCCc1n[nH]c(C(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000372298121 466286627 /nfs/dbraw/zinc/28/66/27/466286627.db2.gz MLMJULCLOZNCHQ-AWEZNQCLSA-N 1 1 343.387 2.187 20 5 EEBDMO CCCc1n[nH]c(C(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000372298121 466286635 /nfs/dbraw/zinc/28/66/35/466286635.db2.gz MLMJULCLOZNCHQ-AWEZNQCLSA-N 1 1 343.387 2.187 20 5 EEBDMO C[C@H]1C[C@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C ZINC000332019778 466348001 /nfs/dbraw/zinc/34/80/01/466348001.db2.gz FYLMSSCLXVOJCC-WCQYABFASA-N 1 1 330.388 2.218 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)C(C)C ZINC000338767905 466367731 /nfs/dbraw/zinc/36/77/31/466367731.db2.gz RYJKILBMVXFWJE-UHFFFAOYSA-N 1 1 345.403 2.241 20 5 EEBDMO C[C@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]1CO ZINC000305203685 466377161 /nfs/dbraw/zinc/37/71/61/466377161.db2.gz WYFQYXMRKRKPHY-SMDDNHRTSA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]1CO ZINC000305203685 466377170 /nfs/dbraw/zinc/37/71/70/466377170.db2.gz WYFQYXMRKRKPHY-SMDDNHRTSA-N 1 1 332.360 2.238 20 5 EEBDMO C[C@H](NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)C1=CC[N@@H+](C)CC1 ZINC000358115475 466469890 /nfs/dbraw/zinc/46/98/90/466469890.db2.gz DEPZTQWPFSFJPW-NSHDSACASA-N 1 1 328.372 2.456 20 5 EEBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]([C@H](C)CO)C1CCCC1 ZINC000347246795 466507305 /nfs/dbraw/zinc/50/73/05/466507305.db2.gz JOKROPJGOHCTFT-CYBMUJFWSA-N 1 1 335.404 2.467 20 5 EEBDMO Cc1cc([C@H]2CCC[N@H+]2C[C@@H](O)COc2cccc([N+](=O)[O-])c2)on1 ZINC000339007298 466565017 /nfs/dbraw/zinc/56/50/17/466565017.db2.gz GDHMDWFJFYIYAO-GDBMZVCRSA-N 1 1 347.371 2.468 20 5 EEBDMO O=[N+]([O-])c1ccc2nc(NC[C@H]3C[N@H+]4CCC[C@H]4CO3)ccc2c1 ZINC000325191078 466654859 /nfs/dbraw/zinc/65/48/59/466654859.db2.gz AAZOSVXHIIEIEC-GJZGRUSLSA-N 1 1 328.372 2.418 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])C[C@H]1C ZINC000410636732 466720666 /nfs/dbraw/zinc/72/06/66/466720666.db2.gz NGATVSHBOLVQEB-MNOVXSKESA-N 1 1 339.367 2.297 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@@H](O)C[C@@H]3CO)s2)cc1 ZINC000370398397 466861583 /nfs/dbraw/zinc/86/15/83/466861583.db2.gz HRQMVTBBWPXIQV-KGLIPLIRSA-N 1 1 334.397 2.251 20 5 EEBDMO CC(C)[NH+]1CCC(NC(=O)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000411770256 466897942 /nfs/dbraw/zinc/89/79/42/466897942.db2.gz LWBRMKTUARAHGI-AWEZNQCLSA-N 1 1 348.447 2.234 20 5 EEBDMO CC(C)[N@H+]1CC[C@H](N(C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000411856609 466918622 /nfs/dbraw/zinc/91/86/22/466918622.db2.gz BRTAGJSZEVBSOO-INIZCTEOSA-N 1 1 334.420 2.338 20 5 EEBDMO CC(C)N1CC[C@H]([N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000411856609 466918626 /nfs/dbraw/zinc/91/86/26/466918626.db2.gz BRTAGJSZEVBSOO-INIZCTEOSA-N 1 1 334.420 2.338 20 5 EEBDMO CC(C)N1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000411856609 466918631 /nfs/dbraw/zinc/91/86/31/466918631.db2.gz BRTAGJSZEVBSOO-INIZCTEOSA-N 1 1 334.420 2.338 20 5 EEBDMO Cc1ccc(C(=O)N2CC[NH2+]C[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000423970081 466932878 /nfs/dbraw/zinc/93/28/78/466932878.db2.gz MDMGUZGBDRXIJG-INIZCTEOSA-N 1 1 326.356 2.085 20 5 EEBDMO COC(=O)[C@@]1(C)CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000412061965 466989236 /nfs/dbraw/zinc/98/92/36/466989236.db2.gz HXUHKKJVPOBHLN-KRWDZBQOSA-N 1 1 349.387 2.199 20 5 EEBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412186951 467034551 /nfs/dbraw/zinc/03/45/51/467034551.db2.gz TWMZBRMYOGDVBN-GLZXHMCRSA-N 1 1 329.400 2.297 20 5 EEBDMO CN(C)c1[nH+]cc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)n1C ZINC000413129037 467175637 /nfs/dbraw/zinc/17/56/37/467175637.db2.gz BCXQXGWETLEOQW-UHFFFAOYSA-N 1 1 344.297 2.420 20 5 EEBDMO C[C@@H](CN1CC[NH+](C)CC1)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000413141665 467177965 /nfs/dbraw/zinc/17/79/65/467177965.db2.gz TYCBYGWGSRDKIV-ZDUSSCGKSA-N 1 1 329.404 2.191 20 5 EEBDMO Cn1cc[nH+]c1N1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413154372 467180359 /nfs/dbraw/zinc/18/03/59/467180359.db2.gz KDFYIGVIAJAPBI-UHFFFAOYSA-N 1 1 338.371 2.203 20 5 EEBDMO C[N@H+]1CCO[C@H]2CCN(c3ccc([N+](=O)[O-])c4ncccc34)C[C@@H]21 ZINC000413286962 467207818 /nfs/dbraw/zinc/20/78/18/467207818.db2.gz FBQMJQGUXWEMHS-HOTGVXAUSA-N 1 1 328.372 2.052 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+](C2CC2)C[C@H](C)C1 ZINC000451080274 467241761 /nfs/dbraw/zinc/24/17/61/467241761.db2.gz BNFNLKVTDGKDKQ-KGLIPLIRSA-N 1 1 346.431 2.338 20 5 EEBDMO CO[C@H]1C[C@H]([N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000451857279 467274521 /nfs/dbraw/zinc/27/45/21/467274521.db2.gz UGIFTHUHHAFRFY-HOTGVXAUSA-N 1 1 347.415 2.447 20 5 EEBDMO CO[C@H]1C[C@H]([N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000451857279 467274523 /nfs/dbraw/zinc/27/45/23/467274523.db2.gz UGIFTHUHHAFRFY-HOTGVXAUSA-N 1 1 347.415 2.447 20 5 EEBDMO COc1ccc(OCCN[C@H](C[NH3+])C2CCCCC2)c([N+](=O)[O-])c1 ZINC000420354363 467375338 /nfs/dbraw/zinc/37/53/38/467375338.db2.gz BFFNPZMSILPMOW-OAHLLOKOSA-N 1 1 337.420 2.479 20 5 EEBDMO CN(C[C@H]1CCC[N@H+]1C)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000420633515 467438421 /nfs/dbraw/zinc/43/84/21/467438421.db2.gz JIORMGRSDYPOGK-CQSZACIVSA-N 1 1 332.404 2.017 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000408069979 467504251 /nfs/dbraw/zinc/50/42/51/467504251.db2.gz HAQIRZVSRLJCMP-NWDGAFQWSA-N 1 1 328.372 2.308 20 5 EEBDMO CCC1(C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)COC1 ZINC000449602884 467668974 /nfs/dbraw/zinc/66/89/74/467668974.db2.gz UWHWOKDSFSSJKH-OAHLLOKOSA-N 1 1 330.388 2.434 20 5 EEBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000450315781 467824676 /nfs/dbraw/zinc/82/46/76/467824676.db2.gz DMNYXQDXRCCZDA-ZIAGYGMSSA-N 1 1 347.415 2.499 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000450315781 467824680 /nfs/dbraw/zinc/82/46/80/467824680.db2.gz DMNYXQDXRCCZDA-ZIAGYGMSSA-N 1 1 347.415 2.499 20 5 EEBDMO COc1ccc(NC(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000487227719 468029352 /nfs/dbraw/zinc/02/93/52/468029352.db2.gz TWOCADJYROHMRY-AWEZNQCLSA-N 1 1 336.392 2.407 20 5 EEBDMO Cc1c(CNC(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000487298042 468031703 /nfs/dbraw/zinc/03/17/03/468031703.db2.gz RMUCLBCSHOLKQC-INIZCTEOSA-N 1 1 334.420 2.385 20 5 EEBDMO C[C@@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000517622845 468091162 /nfs/dbraw/zinc/09/11/62/468091162.db2.gz NCJRABLXIUOLPT-MJBXVCDLSA-N 1 1 335.404 2.351 20 5 EEBDMO Cn1ccnc1[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000533861532 468226388 /nfs/dbraw/zinc/22/63/88/468226388.db2.gz VCHDDWJDTCFEPQ-LBPRGKRZSA-N 1 1 344.371 2.184 20 5 EEBDMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1 ZINC000534517930 468261210 /nfs/dbraw/zinc/26/12/10/468261210.db2.gz RSKSRHKJNLWJEZ-XJKSGUPXSA-N 1 1 346.431 2.391 20 5 EEBDMO COc1cc(C(=O)N2CCC[C@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000597717089 468650219 /nfs/dbraw/zinc/65/02/19/468650219.db2.gz YIAZOMUPEDVIDI-QGZVFWFLSA-N 1 1 333.388 2.161 20 5 EEBDMO C[C@H]1CN(c2ccnc3ccc([N+](=O)[O-])cc32)CC[N@H+]1CC(C)(C)O ZINC000601151257 468762546 /nfs/dbraw/zinc/76/25/46/468762546.db2.gz UUNHYMFILLMOLX-ZDUSSCGKSA-N 1 1 344.415 2.424 20 5 EEBDMO COC(=O)c1ccnc(N(C)CC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000598601762 468928282 /nfs/dbraw/zinc/92/82/82/468928282.db2.gz VXALPTVUCHGRHW-LBPRGKRZSA-N 1 1 336.392 2.087 20 5 EEBDMO C[C@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H]1CCO ZINC000595699918 468960170 /nfs/dbraw/zinc/96/01/70/468960170.db2.gz PLKLALRKCSSVHV-BBRMVZONSA-N 1 1 335.404 2.041 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)[C@](C)(CO)C1 ZINC000595876389 469059170 /nfs/dbraw/zinc/05/91/70/469059170.db2.gz SRYLQAKKILRXQB-DYVFJYSZSA-N 1 1 335.404 2.182 20 5 EEBDMO CC(C)[C@@H]1c2ccccc2CC[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000610783299 469070036 /nfs/dbraw/zinc/07/00/36/469070036.db2.gz JCIBHBVCWZURQV-FUHWJXTLSA-N 1 1 344.415 2.408 20 5 EEBDMO CO[C@@]1(C(F)(F)F)CCC[N@H+](CCn2c(C)ncc2[N+](=O)[O-])C1 ZINC000602813078 469091800 /nfs/dbraw/zinc/09/18/00/469091800.db2.gz DKUJNLLNPMRNMV-LBPRGKRZSA-N 1 1 336.314 2.143 20 5 EEBDMO CO[C@@]1(C(F)(F)F)CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1 ZINC000602813078 469091806 /nfs/dbraw/zinc/09/18/06/469091806.db2.gz DKUJNLLNPMRNMV-LBPRGKRZSA-N 1 1 336.314 2.143 20 5 EEBDMO COCC[N@@H+](C)CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000593705060 469102661 /nfs/dbraw/zinc/10/26/61/469102661.db2.gz KNPPFQSNIRJHDC-ZDUSSCGKSA-N 1 1 335.326 2.366 20 5 EEBDMO COCC[N@@H+]1CC[C@H](Nc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596124117 469166707 /nfs/dbraw/zinc/16/67/07/469166707.db2.gz 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CC(C)C[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000824262060 607736297 /nfs/dbraw/zinc/73/62/97/607736297.db2.gz VMWHXMSLLAEIOA-CYBMUJFWSA-N 1 1 345.407 2.307 20 5 EEBDMO COCC[N@H+]1CCCN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])CC1 ZINC000891863487 676871284 /nfs/dbraw/zinc/87/12/84/676871284.db2.gz YJZJTRPVVRPUSV-UHFFFAOYSA-N 1 1 348.378 2.441 20 5 EEBDMO COc1c(O)ccc(C[N@@H+]2CCC[C@H](n3ccnc3)C2)c1[N+](=O)[O-] ZINC000891904275 676897562 /nfs/dbraw/zinc/89/75/62/676897562.db2.gz GYPGRKSCUWRCOJ-ZDUSSCGKSA-N 1 1 332.360 2.343 20 5 EEBDMO COc1c(O)ccc(C[N@H+]2CCC[C@H](n3ccnc3)C2)c1[N+](=O)[O-] ZINC000891904275 676897563 /nfs/dbraw/zinc/89/75/63/676897563.db2.gz GYPGRKSCUWRCOJ-ZDUSSCGKSA-N 1 1 332.360 2.343 20 5 EEBDMO C[C@@H](C(=O)OCCC[N@H+]1CCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000893386447 685167860 /nfs/dbraw/zinc/16/78/60/685167860.db2.gz UDUCXTXJENDNCM-ZIAGYGMSSA-N 1 1 336.388 2.352 20 5 EEBDMO C[C@@H]1C[N@@H+](CCCOC(=O)CCc2cccc([N+](=O)[O-])c2)CCO1 ZINC000893390898 685223976 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O=[N+]([O-])c1cccc(Cl)c1N1CC[NH+]([C@@H]2CCC[C@H]2O)CC1 ZINC000368639513 275039424 /nfs/dbraw/zinc/03/94/24/275039424.db2.gz VTIYBNVYXXYGDM-TZMCWYRMSA-N 1 1 325.796 2.284 20 5 EEBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000173995612 280157259 /nfs/dbraw/zinc/15/72/59/280157259.db2.gz AQUVDBIJAALFJG-WMZOPIPTSA-N 1 1 346.431 2.414 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)CCN1CC[NH+](C)CC1 ZINC000183894020 281018260 /nfs/dbraw/zinc/01/82/60/281018260.db2.gz QHLWFRIJSHFGQW-AWEZNQCLSA-N 1 1 349.435 2.051 20 5 EEBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000293654599 293262657 /nfs/dbraw/zinc/26/26/57/293262657.db2.gz HEGOMMVIYDIOCO-QGZVFWFLSA-N 1 1 333.388 2.161 20 5 EEBDMO Cc1cc(OCC(=O)N2CC[C@]3(C2)CCC[N@H+](C)C3)ccc1[N+](=O)[O-] ZINC000294187256 293391501 /nfs/dbraw/zinc/39/15/01/293391501.db2.gz PJEBMYOGHXUAGK-GOSISDBHSA-N 1 1 347.415 2.226 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C 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HMHAYIHPJBVMNR-NSHDSACASA-N 1 1 344.209 2.347 20 5 EEBDMO Cc1c(NC(=O)[C@@H](C)N2CCC[C@@H](CC[NH3+])C2)cccc1[N+](=O)[O-] ZINC000443056939 315226183 /nfs/dbraw/zinc/22/61/83/315226183.db2.gz DULRFSJRENJZSP-KGLIPLIRSA-N 1 1 334.420 2.291 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445514161 315357299 /nfs/dbraw/zinc/35/72/99/315357299.db2.gz SLYCTGBKJABPAU-IRXDYDNUSA-N 1 1 344.415 2.289 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445514164 315357717 /nfs/dbraw/zinc/35/77/17/315357717.db2.gz SLYCTGBKJABPAU-SJORKVTESA-N 1 1 344.415 2.289 20 5 EEBDMO C[C@H]1CC[N@@H+](CCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000524720895 317023783 /nfs/dbraw/zinc/02/37/83/317023783.db2.gz LBXADZGSNNWPDK-LBPRGKRZSA-N 1 1 332.404 2.241 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000574355502 320017578 /nfs/dbraw/zinc/01/75/78/320017578.db2.gz WMSYLXAKELGNJG-JKSUJKDBSA-N 1 1 343.383 2.219 20 5 EEBDMO O=C(C[N@H+]1CCC[C@H]1[C@H]1CCCOC1)Nc1ccccc1[N+](=O)[O-] ZINC000574873215 320064921 /nfs/dbraw/zinc/06/49/21/320064921.db2.gz GNBKJVROQARBPM-ZFWWWQNUSA-N 1 1 333.388 2.424 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCC[N@@H+](CCO)CC1 ZINC000578285973 320304683 /nfs/dbraw/zinc/30/46/83/320304683.db2.gz XAMHQFVUCKYLRD-UHFFFAOYSA-N 1 1 334.203 2.406 20 5 EEBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCC[N@H+](CCO)CC1 ZINC000578285973 320304685 /nfs/dbraw/zinc/30/46/85/320304685.db2.gz XAMHQFVUCKYLRD-UHFFFAOYSA-N 1 1 334.203 2.406 20 5 EEBDMO CN(C(=O)C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000284670303 464287421 /nfs/dbraw/zinc/28/74/21/464287421.db2.gz GXLJYQMSVMWMAN-CVEARBPZSA-N 1 1 333.388 2.201 20 5 EEBDMO CN(C(=O)C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000284670303 464287423 /nfs/dbraw/zinc/28/74/23/464287423.db2.gz GXLJYQMSVMWMAN-CVEARBPZSA-N 1 1 333.388 2.201 20 5 EEBDMO C[C@H]1C[C@H](N(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C ZINC000127516045 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RPNJYSIBODBVLK-CQSZACIVSA-N 1 1 334.420 2.121 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@]3(CCOC3)C2)cccc1[N+](=O)[O-] ZINC000153569124 462665162 /nfs/dbraw/zinc/66/51/62/462665162.db2.gz NTAODLZPUBQUFH-KRWDZBQOSA-N 1 1 333.388 2.344 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@]3(CCOC3)C2)cccc1[N+](=O)[O-] ZINC000153569251 462665654 /nfs/dbraw/zinc/66/56/54/462665654.db2.gz NTAODLZPUBQUFH-QGZVFWFLSA-N 1 1 333.388 2.344 20 5 EEBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])o2)[C@H](C)C1 ZINC000115273418 462703744 /nfs/dbraw/zinc/70/37/44/462703744.db2.gz QSHPPIPCZWUUKL-CHWSQXEVSA-N 1 1 339.392 2.055 20 5 EEBDMO O=[N+]([O-])c1ccc(OCC[NH+]2CCC(O)(C(F)(F)F)CC2)cc1 ZINC000089968494 462756272 /nfs/dbraw/zinc/75/62/72/462756272.db2.gz AOFUVYLLLVOUKQ-UHFFFAOYSA-N 1 1 334.294 2.363 20 5 EEBDMO Cc1[nH+]ccn1CCCCNC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000156378521 463016377 /nfs/dbraw/zinc/01/63/77/463016377.db2.gz QYSLTDXUTJOLHH-UHFFFAOYSA-N 1 1 334.351 2.378 20 5 EEBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)NCC[NH+]1Cc2ccccc2C1 ZINC000067744342 463046114 /nfs/dbraw/zinc/04/61/14/463046114.db2.gz WLVOUUIILMJLKN-UHFFFAOYSA-N 1 1 325.368 2.269 20 5 EEBDMO C[C@@H]1CC[N@H+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1C ZINC000156789182 463068399 /nfs/dbraw/zinc/06/83/99/463068399.db2.gz RZFNHBORBBDEAE-TYNCELHUSA-N 1 1 331.372 2.205 20 5 EEBDMO CCOC(=O)c1ccnc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c1[N+](=O)[O-] ZINC000077963743 463074659 /nfs/dbraw/zinc/07/46/59/463074659.db2.gz IVIPLNHHKAEBSA-NSHDSACASA-N 1 1 345.359 2.274 20 5 EEBDMO O=C(NCCC[NH+]1CCCCCC1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000067997980 463078385 /nfs/dbraw/zinc/07/83/85/463078385.db2.gz QQIBBDKPBVELTI-UHFFFAOYSA-N 1 1 345.403 2.467 20 5 EEBDMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]2CSC)c([N+](=O)[O-])c1 ZINC000135488563 463164479 /nfs/dbraw/zinc/16/44/79/463164479.db2.gz UJYAPCMCUYXVFE-LLVKDONJSA-N 1 1 339.417 2.369 20 5 EEBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@@H]2CSC)c([N+](=O)[O-])c1 ZINC000135488563 463164485 /nfs/dbraw/zinc/16/44/85/463164485.db2.gz UJYAPCMCUYXVFE-LLVKDONJSA-N 1 1 339.417 2.369 20 5 EEBDMO CC[N@@H+](CC(C)(C)O)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000158176816 463213064 /nfs/dbraw/zinc/21/30/64/463213064.db2.gz ROJLWLYHWAWJIY-LLVKDONJSA-N 1 1 339.392 2.023 20 5 EEBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)cc1[N+](=O)[O-] ZINC000069534443 463271423 /nfs/dbraw/zinc/27/14/23/463271423.db2.gz ZFIYMJSQGBBJED-VIFPVBQESA-N 1 1 336.348 2.024 20 5 EEBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000055400467 463315179 /nfs/dbraw/zinc/31/51/79/463315179.db2.gz VTFCIOIFHVQSDD-ZIAGYGMSSA-N 1 1 335.404 2.210 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@H](C)[C@@H]1C ZINC000139302035 463321180 /nfs/dbraw/zinc/32/11/80/463321180.db2.gz XVAQEBDIAWTTKH-NWDGAFQWSA-N 1 1 337.376 2.041 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000140346225 463340391 /nfs/dbraw/zinc/34/03/91/463340391.db2.gz 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CC(C)[N@@H+](C)CC(=O)NC1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC001095418572 1205721852 /nfs/dbraw/zinc/72/18/52/1205721852.db2.gz QFTWNYUVTLDMNB-UHFFFAOYSA-N 1 1 334.420 2.020 20 5 EEBDMO CNC(=O)CCC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Br ZINC000930082554 1206533708 /nfs/dbraw/zinc/53/37/08/1206533708.db2.gz PYQRAKKICWCJDB-UHFFFAOYSA-N 1 1 344.209 2.315 20 5 EEBDMO CNC(=O)CCC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Br ZINC000930082554 1206533710 /nfs/dbraw/zinc/53/37/10/1206533710.db2.gz PYQRAKKICWCJDB-UHFFFAOYSA-N 1 1 344.209 2.315 20 5 EEBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2C2OCCO2)cccc1[N+](=O)[O-] ZINC000933904225 1207866337 /nfs/dbraw/zinc/86/63/37/1207866337.db2.gz VUBQUIAICSFEGV-OAHLLOKOSA-N 1 1 349.387 2.069 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1C1OCCO1 ZINC000933904608 1207866567 /nfs/dbraw/zinc/86/65/67/1207866567.db2.gz ZBTIATBOFSPKQY-OAHLLOKOSA-N 1 1 349.387 2.069 20 5 EEBDMO CC(C)C[NH+]1CCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000778220766 1207899902 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/nfs/dbraw/zinc/15/13/91/243151391.db2.gz NDWVEQCHVCIGRP-SUMWQHHRSA-N 1 1 347.415 2.231 20 5 EEBDMO CCO[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1C ZINC000451542273 243151397 /nfs/dbraw/zinc/15/13/97/243151397.db2.gz NDWVEQCHVCIGRP-SUMWQHHRSA-N 1 1 347.415 2.231 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCn1cccn1 ZINC000111281183 220133815 /nfs/dbraw/zinc/13/38/15/220133815.db2.gz SBTIJKDLVCUVOW-UHFFFAOYSA-N 1 1 331.376 2.060 20 5 EEBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[NH+]1CCN(C)CC1 ZINC000266357197 248262756 /nfs/dbraw/zinc/26/27/56/248262756.db2.gz KEAMAWNNZUGOSI-LLVKDONJSA-N 1 1 344.362 2.244 20 5 EEBDMO Cc1nc(N2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000268539959 252007404 /nfs/dbraw/zinc/00/74/04/252007404.db2.gz ZBUIBKUIDKHUSL-GASCZTMLSA-N 1 1 347.463 2.293 20 5 EEBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000270334198 256124317 /nfs/dbraw/zinc/12/43/17/256124317.db2.gz IVYLMOHQBKDQDE-JKSUJKDBSA-N 1 1 332.404 2.063 20 5 EEBDMO C[C@H](c1cccnc1)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000270683125 256160008 /nfs/dbraw/zinc/16/00/08/256160008.db2.gz VNSYDKPSLBVLSY-CJNGLKHVSA-N 1 1 331.372 2.423 20 5 EEBDMO COc1ccc(NC(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000272824281 256241654 /nfs/dbraw/zinc/24/16/54/256241654.db2.gz LOMRUYLYVCMKTJ-AAEUAGOBSA-N 1 1 334.376 2.304 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000274288489 256370861 /nfs/dbraw/zinc/37/08/61/256370861.db2.gz LTROAPDYHRNTBO-IUODEOHRSA-N 1 1 328.372 2.173 20 5 EEBDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000352203278 153003614 /nfs/dbraw/zinc/00/36/14/153003614.db2.gz QKNCOELAYJMZML-LLVKDONJSA-N 1 1 327.768 2.298 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000352203278 153003619 /nfs/dbraw/zinc/00/36/19/153003619.db2.gz QKNCOELAYJMZML-LLVKDONJSA-N 1 1 327.768 2.298 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)c1 ZINC000344961827 292290418 /nfs/dbraw/zinc/29/04/18/292290418.db2.gz HLZRHECNQQXZBN-KGLIPLIRSA-N 1 1 335.404 2.223 20 5 EEBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1c([N+](=O)[O-])c(C)nn1C ZINC000126305104 292309009 /nfs/dbraw/zinc/30/90/09/292309009.db2.gz ZXXHPXOIEPWWCK-ZDUSSCGKSA-N 1 1 337.424 2.021 20 5 EEBDMO CCCc1n[nH]c(C(=O)NCCC[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000068609363 159021862 /nfs/dbraw/zinc/02/18/62/159021862.db2.gz FINNHXHNFRZILP-GFCCVEGCSA-N 1 1 337.424 2.265 20 5 EEBDMO CC(C)OCC[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000072731889 159044021 /nfs/dbraw/zinc/04/40/21/159044021.db2.gz XSKZAMZLJVDOJV-UHFFFAOYSA-N 1 1 336.392 2.169 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(n2cccn2)CC1 ZINC000109007306 159346302 /nfs/dbraw/zinc/34/63/02/159346302.db2.gz WPPHPQWGNPGPGI-CYBMUJFWSA-N 1 1 343.387 2.455 20 5 EEBDMO CCCc1n[nH]c(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-] ZINC000109688849 159351129 /nfs/dbraw/zinc/35/11/29/159351129.db2.gz CNLGCCDZXGRNSB-NSHDSACASA-N 1 1 335.408 2.017 20 5 EEBDMO CC[C@@H](CSC)[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000245572041 160243241 /nfs/dbraw/zinc/24/32/41/160243241.db2.gz CFRQKBQMERMOFQ-GXTWGEPZSA-N 1 1 328.434 2.408 20 5 EEBDMO C[C@@H](c1ccccn1)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248472658 160348162 /nfs/dbraw/zinc/34/81/62/160348162.db2.gz WHGWUOFHXJKUIT-UONOGXRCSA-N 1 1 331.372 2.423 20 5 EEBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000341690924 161005414 /nfs/dbraw/zinc/00/54/14/161005414.db2.gz WTVZKGNADPAZRU-OWCLPIDISA-N 1 1 348.447 2.094 20 5 EEBDMO CCOc1cc(N2C[C@H]([NH+]3CCOCC3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000343266568 161118544 /nfs/dbraw/zinc/11/85/44/161118544.db2.gz SOLLIQBUYQULKH-UKRRQHHQSA-N 1 1 335.404 2.293 20 5 EEBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000343266940 161118721 /nfs/dbraw/zinc/11/87/21/161118721.db2.gz MTXWYKCETKMDMG-OLZOCXBDSA-N 1 1 328.372 2.433 20 5 EEBDMO CC[N@@H+](CCNC(=O)N(C)CCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000344769259 161244410 /nfs/dbraw/zinc/24/44/10/161244410.db2.gz USSPTHOFUYKXJX-UHFFFAOYSA-N 1 1 334.420 2.263 20 5 EEBDMO C[C@H]1[C@@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C ZINC000345327102 161292154 /nfs/dbraw/zinc/29/21/54/161292154.db2.gz SUKJSKWEYCJFRY-BBRMVZONSA-N 1 1 334.420 2.386 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(c3nc(-c4ccc([N+](=O)[O-])cc4)no3)[C@@H]2C1 ZINC000352089994 162064879 /nfs/dbraw/zinc/06/48/79/162064879.db2.gz TXVIHPVDVWKJPC-SMDDNHRTSA-N 1 1 329.360 2.175 20 5 EEBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCC[C@H]1O ZINC000352659159 162230597 /nfs/dbraw/zinc/23/05/97/162230597.db2.gz LXBVJAYZMWGCTE-WCQYABFASA-N 1 1 327.768 2.032 20 5 EEBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)[C@H]1CCC[C@H]1O ZINC000352695660 162250662 /nfs/dbraw/zinc/25/06/62/162250662.db2.gz IPFWLCDVRPMCLU-BIGNPOOSSA-N 1 1 341.795 2.420 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CC[C@@H](n4cncn4)C3)co2)cc1 ZINC000364452692 165141752 /nfs/dbraw/zinc/14/17/52/165141752.db2.gz HJPFVYXCFAQJPE-OAHLLOKOSA-N 1 1 340.343 2.288 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@@H](n4cncn4)C3)co2)cc1 ZINC000364452692 165141758 /nfs/dbraw/zinc/14/17/58/165141758.db2.gz HJPFVYXCFAQJPE-OAHLLOKOSA-N 1 1 340.343 2.288 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000163762733 226013697 /nfs/dbraw/zinc/01/36/97/226013697.db2.gz BXOKKNZYZPVORC-CYBMUJFWSA-N 1 1 343.387 2.055 20 5 EEBDMO C[C@H](O)C[C@H]1CCCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000279066565 269260371 /nfs/dbraw/zinc/26/03/71/269260371.db2.gz ACSLRYKSSBKKIH-DZGCQCFKSA-N 1 1 347.415 2.109 20 5 EEBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H](CC(N)=O)c1ccccc1 ZINC000280656281 269382830 /nfs/dbraw/zinc/38/28/30/269382830.db2.gz ZODRLKYIBKMQCB-IAGOWNOFSA-N 1 1 343.383 2.177 20 5 EEBDMO COc1cc(C(=O)NCC[N@H+]2CCC[C@@H](C)C2)cc([N+](=O)[O-])c1C ZINC000188731100 274032715 /nfs/dbraw/zinc/03/27/15/274032715.db2.gz BDOKVVGFGWFVJV-GFCCVEGCSA-N 1 1 335.404 2.374 20 5 EEBDMO NC(=O)c1ccc(C[N@@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000289751970 275145429 /nfs/dbraw/zinc/14/54/29/275145429.db2.gz YSMHFJUMTPOTAV-HZPDHXFCSA-N 1 1 345.399 2.227 20 5 EEBDMO NC(=O)c1ccc(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000289751970 275145431 /nfs/dbraw/zinc/14/54/31/275145431.db2.gz YSMHFJUMTPOTAV-HZPDHXFCSA-N 1 1 345.399 2.227 20 5 EEBDMO C[N@@H+](CCCNc1nccc(C(N)=O)c1[N+](=O)[O-])C1CCCCC1 ZINC000290588142 275220635 /nfs/dbraw/zinc/22/06/35/275220635.db2.gz WWQZRPKVIKBGHJ-UHFFFAOYSA-N 1 1 335.408 2.155 20 5 EEBDMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000269332201 281194149 /nfs/dbraw/zinc/19/41/49/281194149.db2.gz APQUSHQFYSYDIN-NWDGAFQWSA-N 1 1 335.408 2.140 20 5 EEBDMO CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000269332201 281194151 /nfs/dbraw/zinc/19/41/51/281194151.db2.gz APQUSHQFYSYDIN-NWDGAFQWSA-N 1 1 335.408 2.140 20 5 EEBDMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000269332201 281194153 /nfs/dbraw/zinc/19/41/53/281194153.db2.gz APQUSHQFYSYDIN-NWDGAFQWSA-N 1 1 335.408 2.140 20 5 EEBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)CCCC[NH+]1CCOCC1 ZINC000282556564 292833647 /nfs/dbraw/zinc/83/36/47/292833647.db2.gz SZSZLDFMUDVCFQ-UHFFFAOYSA-N 1 1 349.431 2.098 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000294084445 293366246 /nfs/dbraw/zinc/36/62/46/293366246.db2.gz JUQTZRWYNFCCQX-SFHVURJKSA-N 1 1 331.416 2.472 20 5 EEBDMO COc1ccc(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1[N+](=O)[O-] ZINC000294122056 293375160 /nfs/dbraw/zinc/37/51/60/293375160.db2.gz LUGPAHPMYOGRNR-QGZVFWFLSA-N 1 1 333.388 2.161 20 5 EEBDMO CC(C)(CCC(=O)N1CC[NH+](CCc2cccs2)CC1)[N+](=O)[O-] ZINC000294543728 293481742 /nfs/dbraw/zinc/48/17/42/293481742.db2.gz MYHHEOAZCWRKOE-UHFFFAOYSA-N 1 1 339.461 2.270 20 5 EEBDMO CCOc1cc(C[N@@H+]2CC[C@H](OC(=O)N(C)C)C2)ccc1[N+](=O)[O-] ZINC000296534145 294001744 /nfs/dbraw/zinc/00/17/44/294001744.db2.gz BBMXEPBKRPKXID-ZDUSSCGKSA-N 1 1 337.376 2.266 20 5 EEBDMO CCOc1cc(C[N@H+]2CC[C@H](OC(=O)N(C)C)C2)ccc1[N+](=O)[O-] ZINC000296534145 294001745 /nfs/dbraw/zinc/00/17/45/294001745.db2.gz BBMXEPBKRPKXID-ZDUSSCGKSA-N 1 1 337.376 2.266 20 5 EEBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000332579765 312028605 /nfs/dbraw/zinc/02/86/05/312028605.db2.gz FFTJEVLEYFAADI-LLVKDONJSA-N 1 1 339.342 2.112 20 5 EEBDMO COC(=O)[C@H]1CN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC[N@@H+](C)C1 ZINC000414485344 313033531 /nfs/dbraw/zinc/03/35/31/313033531.db2.gz HXYGEDGFDMQFLE-SCZPIIQISA-N 1 1 347.415 2.035 20 5 EEBDMO COC(=O)[C@@H]1CN(C)CC[N@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000414485344 313033532 /nfs/dbraw/zinc/03/35/32/313033532.db2.gz HXYGEDGFDMQFLE-SCZPIIQISA-N 1 1 347.415 2.035 20 5 EEBDMO 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O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+](Cc1ccccn1)C1CC1 ZINC000182178924 464591225 /nfs/dbraw/zinc/59/12/25/464591225.db2.gz VVVDFSOAARMCFJ-INIZCTEOSA-N 1 1 343.383 2.394 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]CCCn1cccn1)c1ccc([N+](=O)[O-])cc1 ZINC000272483223 464627937 /nfs/dbraw/zinc/62/79/37/464627937.db2.gz CMQMARMPCXFPMK-INIZCTEOSA-N 1 1 340.387 2.294 20 5 EEBDMO C[N@H+]1CC[C@H]2CCN(C(=O)Cn3ccc4cc([N+](=O)[O-])ccc43)[C@H]2C1 ZINC000272504209 464636230 /nfs/dbraw/zinc/63/62/30/464636230.db2.gz ODXFQBZELXOFTM-GUYCJALGSA-N 1 1 342.399 2.102 20 5 EEBDMO Cc1nc(N2CC[C@@H](C[N@H+](C)Cc3cccnc3)C2)ncc1[N+](=O)[O-] ZINC000294964697 464664514 /nfs/dbraw/zinc/66/45/14/464664514.db2.gz LHPYIASRXRPABZ-HNNXBMFYSA-N 1 1 342.403 2.047 20 5 EEBDMO CC(C)CO[C@@H]1CC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000247770871 464706201 /nfs/dbraw/zinc/70/62/01/464706201.db2.gz WCBVKTWRTJTGQS-SJORKVTESA-N 1 1 347.415 2.447 20 5 EEBDMO CC(C)CO[C@@H]1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000247770871 464706208 /nfs/dbraw/zinc/70/62/08/464706208.db2.gz WCBVKTWRTJTGQS-SJORKVTESA-N 1 1 347.415 2.447 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccnn3CC3CC3)C2)nc1 ZINC000597014426 468418052 /nfs/dbraw/zinc/41/80/52/468418052.db2.gz PDOKDMGZMGUTKS-CQSZACIVSA-N 1 1 342.403 2.283 20 5 EEBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccnn3CC3CC3)C2)nc1 ZINC000597014426 468418060 /nfs/dbraw/zinc/41/80/60/468418060.db2.gz PDOKDMGZMGUTKS-CQSZACIVSA-N 1 1 342.403 2.283 20 5 EEBDMO C[C@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000248440126 464752594 /nfs/dbraw/zinc/75/25/94/464752594.db2.gz ULEGJTPTJAQKFO-RYUDHWBXSA-N 1 1 327.812 2.135 20 5 EEBDMO C[C@H]1CN(c2ccccc2F)CC[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000191633131 464823572 /nfs/dbraw/zinc/82/35/72/464823572.db2.gz XOTVOMPIYAWNTF-ZDUSSCGKSA-N 1 1 333.367 2.141 20 5 EEBDMO C[C@H]1CN(c2ccccc2F)CC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000191633131 464823575 /nfs/dbraw/zinc/82/35/75/464823575.db2.gz 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ZINC000330584255 465717697 /nfs/dbraw/zinc/71/76/97/465717697.db2.gz KWWQPNKTXWXCAZ-VXGBXAGGSA-N 1 1 331.376 2.169 20 5 EEBDMO CCn1c(C)nc([N+](=O)[O-])c1NCCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000361073760 465747142 /nfs/dbraw/zinc/74/71/42/465747142.db2.gz MNUKKCNNWCVAGJ-BETUJISGSA-N 1 1 339.440 2.421 20 5 EEBDMO CC[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2F)CC[N@H+]1C[C@@H](C)O ZINC000330706740 465771127 /nfs/dbraw/zinc/77/11/27/465771127.db2.gz LZHSFYIPEAVQST-TZMCWYRMSA-N 1 1 325.384 2.011 20 5 EEBDMO CC1(C)C(=O)N[C@H]1C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000593992800 468454174 /nfs/dbraw/zinc/45/41/74/468454174.db2.gz FYVHQFKLZXYKHQ-HNNXBMFYSA-N 1 1 335.379 2.471 20 5 EEBDMO Cn1ccnc1[C@@H]([NH2+]CC(C)(C)CCO)c1cccc([N+](=O)[O-])c1 ZINC000353513927 465945560 /nfs/dbraw/zinc/94/55/60/465945560.db2.gz GBOVMGRKSGTGEL-HNNXBMFYSA-N 1 1 332.404 2.416 20 5 EEBDMO CCc1nnc(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)s1 ZINC000353539501 465963895 /nfs/dbraw/zinc/96/38/95/465963895.db2.gz 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CCc1nn(C)c(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000301943824 466065247 /nfs/dbraw/zinc/06/52/47/466065247.db2.gz YUBPTDNWNGJWEH-WFASDCNBSA-N 1 1 333.436 2.344 20 5 EEBDMO CN(Cc1c([N+](=O)[O-])ncn1C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000362854087 466074689 /nfs/dbraw/zinc/07/46/89/466074689.db2.gz WEDCFWFQYJIUDW-INIZCTEOSA-N 1 1 343.431 2.282 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](C)C[N@@H+](C)C(C)C ZINC000357638828 466198657 /nfs/dbraw/zinc/19/86/57/466198657.db2.gz MXWHDXHHNKIEAR-LBPRGKRZSA-N 1 1 338.408 2.131 20 5 EEBDMO Cc1c(CNC(=O)N2CC[C@@H]3CC[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-] ZINC000332056375 466365479 /nfs/dbraw/zinc/36/54/79/466365479.db2.gz OSKJFJSMLWMXSI-XJKSGUPXSA-N 1 1 332.404 2.139 20 5 EEBDMO CC(C)OCCC[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000354208734 466378150 /nfs/dbraw/zinc/37/81/50/466378150.db2.gz PPJFCQYFKDJXAN-INIZCTEOSA-N 1 1 335.404 2.447 20 5 EEBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000354223119 466394999 /nfs/dbraw/zinc/39/49/99/466394999.db2.gz NFTBRFOCUQEPTF-ZIAGYGMSSA-N 1 1 334.420 2.338 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H]([C@H](C)O)C1 ZINC000305674680 466422206 /nfs/dbraw/zinc/42/22/06/466422206.db2.gz ZDITZVNBGYSTKY-KBPBESRZSA-N 1 1 335.404 2.325 20 5 EEBDMO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CS(=O)(=O)c3ccccc32)cc1 ZINC000320782311 466614649 /nfs/dbraw/zinc/61/46/49/466614649.db2.gz JIPGUDNMAWJGMY-HNNXBMFYSA-N 1 1 332.381 2.256 20 5 EEBDMO CS(=O)(=O)c1cccc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-] ZINC000322579908 466633513 /nfs/dbraw/zinc/63/35/13/466633513.db2.gz RPPBVTNWXBQQRV-NWDGAFQWSA-N 1 1 339.417 2.037 20 5 EEBDMO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CCc2cn[nH]c2C1 ZINC000374469308 467054937 /nfs/dbraw/zinc/05/49/37/467054937.db2.gz PNMWQGIPHYGOSP-SMDDNHRTSA-N 1 1 343.387 2.182 20 5 EEBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3ncccc32)C[C@H]1C ZINC000413124910 467174279 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ZZDYDWQQTXZSLF-AWEZNQCLSA-N 1 1 341.433 2.006 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)C[C@H]1C ZINC000430785031 467466552 /nfs/dbraw/zinc/46/65/52/467466552.db2.gz SNFOSYDQZICHIU-ZIAGYGMSSA-N 1 1 335.404 2.223 20 5 EEBDMO COc1cc(C[N@H+](C)C2CCN(OC)CC2)c([N+](=O)[O-])cc1OC ZINC000453625462 467505858 /nfs/dbraw/zinc/50/58/58/467505858.db2.gz ROROJYLKRMHRPQ-UHFFFAOYSA-N 1 1 339.392 2.070 20 5 EEBDMO CCC1(C[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)COC1 ZINC000449604668 467669888 /nfs/dbraw/zinc/66/98/88/467669888.db2.gz XUJQCGZEENUVQX-HNNXBMFYSA-N 1 1 330.388 2.434 20 5 EEBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000458479780 467843070 /nfs/dbraw/zinc/84/30/70/467843070.db2.gz RFBGCXPGPBLUQW-OAHLLOKOSA-N 1 1 334.420 2.263 20 5 EEBDMO COc1ccc(CC(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594197801 468509531 /nfs/dbraw/zinc/50/95/31/468509531.db2.gz PWEYRUIJNZYPHL-GJZGRUSLSA-N 1 1 347.415 2.279 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000597859971 468696155 /nfs/dbraw/zinc/69/61/55/468696155.db2.gz JBOQYDCONQBASD-LLVKDONJSA-N 1 1 337.424 2.292 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000570997382 468725609 /nfs/dbraw/zinc/72/56/09/468725609.db2.gz MUEDHVJIOZDAPF-LBPRGKRZSA-N 1 1 325.796 2.343 20 5 EEBDMO O=C1[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C[C@@H]2CCCCN12 ZINC000601173055 468769764 /nfs/dbraw/zinc/76/97/64/468769764.db2.gz PVKPSQVRFUCKEP-MEDUHNTESA-N 1 1 326.356 2.130 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000583992242 468782854 /nfs/dbraw/zinc/78/28/54/468782854.db2.gz ZLOZOLWKTFYPRB-JKSUJKDBSA-N 1 1 343.383 2.219 20 5 EEBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 ZINC000598195644 468792288 /nfs/dbraw/zinc/79/22/88/468792288.db2.gz QGEJROBKMOHBKC-OAHLLOKOSA-N 1 1 342.399 2.312 20 5 EEBDMO CC[N@H+]1CCCN(S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000601439093 468873829 /nfs/dbraw/zinc/87/38/29/468873829.db2.gz BNYASJZXIIIJIZ-CYBMUJFWSA-N 1 1 341.433 2.008 20 5 EEBDMO COC(=O)c1ccnc(NC[C@@H]2CC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000598611379 468933133 /nfs/dbraw/zinc/93/31/33/468933133.db2.gz HODSJWGSDPATEC-LBPRGKRZSA-N 1 1 336.392 2.166 20 5 EEBDMO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCN(Cc3csc([N+](=O)[O-])c3)C2)C1 ZINC000593315583 468936684 /nfs/dbraw/zinc/93/66/84/468936684.db2.gz MPHJLUZONRZMKT-MJBXVCDLSA-N 1 1 325.434 2.375 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC(C)(C)CC[C@@H]1CO ZINC000598649353 468945100 /nfs/dbraw/zinc/94/51/00/468945100.db2.gz UORPFAARAOULFC-CQSZACIVSA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC(C)(C)CC[C@@H]1CO ZINC000598649353 468945102 /nfs/dbraw/zinc/94/51/02/468945102.db2.gz UORPFAARAOULFC-CQSZACIVSA-N 1 1 335.404 2.325 20 5 EEBDMO COc1ccc(OCC[N@H+]2CCC[C@@H](C)[C@@H]2CCO)c([N+](=O)[O-])c1 ZINC000595695851 468958294 /nfs/dbraw/zinc/95/82/94/468958294.db2.gz IHMHTMINKWPRLJ-HIFRSBDPSA-N 1 1 338.404 2.465 20 5 EEBDMO CC[C@H](C)[C@@H](C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)OC ZINC000602674922 469004697 /nfs/dbraw/zinc/00/46/97/469004697.db2.gz FYIOPDLILHTEFB-WMLDXEAASA-N 1 1 349.431 2.414 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000602834142 469107156 /nfs/dbraw/zinc/10/71/56/469107156.db2.gz QXWINWXJGRBZNI-MRXNPFEDSA-N 1 1 341.415 2.237 20 5 EEBDMO O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+]1C1CCCC1 ZINC000602037419 469156530 /nfs/dbraw/zinc/15/65/30/469156530.db2.gz ANTVMFJIEWNYAF-MRXNPFEDSA-N 1 1 332.404 2.140 20 5 EEBDMO CC(C)c1[nH+]ccn1CC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000602139791 469212313 /nfs/dbraw/zinc/21/23/13/469212313.db2.gz JZIGFMFDTQDFKL-UHFFFAOYSA-N 1 1 344.371 2.205 20 5 EEBDMO Cc1noc(C)c1[C@H](C)[NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000612461757 469473317 /nfs/dbraw/zinc/47/33/17/469473317.db2.gz VIEBVHGGPYNJDS-JTQLQIEISA-N 1 1 344.371 2.440 20 5 EEBDMO CC1(C)CC[NH+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000608889292 469884923 /nfs/dbraw/zinc/88/49/23/469884923.db2.gz YFCKLJHZOOZEQL-CQSZACIVSA-N 1 1 331.372 2.349 20 5 EEBDMO CNc1nc(C(=O)NCCCC[N@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000454772406 485482956 /nfs/dbraw/zinc/48/29/56/485482956.db2.gz XSCOJVVOVFQPDR-CYBMUJFWSA-N 1 1 349.435 2.416 20 5 EEBDMO Cc1c(CC(=O)NC[C@H](c2ccco2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000159464836 533833794 /nfs/dbraw/zinc/83/37/94/533833794.db2.gz JGJYYCCLGKKUPM-OAHLLOKOSA-N 1 1 331.372 2.458 20 5 EEBDMO CC(C)(O)C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CC1 ZINC000189886387 527340011 /nfs/dbraw/zinc/34/00/11/527340011.db2.gz VBNDZZUMEZBAFD-UHFFFAOYSA-N 1 1 341.795 2.422 20 5 EEBDMO CC[C@](C)(O)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000189736802 529373022 /nfs/dbraw/zinc/37/30/22/529373022.db2.gz APVXEUFRQAPFEG-KRWDZBQOSA-N 1 1 332.404 2.455 20 5 EEBDMO COC[C@@]1(C)CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000451203264 536824756 /nfs/dbraw/zinc/82/47/56/536824756.db2.gz PCSYHSXSDXGRAA-WBVHZDCISA-N 1 1 333.388 2.059 20 5 EEBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000771460553 577213704 /nfs/dbraw/zinc/21/37/04/577213704.db2.gz QEMXHCCJPCSLDR-GHMZBOCLSA-N 1 1 340.811 2.211 20 5 EEBDMO Cn1ncc2c1CCC[C@H]2[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776591685 577463594 /nfs/dbraw/zinc/46/35/94/577463594.db2.gz UGLJOGORCSHARQ-NVXWUHKLSA-N 1 1 330.388 2.371 20 5 EEBDMO CC1=CC[N@H+](CCNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000762701122 577705962 /nfs/dbraw/zinc/70/59/62/577705962.db2.gz PLFFFISFAJFQSY-UHFFFAOYSA-N 1 1 339.342 2.455 20 5 EEBDMO CC1=CC[N@@H+](CCNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000762701122 577705963 /nfs/dbraw/zinc/70/59/63/577705963.db2.gz PLFFFISFAJFQSY-UHFFFAOYSA-N 1 1 339.342 2.455 20 5 EEBDMO C[N@H+](C[C@H]1CCCCO1)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000752790438 577776165 /nfs/dbraw/zinc/77/61/65/577776165.db2.gz ULOYLCWIYCOKKG-CQSZACIVSA-N 1 1 348.403 2.295 20 5 EEBDMO C[N@@H+](C[C@H]1CCCCO1)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000752790438 577776166 /nfs/dbraw/zinc/77/61/66/577776166.db2.gz ULOYLCWIYCOKKG-CQSZACIVSA-N 1 1 348.403 2.295 20 5 EEBDMO Cc1cc(C[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000757957840 577867251 /nfs/dbraw/zinc/86/72/51/577867251.db2.gz PKEFHJBDDWWSME-UHFFFAOYSA-N 1 1 338.385 2.368 20 5 EEBDMO Cc1c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000748713189 577966009 /nfs/dbraw/zinc/96/60/09/577966009.db2.gz QXJRSSOJCGAIDQ-UONOGXRCSA-N 1 1 348.359 2.168 20 5 EEBDMO CCN(CC)C(=O)C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000748819388 577967479 /nfs/dbraw/zinc/96/74/79/577967479.db2.gz HBUVLVSFQGSXIJ-UHFFFAOYSA-N 1 1 331.319 2.154 20 5 EEBDMO Cc1cn2cc(Nc3ccc([N+](=O)[O-])cc3-c3nn[nH]n3)ccc2[nH+]1 ZINC000737446755 578258108 /nfs/dbraw/zinc/25/81/08/578258108.db2.gz URKZPGDWICBIDF-UHFFFAOYSA-N 1 1 336.315 2.475 20 5 EEBDMO COCC[NH+]1CCN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])CC1 ZINC000891625690 676734451 /nfs/dbraw/zinc/73/44/51/676734451.db2.gz QELMBVCXDADNPE-UHFFFAOYSA-N 1 1 334.351 2.051 20 5 EEBDMO C[N@@H+](CCNC(=O)c1ccc(N)c([N+](=O)[O-])c1)Cc1ccc(F)cc1 ZINC000177053144 679827700 /nfs/dbraw/zinc/82/77/00/679827700.db2.gz TXMZEMFHTCXLKO-UHFFFAOYSA-N 1 1 346.362 2.178 20 5 EEBDMO Cn1nccc1[C@@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCO1 ZINC000896841443 685354697 /nfs/dbraw/zinc/35/46/97/685354697.db2.gz YXTRSBOGGFERAZ-KRWDZBQOSA-N 1 1 339.355 2.454 20 5 EEBDMO Cc1[nH+]ccn1CCNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000895116580 683952270 /nfs/dbraw/zinc/95/22/70/683952270.db2.gz XOMNBLGMVQTIKG-UHFFFAOYSA-N 1 1 327.344 2.064 20 5 EEBDMO Cc1c[nH+]cn1CC(=O)N[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC001059769120 689389906 /nfs/dbraw/zinc/38/99/06/689389906.db2.gz GHTQHEUVGMOUPN-GASCZTMLSA-N 1 1 343.387 2.167 20 5 EEBDMO Cc1ccc(F)cc1C[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001034643198 1196464519 /nfs/dbraw/zinc/46/45/19/1196464519.db2.gz KBPDIWGKYOGHMT-QBPKDAKJSA-N 1 1 349.406 2.316 20 5 EEBDMO O=C1CC2(CN1)CCN(c1cc[nH+]c3ccc([N+](=O)[O-])cc31)CC2 ZINC000865575679 1198284011 /nfs/dbraw/zinc/28/40/11/1198284011.db2.gz ULAKUMWEEWHRMZ-UHFFFAOYSA-N 1 1 326.356 2.250 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CC[N@@H+]2CCOC[C@H]2C1 ZINC000865676154 1198328101 /nfs/dbraw/zinc/32/81/01/1198328101.db2.gz IYHNRVRMRHMKMI-SECBINFHSA-N 1 1 332.187 2.422 20 5 EEBDMO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CC[N@H+]2CCOC[C@H]2C1 ZINC000865676154 1198328108 /nfs/dbraw/zinc/32/81/08/1198328108.db2.gz IYHNRVRMRHMKMI-SECBINFHSA-N 1 1 332.187 2.422 20 5 EEBDMO CCn1nccc1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172725 1201141663 /nfs/dbraw/zinc/14/16/63/1201141663.db2.gz MHWMMWQGUJXUOI-HNNXBMFYSA-N 1 1 344.371 2.243 20 5 EEBDMO CCn1nccc1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172725 1201141669 /nfs/dbraw/zinc/14/16/69/1201141669.db2.gz MHWMMWQGUJXUOI-HNNXBMFYSA-N 1 1 344.371 2.243 20 5 EEBDMO COc1cc2c(cc1OC)[C@H](C)[N@H+](CCn1ccc([N+](=O)[O-])n1)CC2 ZINC000880090345 1201383174 /nfs/dbraw/zinc/38/31/74/1201383174.db2.gz IYVUGHQGAZOXQA-LBPRGKRZSA-N 1 1 346.387 2.428 20 5 EEBDMO COc1cc2c(cc1OC)[C@H](C)[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC2 ZINC000880090345 1201383177 /nfs/dbraw/zinc/38/31/77/1201383177.db2.gz IYVUGHQGAZOXQA-LBPRGKRZSA-N 1 1 346.387 2.428 20 5 EEBDMO C[C@]([NH3+])(C(=O)N1CCc2ccccc2CC1)c1cccc([N+](=O)[O-])c1 ZINC000867948601 1201712570 /nfs/dbraw/zinc/71/25/70/1201712570.db2.gz ZMRLCSFDNVBMLG-LJQANCHMSA-N 1 1 339.395 2.396 20 5 EEBDMO O=[N+]([O-])c1ncccc1C[NH2+][C@@H](CN1CCOCC1)c1ccccc1 ZINC000886104588 1202472795 /nfs/dbraw/zinc/47/27/95/1202472795.db2.gz GOYDDJAITZRKTH-KRWDZBQOSA-N 1 1 342.399 2.153 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001095423791 1205734373 /nfs/dbraw/zinc/73/43/73/1205734373.db2.gz NWSCINQHMLPTRD-UHFFFAOYSA-N 1 1 348.447 2.412 20 5 EEBDMO CCC[N@@H+](C)CC(=O)NC1CCN(c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC001095423892 1205734601 /nfs/dbraw/zinc/73/46/01/1205734601.db2.gz URIZURIMATYJDD-UHFFFAOYSA-N 1 1 348.447 2.330 20 5 EEBDMO C[C@H](c1ccccc1)[C@H]1CCC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000932279086 1207574628 /nfs/dbraw/zinc/57/46/28/1207574628.db2.gz UOLNXAWXFVUOJF-ZTFGCOKTSA-N 1 1 344.415 2.420 20 5 EEBDMO CCOC(=O)[C@@H]1[C@H](C)C[C@@H](C)[N@@H+](CCn2cc([N+](=O)[O-])cn2)[C@@H]1C ZINC000934164558 1207914717 /nfs/dbraw/zinc/91/47/17/1207914717.db2.gz YKAHBMXTYHUCIU-RGCMKSIDSA-N 1 1 338.408 2.089 20 5 EEBDMO C/C=C(/C)C(=O)NCCC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC001096251727 1236669937 /nfs/dbraw/zinc/66/99/37/1236669937.db2.gz LTHZECNVJIJFCW-CQPUUCJISA-N 1 1 346.431 2.189 20 5 EEBDMO O=C(CCCC[NH+]1CCOCC1)OCc1cc(F)ccc1[N+](=O)[O-] ZINC000803512175 1240583723 /nfs/dbraw/zinc/58/37/23/1240583723.db2.gz JTRGRTOTDUAWQP-UHFFFAOYSA-N 1 1 340.351 2.280 20 5 EEBDMO C[N@@H+](CC(=O)N1CCCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CCC1 ZINC001057251719 1242761849 /nfs/dbraw/zinc/76/18/49/1242761849.db2.gz UCOXBGLNYRXYSG-UHFFFAOYSA-N 1 1 346.431 2.118 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](CCCCc2ccccc2)CC1 ZINC001195761959 1283707281 /nfs/dbraw/zinc/70/72/81/1283707281.db2.gz TVVWAZKWDIDGAL-QZTJIDSGSA-N 1 1 345.443 2.209 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CCCCc2ccccc2)CC1 ZINC001195761959 1283707287 /nfs/dbraw/zinc/70/72/87/1283707287.db2.gz TVVWAZKWDIDGAL-QZTJIDSGSA-N 1 1 345.443 2.209 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CCCCc2ccccc2)CC1 ZINC001195761959 1283707299 /nfs/dbraw/zinc/70/72/99/1283707299.db2.gz TVVWAZKWDIDGAL-QZTJIDSGSA-N 1 1 345.443 2.209 20 5 EEBDMO CCOc1cc(C[NH+]2CCC(N3CCOC3=O)CC2)ccc1[N+](=O)[O-] ZINC000852721012 1292174515 /nfs/dbraw/zinc/17/45/15/1292174515.db2.gz ASXKQDHIUAMNMO-UHFFFAOYSA-N 1 1 349.387 2.410 20 5 EEBDMO CON(C)C(=O)[C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000858320266 1294081366 /nfs/dbraw/zinc/08/13/66/1294081366.db2.gz RKOYSAMERWSHJK-NSHDSACASA-N 1 1 333.344 2.353 20 5 EEBDMO COC(=O)C1=C[C@H](OCCC[N+](C)(C)C)CN(Cc2ccccc2)C1 ZINC001224621197 1300673656 /nfs/dbraw/zinc/67/36/56/1300673656.db2.gz MTQPUPOSEZJTCE-IBGZPJMESA-N 1 1 347.479 2.083 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(O[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1O ZINC001228810997 1302462163 /nfs/dbraw/zinc/46/21/63/1302462163.db2.gz MHWVBSBGVOGXPD-JGPRNRPPSA-N 1 1 336.344 2.091 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(O[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1O ZINC001228810997 1302462172 /nfs/dbraw/zinc/46/21/72/1302462172.db2.gz MHWVBSBGVOGXPD-JGPRNRPPSA-N 1 1 336.344 2.091 20 5 EEBDMO C[NH+](C)CCCC(=O)NC1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001228879582 1302501531 /nfs/dbraw/zinc/50/15/31/1302501531.db2.gz PUBUDGJCAMYYCG-UHFFFAOYSA-N 1 1 348.447 2.017 20 5 EEBDMO C[N@H+]1[C@@H]2C[C@@H](Oc3nccc4ccc([N+](=O)[O-])cc43)[C@H]1CC(=O)C2 ZINC001229005932 1302566067 /nfs/dbraw/zinc/56/60/67/1302566067.db2.gz PEFPCJSNTHRCNS-APHBMKBZSA-N 1 1 327.340 2.326 20 5 EEBDMO CC(C)[N@H+]1CCC[C@@H](Oc2n[nH]c(=O)c3ccc([N+](=O)[O-])cc32)C1 ZINC001229363739 1302746896 /nfs/dbraw/zinc/74/68/96/1302746896.db2.gz FRSSFGDFJAYFLZ-GFCCVEGCSA-N 1 1 332.360 2.495 20 5 EEBDMO CC(=O)Cc1c(F)c(O[C@H]2CCc3[nH+]ccn3C2)ccc1[N+](=O)[O-] ZINC001230796021 1303462165 /nfs/dbraw/zinc/46/21/65/1303462165.db2.gz GLDFYTXNWJCHJP-NSHDSACASA-N 1 1 333.319 2.456 20 5 EEBDMO Cc1ccc(C(=O)NCCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])n1C ZINC001233925495 1304641861 /nfs/dbraw/zinc/64/18/61/1304641861.db2.gz VEIBYDRKJSOQIC-UHFFFAOYSA-N 1 1 344.415 2.494 20 5 EEBDMO C[N@H+]1CCC[C@H](Oc2cc(N3CCOCC3)ccc2[N+](=O)[O-])CC1 ZINC001234361091 1304899163 /nfs/dbraw/zinc/89/91/63/1304899163.db2.gz XMNLABYSWOIAQP-HNNXBMFYSA-N 1 1 335.404 2.295 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@H](c3ccccn3)C2)c1 ZINC000799195848 1305182876 /nfs/dbraw/zinc/18/28/76/1305182876.db2.gz LZMOHKOOVJAHMK-HOCLYGCPSA-N 1 1 343.383 2.219 20 5 EEBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2C[C@H](O)C[C@H]2c2ccccc2)c1 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ZINC000377283984 154123519 /nfs/dbraw/zinc/12/35/19/154123519.db2.gz WZJPKTJQHTYEMT-CQSZACIVSA-N 1 1 349.431 2.289 20 5 EEBDMO CCOC[C@H]1CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000072977127 159047923 /nfs/dbraw/zinc/04/79/23/159047923.db2.gz HVUPDTIEHXZOCR-AWEZNQCLSA-N 1 1 335.404 2.306 20 5 EEBDMO CCOC[C@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000072977127 159047926 /nfs/dbraw/zinc/04/79/26/159047926.db2.gz HVUPDTIEHXZOCR-AWEZNQCLSA-N 1 1 335.404 2.306 20 5 EEBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000176042189 159851382 /nfs/dbraw/zinc/85/13/82/159851382.db2.gz CHDSAKJKTIYHGW-UHFFFAOYSA-N 1 1 338.327 2.318 20 5 EEBDMO O=C(CC[N@H+]1CC[C@@H]2OCCC[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000246511329 160282963 /nfs/dbraw/zinc/28/29/63/160282963.db2.gz FIXDXNRVZSXDEN-BBRMVZONSA-N 1 1 333.388 2.424 20 5 EEBDMO COc1ccc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)cc1[N+](=O)[O-] ZINC000246743616 160292544 /nfs/dbraw/zinc/29/25/44/160292544.db2.gz 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PYPHKFJGBFUTHW-UHFFFAOYSA-N 1 1 340.343 2.233 20 5 EEBDMO COc1cc(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc([N+](=O)[O-])c1C ZINC000364478916 165151469 /nfs/dbraw/zinc/15/14/69/165151469.db2.gz OWCHPOWXWMPPFN-UONOGXRCSA-N 1 1 333.388 2.268 20 5 EEBDMO O=C1CCCCN1[C@H]1CCC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000369272336 166225985 /nfs/dbraw/zinc/22/59/85/166225985.db2.gz BBPNGWJYBDMZTD-INIZCTEOSA-N 1 1 347.415 2.451 20 5 EEBDMO C[C@H]1C[C@@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C[N@H+]1C1CC1 ZINC000124208378 222392141 /nfs/dbraw/zinc/39/21/41/222392141.db2.gz BYWDXGUHCUHTCC-WCQYABFASA-N 1 1 342.399 2.360 20 5 EEBDMO C[C@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)C1=CC[N@@H+](C)CC1 ZINC000272652493 269004253 /nfs/dbraw/zinc/00/42/53/269004253.db2.gz FKIRCRRADIYTTJ-ZDUSSCGKSA-N 1 1 342.399 2.316 20 5 EEBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CCc1cnccn1 ZINC000275598656 269128478 /nfs/dbraw/zinc/12/84/78/269128478.db2.gz KIKFBCVAEWLRID-UHFFFAOYSA-N 1 1 347.350 2.027 20 5 EEBDMO 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O=C(CC[N@H+]1CCCC[C@H]1C1OCCO1)Nc1ccccc1[N+](=O)[O-] ZINC000800337537 1234053626 /nfs/dbraw/zinc/05/36/26/1234053626.db2.gz JITKEAOBVZCWTG-HNNXBMFYSA-N 1 1 349.387 2.151 20 5 EEBDMO CC[N@@H+](C)CCC(=O)N(C)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001096116825 1235023480 /nfs/dbraw/zinc/02/34/80/1235023480.db2.gz LVFSDINGILRKHY-UHFFFAOYSA-N 1 1 348.447 2.364 20 5 EEBDMO O=C(C1CCC1)N1C[C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001048636062 1238155766 /nfs/dbraw/zinc/15/57/66/1238155766.db2.gz OPFXRHIZWKUMME-IYBDPMFKSA-N 1 1 329.400 2.285 20 5 EEBDMO C[N@@H+](CC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)CC(C)(C)C ZINC001097255278 1243880538 /nfs/dbraw/zinc/88/05/38/1243880538.db2.gz ISYURUYGYPQWIZ-BETUJISGSA-N 1 1 349.435 2.027 20 5 EEBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)nc1-c1ccccn1 ZINC000853502862 1292404871 /nfs/dbraw/zinc/40/48/71/1292404871.db2.gz AGUUQGJCFVPAKI-KBPBESRZSA-N 1 1 343.387 2.169 20 5 EEBDMO O=[N+]([O-])c1ccc2nc(NC[C@H]3CCC[N@@H+]3CCCO)sc2c1 ZINC000828421769 1314457990 /nfs/dbraw/zinc/45/79/90/1314457990.db2.gz NFFUPGPQEXHBKR-GFCCVEGCSA-N 1 1 336.417 2.463 20 5 EEBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CC[C@H](C2CCOCC2)C1 ZINC000794636729 1296501406 /nfs/dbraw/zinc/50/14/06/1296501406.db2.gz LYIXFMYTBPJZMA-ZDUSSCGKSA-N 1 1 347.371 2.209 20 5 EEBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000794636729 1296501428 /nfs/dbraw/zinc/50/14/28/1296501428.db2.gz LYIXFMYTBPJZMA-ZDUSSCGKSA-N 1 1 347.371 2.209 20 5 EEBDMO O=[N+]([O-])c1cccc(F)c1CN1CC[NH+](CCc2ccncc2)CC1 ZINC000931345730 1297150568 /nfs/dbraw/zinc/15/05/68/1297150568.db2.gz WFXDLIFVPBWVQQ-UHFFFAOYSA-N 1 1 344.390 2.489 20 5 EEBDMO Cc1[nH+]ccn1CCCC(=O)N(C)CCNc1ccccc1[N+](=O)[O-] ZINC001101684694 1299733595 /nfs/dbraw/zinc/73/35/95/1299733595.db2.gz BVFBWGMOIVWEDV-UHFFFAOYSA-N 1 1 345.403 2.450 20 5 EEBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1OC1CC[NH+](C2CC2)CC1 ZINC001226062539 1301249597 /nfs/dbraw/zinc/24/95/97/1301249597.db2.gz ZNUGBHHMJHGKDM-UHFFFAOYSA-N 1 1 340.401 2.004 20 5 EEBDMO COC(=O)Cc1ccc(O[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])c1 ZINC001226214188 1301304444 /nfs/dbraw/zinc/30/44/44/1301304444.db2.gz KODFZGUTIFUSEM-WDNDVIMCSA-N 1 1 334.372 2.314 20 5 EEBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@H]2Oc1n[nH]c(=O)c2ccc([N+](=O)[O-])cc21 ZINC001229358003 1302744403 /nfs/dbraw/zinc/74/44/03/1302744403.db2.gz JSHCXCCBIHJCKK-HBYGRHMLSA-N 1 1 344.371 2.353 20 5 EEBDMO CCCSc1nc(O[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229792964 1302946342 /nfs/dbraw/zinc/94/63/42/1302946342.db2.gz VMHOZSKLUQLBBQ-VIFPVBQESA-N 1 1 328.394 2.066 20 5 EEBDMO CC[N@H+]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1C ZINC000782523427 1304078750 /nfs/dbraw/zinc/07/87/50/1304078750.db2.gz VUAFRJOVJNRQPN-LBPRGKRZSA-N 1 1 338.383 2.089 20 5 EEBDMO CCN1CC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1C ZINC000782523427 1304078755 /nfs/dbraw/zinc/07/87/55/1304078755.db2.gz VUAFRJOVJNRQPN-LBPRGKRZSA-N 1 1 338.383 2.089 20 5 EEBDMO CCN1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1C ZINC000782523427 1304078761 /nfs/dbraw/zinc/07/87/61/1304078761.db2.gz VUAFRJOVJNRQPN-LBPRGKRZSA-N 1 1 338.383 2.089 20 5 EEBDMO C[NH+](C)Cc1cc(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)no1 ZINC001120246798 1309403715 /nfs/dbraw/zinc/40/37/15/1309403715.db2.gz ULNDJPGXNSFDEW-UHFFFAOYSA-N 1 1 330.344 2.237 20 5 EEBDMO [NH3+][C@@H](Cc1ccccc1[N+](=O)[O-])c1nc(-c2cc(F)ccn2)no1 ZINC001247673992 1310672983 /nfs/dbraw/zinc/67/29/83/1310672983.db2.gz TZEYOTIQLYPKSO-NSHDSACASA-N 1 1 329.291 2.421 20 5 EEBDMO CN1CC[C@H]2C[N@H+](C3CCN(c4ccc([N+](=O)[O-])cc4)CC3)C[C@H]21 ZINC001254479695 1318085012 /nfs/dbraw/zinc/08/50/12/1318085012.db2.gz HWMIQXXLZIBXDN-KBXCAEBGSA-N 1 1 330.432 2.200 20 5 EEBDMO Cc1cc(N2CC[NH+]([C@H](C)Cc3ccccc3[N+](=O)[O-])CC2)ncn1 ZINC001254569760 1318123723 /nfs/dbraw/zinc/12/37/23/1318123723.db2.gz KOFRZDODORVGSG-OAHLLOKOSA-N 1 1 341.415 2.446 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCN(Cc3cccnc3)CC1)C2 ZINC001254600637 1318141222 /nfs/dbraw/zinc/14/12/22/1318141222.db2.gz UCMNAGGMJQZBLP-IBGZPJMESA-N 1 1 338.411 2.275 20 5 EEBDMO CCCC[NH2+]CCN(CCc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001162810245 1320965000 /nfs/dbraw/zinc/96/50/00/1320965000.db2.gz HMCGNFIRKKHEKW-IAGOWNOFSA-N 1 1 333.432 2.113 20 5 EEBDMO COC(=O)Cc1ccc(NCC[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC001165289976 1321493594 /nfs/dbraw/zinc/49/35/94/1321493594.db2.gz NKBQLBOJMDEJQA-CYBMUJFWSA-N 1 1 335.404 2.454 20 5 EEBDMO NC(=O)C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001324140038 1333616850 /nfs/dbraw/zinc/61/68/50/1333616850.db2.gz DTQMGMIAHNSVLP-SECBINFHSA-N 1 1 342.193 2.055 20 5 EEBDMO NC(=O)C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001324140038 1333616854 /nfs/dbraw/zinc/61/68/54/1333616854.db2.gz DTQMGMIAHNSVLP-SECBINFHSA-N 1 1 342.193 2.055 20 5 EEBDMO COc1cc(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])cc1F ZINC001324356055 1333664722 /nfs/dbraw/zinc/66/47/22/1333664722.db2.gz FJWLJRYFYHYNOA-LLVKDONJSA-N 1 1 337.351 2.053 20 5 EEBDMO CC(C)C[N@H+]1CCC[C@@H]1C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC001338984155 1336940878 /nfs/dbraw/zinc/94/08/78/1336940878.db2.gz SUNUKEWDDQFQPV-OAHLLOKOSA-N 1 1 349.435 2.075 20 5 EEBDMO O=C(CCC(=O)N1CCC[N@H+]2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC001344070609 1337364133 /nfs/dbraw/zinc/36/41/33/1337364133.db2.gz VABKVTCPKHADFU-INIZCTEOSA-N 1 1 345.399 2.254 20 5 EEBDMO CC[C@H]1CCCC[N@H+]1CCNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001604102884 1350858103 /nfs/dbraw/zinc/85/81/03/1350858103.db2.gz JDADTKAMUREJJD-LBPRGKRZSA-N 1 1 345.407 2.451 20 5 EEBDMO C[C@H]1Cn2nc(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)cc2C[NH2+]1 ZINC001576871162 1403613433 /nfs/dbraw/zinc/61/34/33/1403613433.db2.gz MCPCNLKVQXKOLU-QMMMGPOBSA-N 1 1 335.751 2.189 20 5 EEBDMO C[NH+](C)CC1(CNC(=O)[C@@](C)(N)c2cccc([N+](=O)[O-])c2)CCCC1 ZINC001578412458 1403748452 /nfs/dbraw/zinc/74/84/52/1403748452.db2.gz MXZQUGMAPUONPK-KRWDZBQOSA-N 1 1 348.447 2.007 20 5 EEBDMO O=C(CC[N@@H+]1CCCCC[C@H]1CO)Nc1cc([N+](=O)[O-])ccc1F ZINC000847014497 790830839 /nfs/dbraw/zinc/83/08/39/790830839.db2.gz KNQPOEOYORWQQF-ZDUSSCGKSA-N 1 1 339.367 2.299 20 5 EEBDMO O=C(CC[N@@H+]1CCCCC[C@@H]1CO)Nc1cc([N+](=O)[O-])ccc1F ZINC000847014496 790831657 /nfs/dbraw/zinc/83/16/57/790831657.db2.gz KNQPOEOYORWQQF-CYBMUJFWSA-N 1 1 339.367 2.299 20 5 EEBDMO C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1Cl)[C@@H]1C[N@H+](C)CCO1 ZINC000809914047 783465116 /nfs/dbraw/zinc/46/51/16/783465116.db2.gz FVTMGWJIIICAMR-CABZTGNLSA-N 1 1 342.783 2.089 20 5 EEBDMO C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1Cl)[C@@H]1C[N@@H+](C)CCO1 ZINC000809914047 783465122 /nfs/dbraw/zinc/46/51/22/783465122.db2.gz FVTMGWJIIICAMR-CABZTGNLSA-N 1 1 342.783 2.089 20 5 EEBDMO C[N@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC12CCCCC2 ZINC000908572472 785538085 /nfs/dbraw/zinc/53/80/85/785538085.db2.gz XNJAGCQDWLSIRC-INIZCTEOSA-N 1 1 347.415 2.105 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NC/C=C/CNc1ncc([N+](=O)[O-])cc1C ZINC001107391346 787104734 /nfs/dbraw/zinc/10/47/34/787104734.db2.gz GILGNKGBAPCYSW-BQYQJAHWSA-N 1 1 349.435 2.113 20 5 EEBDMO CC[N@@H+](C)C(C)(C)C(=O)NC/C=C/CNc1ccc([N+](=O)[O-])c(C)n1 ZINC001107391983 787105894 /nfs/dbraw/zinc/10/58/94/787105894.db2.gz QVLNWFIHFANPNW-BQYQJAHWSA-N 1 1 349.435 2.113 20 5 EEBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000825411285 788619247 /nfs/dbraw/zinc/61/92/47/788619247.db2.gz NPRUVUZJZZGUDV-QGZVFWFLSA-N 1 1 349.431 2.207 20 5 EEBDMO O=C1C[C@H]([N@H+]2CCC3(CCCC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000172951114 791798396 /nfs/dbraw/zinc/79/83/96/791798396.db2.gz OVTKGOTTWGOOMK-HNNXBMFYSA-N 1 1 343.383 2.493 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@H](N3CCOCC3)C1)CC2 ZINC001172914159 797148031 /nfs/dbraw/zinc/14/80/31/797148031.db2.gz DJJCJEOBBKQCSD-HKUYNNGSSA-N 1 1 345.443 2.249 20 5 EEBDMO O=C1C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C[C@@H]2CCCN12 ZINC001172921319 797151076 /nfs/dbraw/zinc/15/10/76/797151076.db2.gz OJAIFYLWKRKCTL-WBVHZDCISA-N 1 1 329.400 2.149 20 5 EEBDMO COCC[N@@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014375 797197121 /nfs/dbraw/zinc/19/71/21/797197121.db2.gz QAEZXRHWUQVFAQ-UHFFFAOYSA-N 1 1 329.347 2.420 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCc3cnn(C)c3C2)c1F ZINC001173192185 797281849 /nfs/dbraw/zinc/28/18/49/797281849.db2.gz JLYIIHQFGQLHHB-NSHDSACASA-N 1 1 348.378 2.465 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCc3cnn(C)c3C2)c1F ZINC001173192185 797281853 /nfs/dbraw/zinc/28/18/53/797281853.db2.gz JLYIIHQFGQLHHB-NSHDSACASA-N 1 1 348.378 2.465 20 5 EEBDMO CCN(CCNc1ccc(F)cc1[N+](=O)[O-])C(=O)CC[N@@H+](C)CC ZINC001106841969 797298963 /nfs/dbraw/zinc/29/89/63/797298963.db2.gz VASFQGRRCFNTNV-UHFFFAOYSA-N 1 1 340.399 2.336 20 5 EEBDMO CC[N@H+]1CCO[C@@H]2CN([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC001173227542 797311881 /nfs/dbraw/zinc/31/18/81/797311881.db2.gz PMSKZIBVYSPJMU-UWWQBHOKSA-N 1 1 333.432 2.178 20 5 EEBDMO CCN1CCO[C@@H]2C[N@@H+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC001173227542 797311889 /nfs/dbraw/zinc/31/18/89/797311889.db2.gz PMSKZIBVYSPJMU-UWWQBHOKSA-N 1 1 333.432 2.178 20 5 EEBDMO CCN1CCO[C@@H]2C[N@H+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC001173227542 797311897 /nfs/dbraw/zinc/31/18/97/797311897.db2.gz PMSKZIBVYSPJMU-UWWQBHOKSA-N 1 1 333.432 2.178 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2C[C@H](Oc3ccccn3)[C@H]3OCCC[C@H]32)C1 ZINC001169020072 803588052 /nfs/dbraw/zinc/58/80/52/803588052.db2.gz IBJZXWWEFGYFAW-OCABDXPQSA-N 1 1 347.415 2.138 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H]3O[C@@H](COCC4CC4)CC[C@H]32)C1 ZINC001169020581 803588059 /nfs/dbraw/zinc/58/80/59/803588059.db2.gz JKCNCBRYRNQLFI-DUQPFJRNSA-N 1 1 338.448 2.480 20 5 EEBDMO C[N@@H+]([C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169049027 803594857 /nfs/dbraw/zinc/59/48/57/803594857.db2.gz VRJIZNIHWWPBOQ-XPABHHOTSA-N 1 1 339.436 2.229 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2C[C@H](CO)C[C@H](F)C2)c([N+](=O)[O-])c1 ZINC001170330139 809894887 /nfs/dbraw/zinc/89/48/87/809894887.db2.gz ZBMMCPFKNHQRER-SCRDCRAPSA-N 1 1 326.368 2.187 20 5 EEBDMO COc1ccc(C[C@H](C)[N@@H+]2C[C@H](CO)C[C@H](F)C2)c([N+](=O)[O-])c1 ZINC001170330139 809894891 /nfs/dbraw/zinc/89/48/91/809894891.db2.gz ZBMMCPFKNHQRER-SCRDCRAPSA-N 1 1 326.368 2.187 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@@H+](C)[C@H]2CCCN(C(C)=O)C2)c([N+](=O)[O-])c1 ZINC001170351554 809920115 /nfs/dbraw/zinc/92/01/15/809920115.db2.gz DCSQBJNDENITKJ-CJNGLKHVSA-N 1 1 349.431 2.477 20 5 EEBDMO CCOC1(C)CC[NH+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC1 ZINC000793546061 810400103 /nfs/dbraw/zinc/40/01/03/810400103.db2.gz JTTFYTUVZKGXLK-UHFFFAOYSA-N 1 1 333.392 2.496 20 5 EEBDMO Cc1[nH+]ccn1CCNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC001515956281 1118991506 /nfs/dbraw/zinc/99/15/06/1118991506.db2.gz LOVICUBZQYDUAZ-UHFFFAOYSA-N 1 1 343.387 2.448 20 5 EEBDMO C[C@@H](NC(=O)CCCC[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000171964405 296044522 /nfs/dbraw/zinc/04/45/22/296044522.db2.gz JZLYFGJRMLWWMX-CQSZACIVSA-N 1 1 335.404 2.275 20 5 EEBDMO C[C@@H]1CN(CC[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000451542806 243151479 /nfs/dbraw/zinc/15/14/79/243151479.db2.gz AFZWQBIWXHZHRK-WBVHZDCISA-N 1 1 333.432 2.495 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H]2C[C@@H](O)CC[C@H]2C1 ZINC000451695733 243209676 /nfs/dbraw/zinc/20/96/76/243209676.db2.gz NYZVCPLKOMFQDF-YCPHGPKFSA-N 1 1 347.415 2.325 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCc2ccccc2CC1 ZINC000451710850 243219074 /nfs/dbraw/zinc/21/90/74/243219074.db2.gz NFZPBTRMIWVYKA-UHFFFAOYSA-N 1 1 327.384 2.247 20 5 EEBDMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000451821333 243280831 /nfs/dbraw/zinc/28/08/31/243280831.db2.gz ADUZDOCOGLKXDK-ZDUSSCGKSA-N 1 1 335.404 2.403 20 5 EEBDMO CCOC[C@H]1CCCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000459713922 245220224 /nfs/dbraw/zinc/22/02/24/245220224.db2.gz OFFRFKCSEZTFBG-CABCVRRESA-N 1 1 338.404 2.226 20 5 EEBDMO C[C@H](c1cccc(Nc2c([N+](=O)[O-])ncn2C)c1)[NH+]1CCOCC1 ZINC000264097079 246061478 /nfs/dbraw/zinc/06/14/78/246061478.db2.gz KNLLJJROGWIFJK-GFCCVEGCSA-N 1 1 331.376 2.465 20 5 EEBDMO CC[NH+]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000265225863 247315962 /nfs/dbraw/zinc/31/59/62/247315962.db2.gz BHFUOSUYYQEWGW-UHFFFAOYSA-N 1 1 341.795 2.181 20 5 EEBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@@H]([NH+]2CC=CC2)C1 ZINC000266283380 248222458 /nfs/dbraw/zinc/22/24/58/248222458.db2.gz URFVWNVYAGXHDU-GFCCVEGCSA-N 1 1 349.362 2.361 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1cccnc1 ZINC000132675062 533138284 /nfs/dbraw/zinc/13/82/84/533138284.db2.gz CYNRIFDCLPDRNZ-UHFFFAOYSA-N 1 1 344.371 2.459 20 5 EEBDMO Cc1[nH+]ccn1CCNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000268077806 256110883 /nfs/dbraw/zinc/11/08/83/256110883.db2.gz HEDGPRJTRDRKGS-UHFFFAOYSA-N 1 1 337.767 2.253 20 5 EEBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)s1 ZINC000272819360 256241842 /nfs/dbraw/zinc/24/18/42/256241842.db2.gz IOXYRAFBDFFBCN-ZJUUUORDSA-N 1 1 345.446 2.099 20 5 EEBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)s1 ZINC000272819360 256241844 /nfs/dbraw/zinc/24/18/44/256241844.db2.gz IOXYRAFBDFFBCN-ZJUUUORDSA-N 1 1 345.446 2.099 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000111353281 142359726 /nfs/dbraw/zinc/35/97/26/142359726.db2.gz DWEFUDWCRNSJPT-ZDUSSCGKSA-N 1 1 341.433 2.056 20 5 EEBDMO Cn1cnc([N+](=O)[O-])c1CN1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC000355926535 153206317 /nfs/dbraw/zinc/20/63/17/153206317.db2.gz FQMBSDARRACMDR-UHFFFAOYSA-N 1 1 343.431 2.425 20 5 EEBDMO CCOC(=O)c1c[nH+]ccc1NCCNc1ccc([N+](=O)[O-])cc1 ZINC000359439389 153362714 /nfs/dbraw/zinc/36/27/14/153362714.db2.gz OHNARAZKDJXQJT-UHFFFAOYSA-N 1 1 330.344 2.112 20 5 EEBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000174038477 159794886 /nfs/dbraw/zinc/79/48/86/159794886.db2.gz YWGVWWXHFMIAJK-HNNXBMFYSA-N 1 1 348.447 2.364 20 5 EEBDMO CCOC(=O)c1ccnc(N2C[C@@H](C)[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-] ZINC000345191157 161280445 /nfs/dbraw/zinc/28/04/45/161280445.db2.gz PHJOIGHWNPCFGZ-VXGBXAGGSA-N 1 1 336.392 2.085 20 5 EEBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000345894639 161340275 /nfs/dbraw/zinc/34/02/75/161340275.db2.gz WMGFFALWPJWYLQ-CABCVRRESA-N 1 1 342.399 2.293 20 5 EEBDMO CC1(C)CN(C(=O)C2CC2)CC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000345968833 161346093 /nfs/dbraw/zinc/34/60/93/161346093.db2.gz IMEPZCACVXQEDE-UHFFFAOYSA-N 1 1 347.415 2.306 20 5 EEBDMO CC1(C)CN(C(=O)C2CC2)CC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000345968833 161346094 /nfs/dbraw/zinc/34/60/94/161346094.db2.gz IMEPZCACVXQEDE-UHFFFAOYSA-N 1 1 347.415 2.306 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000346238240 161361695 /nfs/dbraw/zinc/36/16/95/161361695.db2.gz OHVSMRRZPMZZBH-DVOMOZLQSA-N 1 1 347.415 2.406 20 5 EEBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000359928094 164198526 /nfs/dbraw/zinc/19/85/26/164198526.db2.gz YIHNSEWJWDMTIR-VXGBXAGGSA-N 1 1 335.404 2.467 20 5 EEBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000364640116 165218034 /nfs/dbraw/zinc/21/80/34/165218034.db2.gz AYUGQUBWKRITLC-UONOGXRCSA-N 1 1 332.356 2.417 20 5 EEBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000365315443 165439821 /nfs/dbraw/zinc/43/98/21/165439821.db2.gz JHBOZSNVNUWJRN-ZIAGYGMSSA-N 1 1 333.388 2.107 20 5 EEBDMO CCc1[nH]nc(C(=O)Nc2ccc(-n3cc[nH+]c3C)nc2)c1[N+](=O)[O-] ZINC000368911583 166150822 /nfs/dbraw/zinc/15/08/22/166150822.db2.gz CYWIGAYKYTZYTM-UHFFFAOYSA-N 1 1 341.331 2.022 20 5 EEBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000369793235 166332024 /nfs/dbraw/zinc/33/20/24/166332024.db2.gz KINHYWSYGCMKSG-GJZGRUSLSA-N 1 1 332.404 2.063 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)c(Cl)c1 ZINC000375777163 167191967 /nfs/dbraw/zinc/19/19/67/167191967.db2.gz QGHKIKOJTREKCC-GJZGRUSLSA-N 1 1 325.796 2.284 20 5 EEBDMO C[C@@H]1C[C@@H](N(C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[N@H+]1C ZINC000123814136 222335508 /nfs/dbraw/zinc/33/55/08/222335508.db2.gz TWKOSXUQVNSSIM-DOMZBBRYSA-N 1 1 335.404 2.376 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1 ZINC000272730331 269013493 /nfs/dbraw/zinc/01/34/93/269013493.db2.gz KPKBTDBEPVNJLO-LBPRGKRZSA-N 1 1 348.403 2.053 20 5 EEBDMO C[C@H]1C[N@H+](CCOc2ccccc2[N+](=O)[O-])CC2(CCOCC2)O1 ZINC000279038688 269258185 /nfs/dbraw/zinc/25/81/85/269258185.db2.gz FUIJPKXBAFJHCU-AWEZNQCLSA-N 1 1 336.388 2.244 20 5 EEBDMO C[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC2(CCOCC2)O1 ZINC000279038688 269258186 /nfs/dbraw/zinc/25/81/86/269258186.db2.gz FUIJPKXBAFJHCU-AWEZNQCLSA-N 1 1 336.388 2.244 20 5 EEBDMO CO[C@]1(C)CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000280656296 269383093 /nfs/dbraw/zinc/38/30/93/269383093.db2.gz ZOJZZTAVRVCAIR-DOTOQJQBSA-N 1 1 338.404 2.226 20 5 EEBDMO COCCC[N@@H+](C)CCNC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000188174228 274028397 /nfs/dbraw/zinc/02/83/97/274028397.db2.gz GKYORMRLGHZKDT-UHFFFAOYSA-N 1 1 341.433 2.015 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(N2CC[N@@H+](C3CCN(C)CC3)[C@@H](C)C2)c1 ZINC000338696233 274118437 /nfs/dbraw/zinc/11/84/37/274118437.db2.gz YEXLWEIRUWAARD-AWEZNQCLSA-N 1 1 348.447 2.208 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(N2CC[N@H+](C3CCN(C)CC3)[C@@H](C)C2)c1 ZINC000338696233 274118438 /nfs/dbraw/zinc/11/84/38/274118438.db2.gz YEXLWEIRUWAARD-AWEZNQCLSA-N 1 1 348.447 2.208 20 5 EEBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000245665613 274220592 /nfs/dbraw/zinc/22/05/92/274220592.db2.gz GOQYSHNTQBNZIW-XQQFMLRXSA-N 1 1 334.420 2.273 20 5 EEBDMO C[C@@H]1C[N@H+](CC(C)(C)O)CCN1c1c(F)cc([N+](=O)[O-])cc1F ZINC000275746994 274262574 /nfs/dbraw/zinc/26/25/74/274262574.db2.gz CRLVEGMDNFVTRT-SNVBAGLBSA-N 1 1 329.347 2.154 20 5 EEBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1c1c(F)cc([N+](=O)[O-])cc1F ZINC000275746994 274262578 /nfs/dbraw/zinc/26/25/78/274262578.db2.gz CRLVEGMDNFVTRT-SNVBAGLBSA-N 1 1 329.347 2.154 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N(C)CCCn1cc[nH+]c1C ZINC000277599509 274318756 /nfs/dbraw/zinc/31/87/56/274318756.db2.gz OLFFLZVYJDWBRE-UHFFFAOYSA-N 1 1 332.360 2.271 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@H]1C[N@H+]3CCC[C@@H]3CO1)CCC2 ZINC000365489596 275038440 /nfs/dbraw/zinc/03/84/40/275038440.db2.gz FWUVIUBWTDCMCY-SOLBZPMBSA-N 1 1 331.416 2.425 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CN3CCC[C@@H]3CO1)CCC2 ZINC000365489596 275038441 /nfs/dbraw/zinc/03/84/41/275038441.db2.gz FWUVIUBWTDCMCY-SOLBZPMBSA-N 1 1 331.416 2.425 20 5 EEBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CNCCCO1 ZINC000415033257 275040061 /nfs/dbraw/zinc/04/00/61/275040061.db2.gz GUWOALXRIWKCMH-BHYGNILZSA-N 1 1 333.432 2.274 20 5 EEBDMO CC[N@H+]1CCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](C)C1 ZINC000288578817 275072072 /nfs/dbraw/zinc/07/20/72/275072072.db2.gz VAIHCHQGUHPTJA-NSHDSACASA-N 1 1 344.371 2.015 20 5 EEBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000289468044 275118489 /nfs/dbraw/zinc/11/84/89/275118489.db2.gz HRDBWNNBBUCYKN-CYBMUJFWSA-N 1 1 343.449 2.135 20 5 EEBDMO Cc1cc(S(=O)(=O)N[C@H](C)C[N@H+](C)C(C)C)cc([N+](=O)[O-])c1F ZINC000289703436 275140712 /nfs/dbraw/zinc/14/07/12/275140712.db2.gz WIGCZYDIMBNWEQ-LLVKDONJSA-N 1 1 347.412 2.049 20 5 EEBDMO Cc1cnn([C@@H]2CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)c1 ZINC000290057819 275174892 /nfs/dbraw/zinc/17/48/92/275174892.db2.gz XMHSCFAPOMAWFM-CQSZACIVSA-N 1 1 343.387 2.375 20 5 EEBDMO CC[N@@H+](C[C@H](C)OC)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000291223889 275283894 /nfs/dbraw/zinc/28/38/94/275283894.db2.gz LSVATLORASYZIT-RYUDHWBXSA-N 1 1 339.392 2.287 20 5 EEBDMO C[C@H]1CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000292136278 275382373 /nfs/dbraw/zinc/38/23/73/275382373.db2.gz IUYODDNVDRCEPG-KBXCAEBGSA-N 1 1 333.432 2.434 20 5 EEBDMO C[N@H+]1CC[C@@]2(CCN(c3c(Br)cncc3[N+](=O)[O-])C2)C1 ZINC000292189477 275390730 /nfs/dbraw/zinc/39/07/30/275390730.db2.gz GANFGQVHWRDLAA-CYBMUJFWSA-N 1 1 341.209 2.284 20 5 EEBDMO C[C@@H]1CN(C/C=C\c2ccccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000438338793 288113845 /nfs/dbraw/zinc/11/38/45/288113845.db2.gz LFDDQBQXPIHKJZ-DDJMYBDESA-N 1 1 333.432 2.385 20 5 EEBDMO CCc1n[nH]c(C(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000171872925 281363047 /nfs/dbraw/zinc/36/30/47/281363047.db2.gz OLPKXJXIRUPMOV-LBPRGKRZSA-N 1 1 345.403 2.131 20 5 EEBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)COCC(F)(F)F ZINC000292899796 293072096 /nfs/dbraw/zinc/07/20/96/293072096.db2.gz JZGPRXOGQBIDQX-ZDUSSCGKSA-N 1 1 336.310 2.009 20 5 EEBDMO Cc1nn(CCC(=O)Nc2cc(C)c3[nH+]ccn3c2)c(C)c1[N+](=O)[O-] ZINC000294003581 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CC[N@@H+](C)CCNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000119983751 462948634 /nfs/dbraw/zinc/94/86/34/462948634.db2.gz KVUXAVPCWGHATF-UHFFFAOYSA-N 1 1 344.209 2.347 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ncc([N+](=O)[O-])c(N)n1 ZINC000077236652 462957495 /nfs/dbraw/zinc/95/74/95/462957495.db2.gz UHHBBAODMZDBRX-ZDUSSCGKSA-N 1 1 342.403 2.068 20 5 EEBDMO CC(C)[N@@H+](C)CCCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000067163118 462974430 /nfs/dbraw/zinc/97/44/30/462974430.db2.gz DSHOGYBQAQASFC-UHFFFAOYSA-N 1 1 345.403 2.241 20 5 EEBDMO C[NH+](C)[C@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000067285427 462988172 /nfs/dbraw/zinc/98/81/72/462988172.db2.gz VHDLUMZIKGOQPX-CQSZACIVSA-N 1 1 332.360 2.019 20 5 EEBDMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000018179117 463008307 /nfs/dbraw/zinc/00/83/07/463008307.db2.gz HVBUGJLTQXWJCF-HNNXBMFYSA-N 1 1 336.392 2.073 20 5 EEBDMO O=[N+]([O-])c1ccn(CC[N@H+](CCCO)Cc2cccc(Cl)c2)n1 ZINC000134286573 463021896 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2.331 20 5 EEBDMO CC[N@H+](CC(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)C1CC1 ZINC000136008070 463213086 /nfs/dbraw/zinc/21/30/86/463213086.db2.gz DEBLMDSWAQYPDG-UHFFFAOYSA-N 1 1 329.360 2.408 20 5 EEBDMO CC[N@@H+](CC(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)C1CC1 ZINC000136008070 463213092 /nfs/dbraw/zinc/21/30/92/463213092.db2.gz DEBLMDSWAQYPDG-UHFFFAOYSA-N 1 1 329.360 2.408 20 5 EEBDMO C[NH+](C)[C@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000055172965 463292108 /nfs/dbraw/zinc/29/21/08/463292108.db2.gz YDIKHXYXSYURGD-OAHLLOKOSA-N 1 1 346.387 2.409 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000140000025 463334770 /nfs/dbraw/zinc/33/47/70/463334770.db2.gz MTFYVIBNGJBYCB-JJRVBVJISA-N 1 1 346.431 2.338 20 5 EEBDMO COc1cc(C[N@@H+]2CCC[C@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000104960671 463430287 /nfs/dbraw/zinc/43/02/87/463430287.db2.gz UWPQJBNBRYCXLW-JTQLQIEISA-N 1 1 332.303 2.162 20 5 EEBDMO COc1cc(C[N@H+]2CCC[C@H]2CO)c([N+](=O)[O-])cc1OC(F)F 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2.156 20 5 EEBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)C1CC1 ZINC000279190119 464058002 /nfs/dbraw/zinc/05/80/02/464058002.db2.gz LIXAAQSHMHLCQI-UHFFFAOYSA-N 1 1 338.383 2.014 20 5 EEBDMO COc1ccc(C[N@@H+](C)CCN2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000279713276 464132369 /nfs/dbraw/zinc/13/23/69/464132369.db2.gz KSFWGQLLSZLIJI-UHFFFAOYSA-N 1 1 337.420 2.146 20 5 EEBDMO COc1ccc(CN(C)CC[N@@H+]2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000279713276 464132376 /nfs/dbraw/zinc/13/23/76/464132376.db2.gz KSFWGQLLSZLIJI-UHFFFAOYSA-N 1 1 337.420 2.146 20 5 EEBDMO COc1ccc(CN(C)CC[N@H+]2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000279713276 464132381 /nfs/dbraw/zinc/13/23/81/464132381.db2.gz KSFWGQLLSZLIJI-UHFFFAOYSA-N 1 1 337.420 2.146 20 5 EEBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000284291423 464139076 /nfs/dbraw/zinc/13/90/76/464139076.db2.gz GCZUMRSFMXBDGF-NSHDSACASA-N 1 1 338.383 2.024 20 5 EEBDMO CCCc1n[nH]c(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000172839723 464152208 /nfs/dbraw/zinc/15/22/08/464152208.db2.gz BLDYXTMOSILGFE-GFCCVEGCSA-N 1 1 337.424 2.217 20 5 EEBDMO CCCc1[nH]nc(C(=O)N(C)CC[C@H]2CCCC[N@@H+]2C)c1[N+](=O)[O-] ZINC000172839723 464152215 /nfs/dbraw/zinc/15/22/15/464152215.db2.gz BLDYXTMOSILGFE-GFCCVEGCSA-N 1 1 337.424 2.217 20 5 EEBDMO CCCc1[nH]nc(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000172839723 464152222 /nfs/dbraw/zinc/15/22/22/464152222.db2.gz BLDYXTMOSILGFE-GFCCVEGCSA-N 1 1 337.424 2.217 20 5 EEBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N)cn1 ZINC000225534876 464169923 /nfs/dbraw/zinc/16/99/23/464169923.db2.gz HPKIKUWNFJUDLX-UHFFFAOYSA-N 1 1 338.327 2.318 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@H]1CCn2cc[nH+]c2C1 ZINC000343028127 465464115 /nfs/dbraw/zinc/46/41/15/465464115.db2.gz JCAKLDDDRFLQGF-NSHDSACASA-N 1 1 330.344 2.313 20 5 EEBDMO CC(C)c1ccc(C(=O)NCCC[NH+]2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000188925312 464397221 /nfs/dbraw/zinc/39/72/21/464397221.db2.gz WAFBCVAXNBGGJH-UHFFFAOYSA-N 1 1 348.447 2.086 20 5 EEBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272133539 464490120 /nfs/dbraw/zinc/49/01/20/464490120.db2.gz XKTYFPPSRVWKAA-UONOGXRCSA-N 1 1 339.342 2.430 20 5 EEBDMO C[C@@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000294407949 464491927 /nfs/dbraw/zinc/49/19/27/464491927.db2.gz AMEYEAFUDZTUEV-LBPRGKRZSA-N 1 1 333.388 2.157 20 5 EEBDMO CC(C)NC(=O)c1ccc(N2CC[C@H]3CC[N@@H+](C)C[C@H]32)c([N+](=O)[O-])c1 ZINC000272233823 464528821 /nfs/dbraw/zinc/52/88/21/464528821.db2.gz VCCFDQFFSQRFFM-CXAGYDPISA-N 1 1 346.431 2.263 20 5 EEBDMO COCCCOCC[N@H+](C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000272401243 464593969 /nfs/dbraw/zinc/59/39/69/464593969.db2.gz WZDTVCAZBNCXNR-UHFFFAOYSA-N 1 1 342.392 2.097 20 5 EEBDMO COCCCOCC[N@@H+](C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000272401243 464593974 /nfs/dbraw/zinc/59/39/74/464593974.db2.gz WZDTVCAZBNCXNR-UHFFFAOYSA-N 1 1 342.392 2.097 20 5 EEBDMO C[C@H](CO)CCC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272497424 464632762 /nfs/dbraw/zinc/63/27/62/464632762.db2.gz GDUVCWLYYNIQRF-BBRMVZONSA-N 1 1 332.404 2.416 20 5 EEBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 ZINC000285631593 464635107 /nfs/dbraw/zinc/63/51/07/464635107.db2.gz KUBACLNVYKLQSQ-COXVUDFISA-N 1 1 330.388 2.235 20 5 EEBDMO CC[C@H](Cc1ccccc1)[N@@H+](CC)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000247655744 464700421 /nfs/dbraw/zinc/70/04/21/464700421.db2.gz POYSEDFJZFBXMQ-SJLPKXTDSA-N 1 1 346.431 2.495 20 5 EEBDMO C[C@@H]1C[N@@H+](C[C@@H]2CCCN2c2ncc([N+](=O)[O-])cc2F)C[C@H](C)O1 ZINC000591157131 468417861 /nfs/dbraw/zinc/41/78/61/468417861.db2.gz QWSWBAFXMLPRCZ-XQQFMLRXSA-N 1 1 338.383 2.207 20 5 EEBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2c2ncc([N+](=O)[O-])cc2F)C[C@H](C)O1 ZINC000591157131 468417868 /nfs/dbraw/zinc/41/78/68/468417868.db2.gz QWSWBAFXMLPRCZ-XQQFMLRXSA-N 1 1 338.383 2.207 20 5 EEBDMO COCC[C@H](C)[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000274845724 464756954 /nfs/dbraw/zinc/75/69/54/464756954.db2.gz PUOISIFYZHMOKH-ZDUSSCGKSA-N 1 1 347.419 2.408 20 5 EEBDMO C[C@H](c1ccccc1)[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000266750729 464808343 /nfs/dbraw/zinc/80/83/43/464808343.db2.gz PRYWAFCQXGYRTC-CXAGYDPISA-N 1 1 330.388 2.378 20 5 EEBDMO Cc1cccc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3CC(=O)N(C)C)c1[N+](=O)[O-] ZINC000286225308 464845903 /nfs/dbraw/zinc/84/59/03/464845903.db2.gz CIDDBLYSVUQVQI-GOOCMWNKSA-N 1 1 346.431 2.399 20 5 EEBDMO C[C@@H]1C[C@@H](N2CCOCC2)C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000286231463 464847576 /nfs/dbraw/zinc/84/75/76/464847576.db2.gz ZDXACXXNTJRQRL-TZMCWYRMSA-N 1 1 346.387 2.031 20 5 EEBDMO C[C@@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000286231463 464847581 /nfs/dbraw/zinc/84/75/81/464847581.db2.gz ZDXACXXNTJRQRL-TZMCWYRMSA-N 1 1 346.387 2.031 20 5 EEBDMO O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000183646942 464891325 /nfs/dbraw/zinc/89/13/25/464891325.db2.gz YOOXVSLCEOPWGX-CYBMUJFWSA-N 1 1 333.392 2.376 20 5 EEBDMO CCN(CCC[NH+]1CCCC1)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000276409585 464921135 /nfs/dbraw/zinc/92/11/35/464921135.db2.gz HSKFSYUJXQSGIC-UHFFFAOYSA-N 1 1 337.424 2.389 20 5 EEBDMO Cc1c(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177128795 464938124 /nfs/dbraw/zinc/93/81/24/464938124.db2.gz UMRKFYMETWLOFH-MWLCHTKSSA-N 1 1 348.359 2.166 20 5 EEBDMO CNC(=O)CC[C@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000286559339 464960429 /nfs/dbraw/zinc/96/04/29/464960429.db2.gz TUGZQNNHUDZCAX-GDBMZVCRSA-N 1 1 335.404 2.009 20 5 EEBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000282925268 465004598 /nfs/dbraw/zinc/00/45/98/465004598.db2.gz WROVMWGMCRZXMT-WFASDCNBSA-N 1 1 335.404 2.406 20 5 EEBDMO COc1c(C(=O)N(C)CCCn2cc[nH+]c2C)cccc1[N+](=O)[O-] ZINC000356525866 465435872 /nfs/dbraw/zinc/43/58/72/465435872.db2.gz YRCWECJLQKLZDC-UHFFFAOYSA-N 1 1 332.360 2.271 20 5 EEBDMO C[C@@H]1CN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C[N@H+]1C ZINC000330602354 465726691 /nfs/dbraw/zinc/72/66/91/465726691.db2.gz WMGCVQPAINMGLN-MNOVXSKESA-N 1 1 340.811 2.211 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000330615631 465733234 /nfs/dbraw/zinc/73/32/34/465733234.db2.gz UUBMJSKVTYDZCC-WDEREUQCSA-N 1 1 325.796 2.342 20 5 EEBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000348683240 465740979 /nfs/dbraw/zinc/74/09/79/465740979.db2.gz OFXLVAUPXAWQDI-INIZCTEOSA-N 1 1 349.435 2.180 20 5 EEBDMO CCOC(=O)c1ccnc(N2C[C@H](C)[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-] ZINC000345191152 465840137 /nfs/dbraw/zinc/84/01/37/465840137.db2.gz PHJOIGHWNPCFGZ-NWDGAFQWSA-N 1 1 336.392 2.085 20 5 EEBDMO C[C@H]1C[N@@H+](C)C[C@H]1c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000361253820 465865331 /nfs/dbraw/zinc/86/53/31/465865331.db2.gz USKVEPOSFGAIBK-NWDGAFQWSA-N 1 1 331.376 2.298 20 5 EEBDMO C[C@@H]1C[N@@H+](C)C[C@H]1c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000361253822 465865411 /nfs/dbraw/zinc/86/54/11/465865411.db2.gz USKVEPOSFGAIBK-VXGBXAGGSA-N 1 1 331.376 2.298 20 5 EEBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000345668315 465890157 /nfs/dbraw/zinc/89/01/57/465890157.db2.gz SGAMTCHLEOELCS-GFCCVEGCSA-N 1 1 328.372 2.309 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCCC[C@H]3CO)n2)cc1 ZINC000594016704 468460919 /nfs/dbraw/zinc/46/09/19/468460919.db2.gz FFKLLERBIQZOKH-AWEZNQCLSA-N 1 1 332.360 2.382 20 5 EEBDMO COc1c(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000353534484 465960297 /nfs/dbraw/zinc/96/02/97/465960297.db2.gz KRWUKKJNOMLCKE-ZDUSSCGKSA-N 1 1 333.344 2.229 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(O[C@@H]2CCOC2)CC1 ZINC000361437109 465996492 /nfs/dbraw/zinc/99/64/92/465996492.db2.gz GVJQCPOOOORLQL-MRXNPFEDSA-N 1 1 336.388 2.373 20 5 EEBDMO C[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1CO ZINC000361658306 466183348 /nfs/dbraw/zinc/18/33/48/466183348.db2.gz FKTQPQXOSPVKOX-SWLSCSKDSA-N 1 1 330.388 2.056 20 5 EEBDMO C[C@H](CC[NH+]1CCOCC1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000358031085 466398532 /nfs/dbraw/zinc/39/85/32/466398532.db2.gz TVQGBGBJUCXMIZ-GFCCVEGCSA-N 1 1 347.371 2.182 20 5 EEBDMO CC[NH+]1CCC(N(C)C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000332310926 466501779 /nfs/dbraw/zinc/50/17/79/466501779.db2.gz XLXRLWHVUFISPW-UHFFFAOYSA-N 1 1 331.376 2.027 20 5 EEBDMO COCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CC[C@H](C)C1 ZINC000362148281 466588659 /nfs/dbraw/zinc/58/86/59/466588659.db2.gz ISARMKMECOADIK-SWLSCSKDSA-N 1 1 335.404 2.331 20 5 EEBDMO CCOc1cc(C[N@@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)ccc1[N+](=O)[O-] ZINC000372807893 466597309 /nfs/dbraw/zinc/59/73/09/466597309.db2.gz RUYSCAPFDJWHMG-WOSRLPQWSA-N 1 1 333.388 2.079 20 5 EEBDMO CCOc1cc(C[N@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)ccc1[N+](=O)[O-] ZINC000372807893 466597312 /nfs/dbraw/zinc/59/73/12/466597312.db2.gz RUYSCAPFDJWHMG-WOSRLPQWSA-N 1 1 333.388 2.079 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412186953 467034504 /nfs/dbraw/zinc/03/45/04/467034504.db2.gz TWMZBRMYOGDVBN-IAOMBJDPSA-N 1 1 329.400 2.297 20 5 EEBDMO O=C(C[N@@H+]1CCC[C@H]1C1CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000377541445 467082840 /nfs/dbraw/zinc/08/28/40/467082840.db2.gz CZGDKAMUSIZASY-LBPRGKRZSA-N 1 1 333.344 2.136 20 5 EEBDMO O=C(C[N@H+]1CCC[C@H]1C1CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000377541445 467082841 /nfs/dbraw/zinc/08/28/41/467082841.db2.gz CZGDKAMUSIZASY-LBPRGKRZSA-N 1 1 333.344 2.136 20 5 EEBDMO C[C@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)CC[N@H+]1CC(C)(C)O ZINC000413253000 467197606 /nfs/dbraw/zinc/19/76/06/467197606.db2.gz XYIDLDGJKAUGQI-ZDUSSCGKSA-N 1 1 344.415 2.424 20 5 EEBDMO CN(C)CC[N@@H+](C)CCCN(C)c1nccc2ccc([N+](=O)[O-])cc21 ZINC000413302928 467211126 /nfs/dbraw/zinc/21/11/26/467211126.db2.gz PHSMLFZTNORNLU-UHFFFAOYSA-N 1 1 345.447 2.463 20 5 EEBDMO CN(CCCN(C)c1nccc2ccc([N+](=O)[O-])cc21)CC[NH+](C)C ZINC000413302928 467211130 /nfs/dbraw/zinc/21/11/30/467211130.db2.gz PHSMLFZTNORNLU-UHFFFAOYSA-N 1 1 345.447 2.463 20 5 EEBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000378271877 467248635 /nfs/dbraw/zinc/24/86/35/467248635.db2.gz JLZLRDUXUDWZSD-OAHLLOKOSA-N 1 1 342.399 2.315 20 5 EEBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H]1CC[N@H+](C(C)C)C1 ZINC000452096150 467320940 /nfs/dbraw/zinc/32/09/40/467320940.db2.gz NDKVFLBDXWCRCJ-CQSZACIVSA-N 1 1 341.433 2.006 20 5 EEBDMO COc1ccc(C(=O)N2CCC3(CCC[N@H+]3C)CC2)cc1[N+](=O)[O-] ZINC000378519301 467329251 /nfs/dbraw/zinc/32/92/51/467329251.db2.gz UMUSIBHEYJWRMH-UHFFFAOYSA-N 1 1 333.388 2.304 20 5 EEBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000433562553 467339597 /nfs/dbraw/zinc/33/95/97/467339597.db2.gz AZBQEAWSDZMXKG-KRWDZBQOSA-N 1 1 346.431 2.453 20 5 EEBDMO CC(C)[C@H]1[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC12CCCCC2 ZINC000414141579 467382934 /nfs/dbraw/zinc/38/29/34/467382934.db2.gz JUXCHIZYEICBGU-HZPDHXFCSA-N 1 1 336.436 2.443 20 5 EEBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(NC(=O)C(C)C)CC1 ZINC000430192311 467406798 /nfs/dbraw/zinc/40/67/98/467406798.db2.gz BDZGDLIOCSXWRO-UHFFFAOYSA-N 1 1 335.404 2.340 20 5 EEBDMO O=C1CCc2cc([N+](=O)[O-])c(NC[C@H]3CC[N@H+](C4CC4)C3)cc2N1 ZINC000392350474 467426406 /nfs/dbraw/zinc/42/64/06/467426406.db2.gz MMMMBGCFVPROKY-LLVKDONJSA-N 1 1 330.388 2.376 20 5 EEBDMO CC(C)NC(=O)c1ccc(N(C)C[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC000420633545 467438287 /nfs/dbraw/zinc/43/82/87/467438287.db2.gz JLDSBDLJUJXUOO-CQSZACIVSA-N 1 1 334.420 2.263 20 5 EEBDMO Cn1cc(CNC[C@]2(C)CCC[NH2+]C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000414920488 467449549 /nfs/dbraw/zinc/44/95/49/467449549.db2.gz ZMZDHPGLPVCALF-GOSISDBHSA-N 1 1 343.431 2.475 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]C[C@H](O)C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449738341 467704151 /nfs/dbraw/zinc/70/41/51/467704151.db2.gz BDRTWGIHRBYWTH-JKSUJKDBSA-N 1 1 330.388 2.168 20 5 EEBDMO Cn1cc[nH+]c1N1CCN(c2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450341246 467830767 /nfs/dbraw/zinc/83/07/67/467830767.db2.gz JDNIEVZZCYVRBA-UHFFFAOYSA-N 1 1 338.371 2.203 20 5 EEBDMO COc1cc(NC[C@@H]2CCC[N@H+]2CCCO)c(F)cc1[N+](=O)[O-] ZINC000450587972 467874559 /nfs/dbraw/zinc/87/45/59/467874559.db2.gz AMWJRLQBXCJSFK-NSHDSACASA-N 1 1 327.356 2.001 20 5 EEBDMO CCn1cc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cn1 ZINC000532981337 468156292 /nfs/dbraw/zinc/15/62/92/468156292.db2.gz HVYXQOGXHBBUHC-UHFFFAOYSA-N 1 1 331.376 2.272 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)CC(C)(C)OC ZINC000533020083 468162401 /nfs/dbraw/zinc/16/24/01/468162401.db2.gz CAMCQIBZLGTGDI-LLVKDONJSA-N 1 1 339.392 2.287 20 5 EEBDMO CCOc1ccc(C(=O)NC[C@H]2CCCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000600310561 468529186 /nfs/dbraw/zinc/52/91/86/468529186.db2.gz KACCWOBYUQLEMS-CYBMUJFWSA-N 1 1 335.404 2.455 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/nfs/dbraw/zinc/23/03/48/469230348.db2.gz LAUBESYIEXSZTM-UHFFFAOYSA-N 1 1 341.371 2.451 20 5 EEBDMO O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[N@@H+](CC2CCC2)CC1 ZINC000619868426 469691272 /nfs/dbraw/zinc/69/12/72/469691272.db2.gz AZHIABCQOFIHQP-UHFFFAOYSA-N 1 1 347.415 2.308 20 5 EEBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000609290993 469913872 /nfs/dbraw/zinc/91/38/72/469913872.db2.gz HOCXAPGBUMNUHT-CQSZACIVSA-N 1 1 332.404 2.411 20 5 EEBDMO COCC[N@H+]1CCC[C@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000609875606 469967160 /nfs/dbraw/zinc/96/71/60/469967160.db2.gz ZMGBOQPAEWFGEK-ZDUSSCGKSA-N 1 1 341.795 2.089 20 5 EEBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000610369679 470008233 /nfs/dbraw/zinc/00/82/33/470008233.db2.gz WBJMTHOEPFXNDK-DOTOQJQBSA-N 1 1 330.388 2.162 20 5 EEBDMO C[N@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)CC(C)(C)C ZINC000738097940 577999297 /nfs/dbraw/zinc/99/92/97/577999297.db2.gz HEHYKJLJTGMERZ-QGZVFWFLSA-N 1 1 348.403 2.297 20 5 EEBDMO C[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)CC(C)(C)C ZINC000738097940 577999298 /nfs/dbraw/zinc/99/92/98/577999298.db2.gz HEHYKJLJTGMERZ-QGZVFWFLSA-N 1 1 348.403 2.297 20 5 EEBDMO C[C@H]1CCC[N@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000726583022 576277743 /nfs/dbraw/zinc/27/77/43/576277743.db2.gz MHMIZPZXADBPIL-LBPRGKRZSA-N 1 1 332.360 2.053 20 5 EEBDMO C[C@H]1CCC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000726583022 576277746 /nfs/dbraw/zinc/27/77/46/576277746.db2.gz MHMIZPZXADBPIL-LBPRGKRZSA-N 1 1 332.360 2.053 20 5 EEBDMO COC1(C)CC[NH+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000774648287 577408648 /nfs/dbraw/zinc/40/86/48/577408648.db2.gz SVOQAPCSVHNHGW-UHFFFAOYSA-N 1 1 331.376 2.312 20 5 EEBDMO Cc1noc([C@H]2CCC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000776579507 577463070 /nfs/dbraw/zinc/46/30/70/577463070.db2.gz MCACGCIJNKJHOL-DZGCQCFKSA-N 1 1 332.360 2.199 20 5 EEBDMO C[C@@H]1[C@@H](C)CC[N@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000751941450 577762879 /nfs/dbraw/zinc/76/28/79/577762879.db2.gz OTTFKJLHHNMYJD-NWDGAFQWSA-N 1 1 332.360 2.051 20 5 EEBDMO CC[N@H+]1CCN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000754373760 577805290 /nfs/dbraw/zinc/80/52/90/577805290.db2.gz QFLIPUZGHOWHGZ-NSHDSACASA-N 1 1 340.811 2.213 20 5 EEBDMO O=[N+]([O-])c1ccc2nc(N3CC[NH+]([C@H]4CCOC4)CC3)sc2c1 ZINC000754784298 577812902 /nfs/dbraw/zinc/81/29/02/577812902.db2.gz IYNTWQNHJMVJGJ-LBPRGKRZSA-N 1 1 334.401 2.115 20 5 EEBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000742242568 577869843 /nfs/dbraw/zinc/86/98/43/577869843.db2.gz YFFRJJAOLWUTFB-CQSZACIVSA-N 1 1 346.431 2.409 20 5 EEBDMO CCOCCO[C@H]1CC[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000749805689 577982331 /nfs/dbraw/zinc/98/23/31/577982331.db2.gz HMKWASAOGAHZMF-HNNXBMFYSA-N 1 1 348.403 2.338 20 5 EEBDMO CCOCCO[C@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000749805689 577982332 /nfs/dbraw/zinc/98/23/32/577982332.db2.gz HMKWASAOGAHZMF-HNNXBMFYSA-N 1 1 348.403 2.338 20 5 EEBDMO Cc1[nH+]ccn1CCCCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000822478968 599584305 /nfs/dbraw/zinc/58/43/05/599584305.db2.gz WRCQXIJTNBEPBC-UHFFFAOYSA-N 1 1 342.363 2.172 20 5 EEBDMO Cn1c2ccccc2c(N[C@@H]2CC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1=O ZINC000891847332 676862452 /nfs/dbraw/zinc/86/24/52/676862452.db2.gz WZNANINQTRAKBD-UKRRQHHQSA-N 1 1 342.399 2.485 20 5 EEBDMO COc1cc(C[N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1O ZINC000178860637 681255252 /nfs/dbraw/zinc/25/52/52/681255252.db2.gz NXNLDKAWDXQHLM-MRXNPFEDSA-N 1 1 332.356 2.474 20 5 EEBDMO Cc1ccnc(N2CC[NH+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000137076915 682070407 /nfs/dbraw/zinc/07/04/07/682070407.db2.gz UGJVZRXCDGEXSY-QGZVFWFLSA-N 1 1 342.399 2.154 20 5 EEBDMO COC(=O)[C@H]1[C@H](C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1(F)F ZINC000894331920 682509158 /nfs/dbraw/zinc/50/91/58/682509158.db2.gz KHDCQMSXGQSXOV-GXSJLCMTSA-N 1 1 334.706 2.392 20 5 EEBDMO O=[N+]([O-])c1cnc2c(Cl)cccc2c1N1CC([N@H+]2CC[C@@H](O)C2)C1 ZINC000894399172 682819792 /nfs/dbraw/zinc/81/97/92/682819792.db2.gz PPLHOBVWDFXXBP-LLVKDONJSA-N 1 1 348.790 2.052 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21)C1CC=CC1 ZINC001025716591 683245262 /nfs/dbraw/zinc/24/52/62/683245262.db2.gz XOWTUWZHCPUAOV-FVQHAEBGSA-N 1 1 327.384 2.107 20 5 EEBDMO C[C@H](CNC(=O)N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccccc1[N+](=O)[O-] ZINC000893221557 684171921 /nfs/dbraw/zinc/17/19/21/684171921.db2.gz MTYHUPWAWQZMCO-HZSPNIEDSA-N 1 1 334.420 2.480 20 5 EEBDMO CC[N@@H+](C)C[C@@H](O)COc1ccc(Br)c(C)c1[N+](=O)[O-] ZINC000312631712 684681862 /nfs/dbraw/zinc/68/18/62/684681862.db2.gz WGALZZHQGMZAMD-SNVBAGLBSA-N 1 1 347.209 2.357 20 5 EEBDMO CCO[C@@H]1C[C@@H](N(C)C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1(C)C ZINC000867944931 1201711441 /nfs/dbraw/zinc/71/14/41/1201711441.db2.gz LTYJEPXGTIPOBF-IIDMSEBBSA-N 1 1 349.431 2.431 20 5 EEBDMO C[C@@]([NH3+])(C(=O)N1CCC(OCC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000867953282 1201714156 /nfs/dbraw/zinc/71/41/56/1201714156.db2.gz RUSCDPZQQQCUFU-SFHVURJKSA-N 1 1 347.415 2.186 20 5 EEBDMO C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ncc([N+](=O)[O-])c2ccccc21 ZINC000884505960 1202328656 /nfs/dbraw/zinc/32/86/56/1202328656.db2.gz RJPGHDRBSHRERQ-ZIAGYGMSSA-N 1 1 342.399 2.442 20 5 EEBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000932901625 1207697376 /nfs/dbraw/zinc/69/73/76/1207697376.db2.gz ATLURFXDOAJNDH-IAOVAPTHSA-N 1 1 331.416 2.499 20 5 EEBDMO Cc1nn(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c(C)c1[N+](=O)[O-] ZINC000246398015 1212445909 /nfs/dbraw/zinc/44/59/09/1212445909.db2.gz PURXPRQMKWLMFV-GOEBONIOSA-N 1 1 333.436 2.314 20 5 EEBDMO O=C(NC1CC2(C1)CC([NH2+]CCC1CCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC000963790665 1218040940 /nfs/dbraw/zinc/04/09/40/1218040940.db2.gz KRGAMLBIIBUTGF-YVXVDGILSA-N 1 1 335.448 2.249 20 5 EEBDMO 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C[N@@H+](CC(=O)N[C@H]1C[C@H](Nc2ncccc2[N+](=O)[O-])C1)CC(C)(C)C ZINC001097102655 1243702377 /nfs/dbraw/zinc/70/23/77/1243702377.db2.gz WJYNVDIYEDZQAL-JOCQHMNTSA-N 1 1 349.435 2.027 20 5 EEBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000827462670 1248127714 /nfs/dbraw/zinc/12/77/14/1248127714.db2.gz LSVJQAQUMPAETF-YOEHRIQHSA-N 1 1 349.431 2.112 20 5 EEBDMO O=C(C1CCC1)N1CC2(C1)CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C2 ZINC001072386291 1255119750 /nfs/dbraw/zinc/11/97/50/1255119750.db2.gz AKTZUTMIYWOXTJ-UHFFFAOYSA-N 1 1 329.400 2.429 20 5 EEBDMO Cc1noc(C[N@@H+]2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851746315 1277740520 /nfs/dbraw/zinc/74/05/20/1277740520.db2.gz SAVYISXMQQXLQD-LLVKDONJSA-N 1 1 340.380 2.238 20 5 EEBDMO Cc1noc(C[N@H+]2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851746315 1277740523 /nfs/dbraw/zinc/74/05/23/1277740523.db2.gz SAVYISXMQQXLQD-LLVKDONJSA-N 1 1 340.380 2.238 20 5 EEBDMO CSCCC(=O)N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 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O=[N+]([O-])c1cnc(N[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2CO)s1 ZINC000192497772 160170634 /nfs/dbraw/zinc/17/06/34/160170634.db2.gz QXICHXSCVDZZCK-ZIAGYGMSSA-N 1 1 348.428 2.346 20 5 EEBDMO CCOC[C@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000248373100 160342507 /nfs/dbraw/zinc/34/25/07/160342507.db2.gz GGLVZAUHKZEUGD-LSDHHAIUSA-N 1 1 338.404 2.083 20 5 EEBDMO COc1ccc(-c2ccc(C[NH2+]Cc3cnnn3C)o2)c([N+](=O)[O-])c1 ZINC000342246405 161050295 /nfs/dbraw/zinc/05/02/95/161050295.db2.gz MGNGWCMPNYGCQI-UHFFFAOYSA-N 1 1 343.343 2.282 20 5 EEBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000352030844 162037653 /nfs/dbraw/zinc/03/76/53/162037653.db2.gz XNNKHQIZHVVNCN-RYUDHWBXSA-N 1 1 330.388 2.170 20 5 EEBDMO CCC[N@H+]1CCC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000352509755 162164825 /nfs/dbraw/zinc/16/48/25/162164825.db2.gz HCCQRZNQAJTGJX-ZDUSSCGKSA-N 1 1 341.433 2.056 20 5 EEBDMO Cn1ccnc1[C@H]([NH2+]C1CCC(O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000353617926 162629026 /nfs/dbraw/zinc/62/90/26/162629026.db2.gz FENBCQZNXSLJKG-AVVWSFFYSA-N 1 1 330.388 2.311 20 5 EEBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000356305877 163399757 /nfs/dbraw/zinc/39/97/57/163399757.db2.gz WEFYMEQWVKLKHP-KRWDZBQOSA-N 1 1 335.379 2.221 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000360406595 164302946 /nfs/dbraw/zinc/30/29/46/164302946.db2.gz OBIAFYFQYPZQFX-CYBMUJFWSA-N 1 1 334.376 2.305 20 5 EEBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000364063023 165013058 /nfs/dbraw/zinc/01/30/58/165013058.db2.gz HMIBVPUPRPSDTN-CQSZACIVSA-N 1 1 333.388 2.060 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000369068966 166183156 /nfs/dbraw/zinc/18/31/56/166183156.db2.gz YFMKNWHEKOPTRU-GFCCVEGCSA-N 1 1 333.388 2.350 20 5 EEBDMO Cc1cccc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)[nH+]1 ZINC000159378518 225205104 /nfs/dbraw/zinc/20/51/04/225205104.db2.gz OJQIKAUAMWHFGP-UHFFFAOYSA-N 1 1 326.356 2.261 20 5 EEBDMO C[C@H](NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)C1=CC[N@@H+](C)CC1 ZINC000272768938 269018397 /nfs/dbraw/zinc/01/83/97/269018397.db2.gz QKHCPFDNGGLPTF-NSHDSACASA-N 1 1 328.372 2.456 20 5 EEBDMO O=[N+]([O-])c1cnc(NC[C@H]2CSCC[N@H+]2Cc2ccccc2)nc1 ZINC000277224644 269144126 /nfs/dbraw/zinc/14/41/26/269144126.db2.gz SDZPSVFYNYLZJI-HNNXBMFYSA-N 1 1 345.428 2.414 20 5 EEBDMO O=c1ccn(C[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)cc1[N+](=O)[O-] ZINC000278510299 269235665 /nfs/dbraw/zinc/23/56/65/269235665.db2.gz DZOYRFIMMNRSLN-MRXNPFEDSA-N 1 1 343.383 2.048 20 5 EEBDMO COc1ccc(CN2CC[N@H+](C3CCOCC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000278705246 269241598 /nfs/dbraw/zinc/24/15/98/269241598.db2.gz QQGLSCPKNSTDTH-AWEZNQCLSA-N 1 1 349.431 2.289 20 5 EEBDMO C[C@H](CN1CCOCC1)[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000279816725 269308586 /nfs/dbraw/zinc/30/85/86/269308586.db2.gz YEPQKPGSDBTDFM-GFCCVEGCSA-N 1 1 327.812 2.401 20 5 EEBDMO C[C@H](CN1CCOCC1)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000279816725 269308587 /nfs/dbraw/zinc/30/85/87/269308587.db2.gz YEPQKPGSDBTDFM-GFCCVEGCSA-N 1 1 327.812 2.401 20 5 EEBDMO COCC[N@H+]1[C@H](C)CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000131909124 274035574 /nfs/dbraw/zinc/03/55/74/274035574.db2.gz VALSOUZYHDWPAW-PHIMTYICSA-N 1 1 328.800 2.189 20 5 EEBDMO COCC[N@@H+]1[C@H](C)CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000131909124 274035576 /nfs/dbraw/zinc/03/55/76/274035576.db2.gz VALSOUZYHDWPAW-PHIMTYICSA-N 1 1 328.800 2.189 20 5 EEBDMO O=C1[C@H]([N@H+]2CC[C@H]3OCCC[C@@H]3C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000155507382 275030275 /nfs/dbraw/zinc/03/02/75/275030275.db2.gz XZTVTCMKPROHCH-KBRIMQKVSA-N 1 1 345.399 2.201 20 5 EEBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000291095358 275269754 /nfs/dbraw/zinc/26/97/54/275269754.db2.gz ILUKZPLVDWNPDG-ZACQAIPSSA-N 1 1 349.431 2.162 20 5 EEBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412147785 276306649 /nfs/dbraw/zinc/30/66/49/276306649.db2.gz HPBJXJSVFVMNIZ-RRQGHBQHSA-N 1 1 331.416 2.499 20 5 EEBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(c2nc3sccn3c2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488752883 278035697 /nfs/dbraw/zinc/03/56/97/278035697.db2.gz YPCBXIFATSSGSG-QJPTWQEYSA-N 1 1 335.433 2.471 20 5 EEBDMO C[C@@H]([N@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1(C)CC1 ZINC000181980488 278303110 /nfs/dbraw/zinc/30/31/10/278303110.db2.gz BYKQQIHMXKSCGG-GFCCVEGCSA-N 1 1 326.418 2.489 20 5 EEBDMO C[C@@H]([N@@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1(C)CC1 ZINC000181980488 278303111 /nfs/dbraw/zinc/30/31/11/278303111.db2.gz BYKQQIHMXKSCGG-GFCCVEGCSA-N 1 1 326.418 2.489 20 5 EEBDMO Cc1ccc([N+](=O)[O-])c(N2CCC([NH+]3CCN(C(C)C)CC3)CC2)n1 ZINC000270497746 281010599 /nfs/dbraw/zinc/01/05/99/281010599.db2.gz SWUKLJKKXCGSTQ-UHFFFAOYSA-N 1 1 347.463 2.293 20 5 EEBDMO CCc1ccc([C@H]2CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000293178463 293144518 /nfs/dbraw/zinc/14/45/18/293144518.db2.gz DKYHHRNUFAXCLN-FUHWJXTLSA-N 1 1 344.415 2.204 20 5 EEBDMO Cc1nc(N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000296837734 294079849 /nfs/dbraw/zinc/07/98/49/294079849.db2.gz SORUSYYUEMNLTL-HNNXBMFYSA-N 1 1 327.388 2.056 20 5 EEBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc(CC(=O)OC)cc2[N+](=O)[O-])C1 ZINC000296947161 294109408 /nfs/dbraw/zinc/10/94/08/294109408.db2.gz BXHGPHDSBPIQOS-OAHLLOKOSA-N 1 1 349.431 2.478 20 5 EEBDMO CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@@H]1CCC[N@H+]1C ZINC000421017073 314027282 /nfs/dbraw/zinc/02/72/82/314027282.db2.gz YZTSRHUQVLYLTL-AWEZNQCLSA-N 1 1 331.376 2.171 20 5 EEBDMO NC(=O)c1cccc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000439131448 315069206 /nfs/dbraw/zinc/06/92/06/315069206.db2.gz ODDUFMHZIZBHTF-AWEZNQCLSA-N 1 1 340.383 2.380 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000566757584 319318195 /nfs/dbraw/zinc/31/81/95/319318195.db2.gz KLGSRRDGXLKBNG-AWEZNQCLSA-N 1 1 335.404 2.225 20 5 EEBDMO CC(C)CO[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000182004317 323361918 /nfs/dbraw/zinc/36/19/18/323361918.db2.gz VQJSBGGDEYSAQY-LSDHHAIUSA-N 1 1 338.404 2.081 20 5 EEBDMO C[N@H+]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C(C)(C)C1 ZINC000347485346 465050175 /nfs/dbraw/zinc/05/01/75/465050175.db2.gz DGSYNFLCNQUNEI-UHFFFAOYSA-N 1 1 334.420 2.340 20 5 EEBDMO C[C@H](NC(=O)NCC[NH+]1CCSCC1)c1ccc([N+](=O)[O-])cc1 ZINC000296226082 465122682 /nfs/dbraw/zinc/12/26/82/465122682.db2.gz ANAFRGIXZWTAMQ-LBPRGKRZSA-N 1 1 338.433 2.004 20 5 EEBDMO O=[N+]([O-])c1ccc(-c2noc(CN3CCC4(C3)CC[NH2+]CC4)n2)cc1 ZINC000358497217 465159501 /nfs/dbraw/zinc/15/95/01/465159501.db2.gz ARTMNWGUHJRKPH-UHFFFAOYSA-N 1 1 343.387 2.220 20 5 EEBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000045313724 462576826 /nfs/dbraw/zinc/57/68/26/462576826.db2.gz VJYYIYWRVGIPRC-GFCCVEGCSA-N 1 1 328.372 2.100 20 5 EEBDMO CS(=O)(=O)c1cccc(N[C@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000089620038 462699264 /nfs/dbraw/zinc/69/92/64/462699264.db2.gz QZTUVVFANLTGCH-WCQYABFASA-N 1 1 339.417 2.037 20 5 EEBDMO C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[N@H+](C)CCO1 ZINC000129897583 462729678 /nfs/dbraw/zinc/72/96/78/462729678.db2.gz KBOQXUJGVVEBKF-NOZJJQNGSA-N 1 1 342.783 2.089 20 5 EEBDMO C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[N@@H+](C)CCO1 ZINC000129897583 462729683 /nfs/dbraw/zinc/72/96/83/462729683.db2.gz KBOQXUJGVVEBKF-NOZJJQNGSA-N 1 1 342.783 2.089 20 5 EEBDMO CC[NH+]1CCN(CCCCNC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000075802130 462758856 /nfs/dbraw/zinc/75/88/56/462758856.db2.gz BJLYDCMPSUBLTQ-UHFFFAOYSA-N 1 1 349.435 2.134 20 5 EEBDMO Cc1nn(C)c(N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000047331226 462770361 /nfs/dbraw/zinc/77/03/61/462770361.db2.gz PWJURSDEZIZXSQ-UHFFFAOYSA-N 1 1 347.394 2.488 20 5 EEBDMO NC(=O)c1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000047744408 462820430 /nfs/dbraw/zinc/82/04/30/462820430.db2.gz JPBJSXIELRICKJ-UHFFFAOYSA-N 1 1 340.383 2.016 20 5 EEBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]1CN1CCOCC1 ZINC000092217926 462935662 /nfs/dbraw/zinc/93/56/62/462935662.db2.gz VNDUMGOMTHETNG-ZVVFDCPKSA-N 1 1 331.416 2.405 20 5 EEBDMO CCCNC(=O)[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000050995554 463015093 /nfs/dbraw/zinc/01/50/93/463015093.db2.gz MPBYMGSZFGCWIE-AWEZNQCLSA-N 1 1 335.404 2.212 20 5 EEBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000068203708 463104985 /nfs/dbraw/zinc/10/49/85/463104985.db2.gz UKJMALMRLYYNPW-DOTOQJQBSA-N 1 1 342.399 2.293 20 5 EEBDMO Cc1[nH+]ccn1CCCCNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000078335998 463105229 /nfs/dbraw/zinc/10/52/29/463105229.db2.gz IEDSRXCXOXAACS-UHFFFAOYSA-N 1 1 342.359 2.229 20 5 EEBDMO O=C1NCCCN1C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000135436605 463155408 /nfs/dbraw/zinc/15/54/08/463155408.db2.gz WPDISZHKYXJWKM-UHFFFAOYSA-N 1 1 336.367 2.114 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOCC12CCC2 ZINC000135505648 463166559 /nfs/dbraw/zinc/16/65/59/463166559.db2.gz CHRGJWKPJNQILP-UHFFFAOYSA-N 1 1 333.388 2.487 20 5 EEBDMO C[C@H]1CCC[C@H](CO)[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000136167238 463225138 /nfs/dbraw/zinc/22/51/38/463225138.db2.gz DOZYBRCGNCZGHN-SMDDNHRTSA-N 1 1 332.360 2.380 20 5 EEBDMO C[C@H]1CCC[C@H](CO)[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000136167238 463225140 /nfs/dbraw/zinc/22/51/40/463225140.db2.gz DOZYBRCGNCZGHN-SMDDNHRTSA-N 1 1 332.360 2.380 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)Cn1cc[nH+]c1C ZINC000054625298 463250592 /nfs/dbraw/zinc/25/05/92/463250592.db2.gz KXNGVJXVANXPNO-NSHDSACASA-N 1 1 332.360 2.174 20 5 EEBDMO O=C(/C=C/c1ccc(F)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000069461701 463253224 /nfs/dbraw/zinc/25/32/24/463253224.db2.gz JMWSWUKRZZMYPN-IPKOWEFYSA-N 1 1 333.363 2.490 20 5 EEBDMO C[C@@H](CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C1CC1 ZINC000057716178 463512986 /nfs/dbraw/zinc/51/29/86/463512986.db2.gz JGFZRTPKXJTPTG-ZDUSSCGKSA-N 1 1 334.420 2.386 20 5 EEBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000286846953 463723116 /nfs/dbraw/zinc/72/31/16/463723116.db2.gz BDJRSKYCFZUOJW-BBRMVZONSA-N 1 1 346.431 2.261 20 5 EEBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000171202722 463812456 /nfs/dbraw/zinc/81/24/56/463812456.db2.gz PDVDUHBVCDDSKV-LBPRGKRZSA-N 1 1 331.376 2.235 20 5 EEBDMO C[C@H]1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC[S@]1=O ZINC000277300764 463906688 /nfs/dbraw/zinc/90/66/88/463906688.db2.gz UDDKTVMLUIRZHF-WHEQGISXSA-N 1 1 326.418 2.207 20 5 EEBDMO C[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC[S@]1=O ZINC000277300764 463906696 /nfs/dbraw/zinc/90/66/96/463906696.db2.gz UDDKTVMLUIRZHF-WHEQGISXSA-N 1 1 326.418 2.207 20 5 EEBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000269284951 463941287 /nfs/dbraw/zinc/94/12/87/463941287.db2.gz QVMBUKVWXNLVHH-HOCLYGCPSA-N 1 1 330.388 2.274 20 5 EEBDMO COC(=O)C[C@@H]1CCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000179126154 464062439 /nfs/dbraw/zinc/06/24/39/464062439.db2.gz TVFUEEQBACDNLA-LBPRGKRZSA-N 1 1 346.343 2.172 20 5 EEBDMO COC(=O)C[C@@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000179126154 464062442 /nfs/dbraw/zinc/06/24/42/464062442.db2.gz TVFUEEQBACDNLA-LBPRGKRZSA-N 1 1 346.343 2.172 20 5 EEBDMO CC[C@]1(CO)CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000187609818 464143736 /nfs/dbraw/zinc/14/37/36/464143736.db2.gz WRUKQYQZHDMNKF-KRWDZBQOSA-N 1 1 335.404 2.408 20 5 EEBDMO COc1cc(C[N@@H+](C)CC(C)(C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000180156805 464255289 /nfs/dbraw/zinc/25/52/89/464255289.db2.gz XDFKYYFSEIOPND-UHFFFAOYSA-N 1 1 348.346 2.450 20 5 EEBDMO C[N@H+]1CCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C(C)(C)C1 ZINC000270938368 464271197 /nfs/dbraw/zinc/27/11/97/464271197.db2.gz IVXKVMOTXFZISC-UHFFFAOYSA-N 1 1 344.371 2.015 20 5 EEBDMO COc1ccc(OCC[N@H+]2CC[C@@H](O)C23CCCC3)c([N+](=O)[O-])c1 ZINC000292557570 464272879 /nfs/dbraw/zinc/27/28/79/464272879.db2.gz AUKSFPMXMBMCJB-MRXNPFEDSA-N 1 1 336.388 2.362 20 5 EEBDMO CC[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1O ZINC000271358243 464294005 /nfs/dbraw/zinc/29/40/05/464294005.db2.gz QOKDFPSHQGHLPM-LRDDRELGSA-N 1 1 330.388 2.198 20 5 EEBDMO O=C(C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)NCC1CCC1 ZINC000174248416 464383464 /nfs/dbraw/zinc/38/34/64/464383464.db2.gz WYQIOLXIERGVCM-UHFFFAOYSA-N 1 1 347.415 2.354 20 5 EEBDMO C[C@@]1(CCCO)CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000272073939 464468296 /nfs/dbraw/zinc/46/82/96/464468296.db2.gz ZWSSIKZDPDRJDX-SFHVURJKSA-N 1 1 347.415 2.111 20 5 EEBDMO CSc1ccc([N+](=O)[O-])c(C(=O)NCC[NH+]2CCSCC2)c1 ZINC000264801940 464471583 /nfs/dbraw/zinc/47/15/83/464471583.db2.gz NDTRWCRCVILPSQ-UHFFFAOYSA-N 1 1 341.458 2.095 20 5 EEBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)[N@@H+](C)C1CC1 ZINC000181466144 464494144 /nfs/dbraw/zinc/49/41/44/464494144.db2.gz HJSKQIQLSNOQIO-SECBINFHSA-N 1 1 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O=C(Nc1ccccc1)[C@H]1CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC000176200281 464719136 /nfs/dbraw/zinc/71/91/36/464719136.db2.gz YLYJIVOKEXVPFM-AWEZNQCLSA-N 1 1 343.387 2.142 20 5 EEBDMO CC[N@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1c(C)cccc1C ZINC000176263718 464734309 /nfs/dbraw/zinc/73/43/09/464734309.db2.gz WJJHNELDMKWDOQ-UHFFFAOYSA-N 1 1 345.403 2.369 20 5 EEBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1c(C)cccc1C ZINC000176263718 464734313 /nfs/dbraw/zinc/73/43/13/464734313.db2.gz WJJHNELDMKWDOQ-UHFFFAOYSA-N 1 1 345.403 2.369 20 5 EEBDMO Cc1cc(C(=O)N2CC[N@H+](C3CC3)C[C@H](C)C2)c(N)c([N+](=O)[O-])c1 ZINC000295411365 464820831 /nfs/dbraw/zinc/82/08/31/464820831.db2.gz SLMSPRHHMPDMPM-LBPRGKRZSA-N 1 1 332.404 2.042 20 5 EEBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@]2(CO)CCOc3ccccc32)cc1F ZINC000282522361 464850335 /nfs/dbraw/zinc/85/03/35/464850335.db2.gz POWZQMOEELIGPS-QGZVFWFLSA-N 1 1 332.331 2.494 20 5 EEBDMO CC(C)[C@H](C(=O)NCc1ccccc1[N+](=O)[O-])[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000249808965 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CC(C)C[C@@]1(CO)CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000191651941 528436078 /nfs/dbraw/zinc/43/60/78/528436078.db2.gz VNJPNTLPCYVYRQ-QGZVFWFLSA-N 1 1 335.404 2.406 20 5 EEBDMO CC[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 ZINC000159034905 529135128 /nfs/dbraw/zinc/13/51/28/529135128.db2.gz ICFGAVRGEBXDHQ-UHFFFAOYSA-N 1 1 342.193 2.135 20 5 EEBDMO O=C(OCCC[NH+]1CCOCC1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000748495651 576350209 /nfs/dbraw/zinc/35/02/09/576350209.db2.gz WLPYBQAHNDDPJZ-UHFFFAOYSA-N 1 1 328.752 2.127 20 5 EEBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCN(CC(F)(F)F)C1=O ZINC000732197436 577158388 /nfs/dbraw/zinc/15/83/88/577158388.db2.gz IFQBQGBBZKTCBY-LBPRGKRZSA-N 1 1 331.294 2.190 20 5 EEBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCN(CC(F)(F)F)C1=O ZINC000732197436 577158390 /nfs/dbraw/zinc/15/83/90/577158390.db2.gz IFQBQGBBZKTCBY-LBPRGKRZSA-N 1 1 331.294 2.190 20 5 EEBDMO COc1cc(CO[NH+]=C(N)C2CCOCC2)c([N+](=O)[O-])cc1F ZINC000766063438 577512107 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1 1 349.387 2.174 20 5 EEBDMO COc1ccc(OCCN2CC[N@@H+](C)[C@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000488020808 468068169 /nfs/dbraw/zinc/06/81/69/468068169.db2.gz CKMAPMYDYKELAV-INIZCTEOSA-N 1 1 337.420 2.254 20 5 EEBDMO Cc1cccc(C(=O)N2CCC([N@@H+]3CCOC[C@H]3C)CC2)c1[N+](=O)[O-] ZINC000590387708 468244447 /nfs/dbraw/zinc/24/44/47/468244447.db2.gz HTPUSKPBZFTKOG-CQSZACIVSA-N 1 1 347.415 2.229 20 5 EEBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@H](c3cccnc3)C2)c1 ZINC000592140014 468634598 /nfs/dbraw/zinc/63/45/98/468634598.db2.gz SYENEIWQCWTTSX-RDJZCZTQSA-N 1 1 343.383 2.219 20 5 EEBDMO O=[N+]([O-])c1ccc2[nH+]ccc(NCCCOC[C@H]3CCOC3)c2c1 ZINC000601121375 468750032 /nfs/dbraw/zinc/75/00/32/468750032.db2.gz MZTISKDGUHGLEE-CYBMUJFWSA-N 1 1 331.372 2.420 20 5 EEBDMO Cc1nc(N2CC[NH+](Cc3ccc(O)cc3)CC2)ccc1[N+](=O)[O-] ZINC000601257601 468801424 /nfs/dbraw/zinc/80/14/24/468801424.db2.gz PIRSZBSJYGESBR-UHFFFAOYSA-N 1 1 328.372 2.326 20 5 EEBDMO CCC[N@H+]1CC[C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000598342294 468836704 /nfs/dbraw/zinc/83/67/04/468836704.db2.gz LWWQUMNQSYURTD-NSHDSACASA-N 1 1 344.371 2.063 20 5 EEBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000595504195 468879259 /nfs/dbraw/zinc/87/92/59/468879259.db2.gz FYKMOGKAEUFTSQ-KSSFIOAISA-N 1 1 346.431 2.340 20 5 EEBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000593188749 468899421 /nfs/dbraw/zinc/89/94/21/468899421.db2.gz PDBKPBVOKNKYHE-MCIONIFRSA-N 1 1 344.415 2.489 20 5 EEBDMO C[C@@H](C(=O)N1CC[N@@H+](CC(C)(C)O)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000562301310 468933300 /nfs/dbraw/zinc/93/33/00/468933300.db2.gz LINDRQLKJLIFEK-UONOGXRCSA-N 1 1 349.431 2.002 20 5 EEBDMO CC(C)c1ccc2c(c1)C[N@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)CC2 ZINC000595657030 468942408 /nfs/dbraw/zinc/94/24/08/468942408.db2.gz HOTYEAYUKZGOAY-SFHVURJKSA-N 1 1 344.415 2.334 20 5 EEBDMO C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1CCO ZINC000595695886 468958454 /nfs/dbraw/zinc/95/84/54/468958454.db2.gz IXFGTCMNNZKWNQ-MLGOLLRUSA-N 1 1 336.388 2.444 20 5 EEBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](C)[C@@H]1CCO ZINC000595695892 468958717 /nfs/dbraw/zinc/95/87/17/468958717.db2.gz IYIUCQOSSXQCQS-WBMJQRKESA-N 1 1 335.404 2.325 20 5 EEBDMO Cc1cc(N2CC([N@@H+]3CC[C@@H](O)C3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000593503378 469008311 /nfs/dbraw/zinc/00/83/11/469008311.db2.gz JCZCFRPFWALTSS-LLVKDONJSA-N 1 1 345.321 2.177 20 5 EEBDMO Cc1cc(N2CC([N@H+]3CC[C@@H](O)C3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000593503378 469008318 /nfs/dbraw/zinc/00/83/18/469008318.db2.gz JCZCFRPFWALTSS-LLVKDONJSA-N 1 1 345.321 2.177 20 5 EEBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000610583376 469011802 /nfs/dbraw/zinc/01/18/02/469011802.db2.gz SFEUEIWRZHGVDU-CABCVRRESA-N 1 1 346.431 2.400 20 5 EEBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)C[C@H](C)C(=O)OC(C)(C)C ZINC000602841842 469111501 /nfs/dbraw/zinc/11/15/01/469111501.db2.gz WBHSULUJMUOUHI-NSHDSACASA-N 1 1 326.397 2.009 20 5 EEBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC2(CCOC2)CC1 ZINC000611177798 469183468 /nfs/dbraw/zinc/18/34/68/469183468.db2.gz LTMLBOBUMFRJDF-CYBMUJFWSA-N 1 1 333.388 2.424 20 5 EEBDMO C[N@H+]1CCC[C@H]2CN(Cc3cc4c(cc3[N+](=O)[O-])OCCO4)CC[C@H]21 ZINC000611286351 469219945 /nfs/dbraw/zinc/21/99/45/469219945.db2.gz QTKHDGSPAZUAGM-DZGCQCFKSA-N 1 1 347.415 2.282 20 5 EEBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(c2cc[nH]c(=O)c2[N+](=O)[O-])C1 ZINC000596460926 469274697 /nfs/dbraw/zinc/27/46/97/469274697.db2.gz ARLYUMFXPNDRPK-HNNXBMFYSA-N 1 1 342.399 2.449 20 5 EEBDMO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@H]3CCCc4c[nH]nc43)CC2)cn1 ZINC000602573099 469367507 /nfs/dbraw/zinc/36/75/07/469367507.db2.gz YPNRYEVKGTYKTG-HNNXBMFYSA-N 1 1 342.403 2.349 20 5 EEBDMO CCNC(=O)[C@@H](C)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602585227 469371603 /nfs/dbraw/zinc/37/16/03/469371603.db2.gz DLNRUJDGUTWOPF-ZCFIWIBFSA-N 1 1 336.211 2.033 20 5 EEBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])cn1C ZINC000609508375 469934841 /nfs/dbraw/zinc/93/48/41/469934841.db2.gz PSQCFDJEBUWHIW-CQSZACIVSA-N 1 1 342.399 2.280 20 5 EEBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])cn1C ZINC000609508375 469934844 /nfs/dbraw/zinc/93/48/44/469934844.db2.gz PSQCFDJEBUWHIW-CQSZACIVSA-N 1 1 342.399 2.280 20 5 EEBDMO Cc1ccc(NCCCNC(=O)[C@H]2CCCC[N@@H+]2C)c([N+](=O)[O-])c1 ZINC000610069271 469978073 /nfs/dbraw/zinc/97/80/73/469978073.db2.gz ICZOZXUYVIJSLN-OAHLLOKOSA-N 1 1 334.420 2.306 20 5 EEBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594204038 485602872 /nfs/dbraw/zinc/60/28/72/485602872.db2.gz WMXKGKQVJHIPQQ-GJZGRUSLSA-N 1 1 333.388 2.350 20 5 EEBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000032921017 524889803 /nfs/dbraw/zinc/88/98/03/524889803.db2.gz FVIJRGUPHPHCAD-ZIAGYGMSSA-N 1 1 349.431 2.141 20 5 EEBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000456394507 535850796 /nfs/dbraw/zinc/85/07/96/535850796.db2.gz YRPVXLSXBFJAFW-CQSZACIVSA-N 1 1 335.404 2.468 20 5 EEBDMO CN(C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000491687200 535935794 /nfs/dbraw/zinc/93/57/94/535935794.db2.gz UWLIZJBCNIPFHJ-MIOHMZDASA-N 1 1 333.363 2.442 20 5 EEBDMO CO[C@@H]1CC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1(C)C ZINC000451572915 536694085 /nfs/dbraw/zinc/69/40/85/536694085.db2.gz XVFRRFCMMCWWGO-JKSUJKDBSA-N 1 1 347.415 2.447 20 5 EEBDMO CO[C@@H]1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1(C)C ZINC000451572915 536694088 /nfs/dbraw/zinc/69/40/88/536694088.db2.gz XVFRRFCMMCWWGO-JKSUJKDBSA-N 1 1 347.415 2.447 20 5 EEBDMO COc1cc(C[N@H+](C)C2CCN(OC)CC2)c([N+](=O)[O-])cc1F ZINC000459580849 536744438 /nfs/dbraw/zinc/74/44/38/536744438.db2.gz NFKPSWOFNLTXEK-UHFFFAOYSA-N 1 1 327.356 2.200 20 5 EEBDMO CC(C)c1n[nH]c(C(=O)NCCn2cc[nH+]c2C(C)C)c1[N+](=O)[O-] ZINC000771492650 577215692 /nfs/dbraw/zinc/21/56/92/577215692.db2.gz SUXGALVKMKLGKD-UHFFFAOYSA-N 1 1 334.380 2.191 20 5 EEBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000773190808 577321694 /nfs/dbraw/zinc/32/16/94/577321694.db2.gz LOIVRDZBPDMSAA-LLVKDONJSA-N 1 1 344.371 2.063 20 5 EEBDMO Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)C[N@@H+](C)[C@@H]1CCSC1)CC2 ZINC000773993967 577377380 /nfs/dbraw/zinc/37/73/80/577377380.db2.gz SDUFNESEJWUWQV-CYBMUJFWSA-N 1 1 335.429 2.230 20 5 EEBDMO Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)C[N@H+](C)[C@@H]1CCSC1)CC2 ZINC000773993967 577377383 /nfs/dbraw/zinc/37/73/83/577377383.db2.gz SDUFNESEJWUWQV-CYBMUJFWSA-N 1 1 335.429 2.230 20 5 EEBDMO Cc1nn(C[N@@H+]2CCOCC3(CCCC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000774660433 577409370 /nfs/dbraw/zinc/40/93/70/577409370.db2.gz ZMKSIOQDQDOAML-UHFFFAOYSA-N 1 1 345.403 2.498 20 5 EEBDMO Cc1nn(C[N@H+]2CCOCC3(CCCC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000774660433 577409371 /nfs/dbraw/zinc/40/93/71/577409371.db2.gz ZMKSIOQDQDOAML-UHFFFAOYSA-N 1 1 345.403 2.498 20 5 EEBDMO CC(=O)N(C)C1CC[NH+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)CC1 ZINC000764943390 577491423 /nfs/dbraw/zinc/49/14/23/577491423.db2.gz DZXXFXPAWBQBSU-UHFFFAOYSA-N 1 1 345.403 2.153 20 5 EEBDMO CC[N@@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@@H]1C ZINC000765930205 577509179 /nfs/dbraw/zinc/50/91/79/577509179.db2.gz PDWVZRNPZCRNTL-QWRGUYRKSA-N 1 1 336.348 2.058 20 5 EEBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@@H]1C ZINC000765930205 577509180 /nfs/dbraw/zinc/50/91/80/577509180.db2.gz PDWVZRNPZCRNTL-QWRGUYRKSA-N 1 1 336.348 2.058 20 5 EEBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CC[N@@H+](C)[C@@H](C)C1 ZINC000761067585 577675490 /nfs/dbraw/zinc/67/54/90/577675490.db2.gz FXQKTHMNQXKHNC-WDEREUQCSA-N 1 1 340.811 2.211 20 5 EEBDMO C[C@@H]1C[C@H](NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000742309580 577870822 /nfs/dbraw/zinc/87/08/22/577870822.db2.gz POIUPWOWXYRQFU-MWLCHTKSSA-N 1 1 347.824 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Cc1cccc(Cl)c1C[NH2+][C@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC001022063740 676628317 /nfs/dbraw/zinc/62/83/17/676628317.db2.gz KRQJVAZFAZKONL-NWJSVONSSA-N 1 1 337.807 2.050 20 5 EEBDMO COc1c(O)ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)c1[N+](=O)[O-] ZINC000894707783 683043430 /nfs/dbraw/zinc/04/34/30/683043430.db2.gz PFJQBTMTGAZXJA-MGPQQGTHSA-N 1 1 336.388 2.434 20 5 EEBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21)C1CC=CC1 ZINC001025716572 683245516 /nfs/dbraw/zinc/24/55/16/683245516.db2.gz JLCSZZFPOSMRDO-QLPKVWCKSA-N 1 1 327.384 2.107 20 5 EEBDMO C[C@@H]1CO[C@@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000893052350 683649881 /nfs/dbraw/zinc/64/98/81/683649881.db2.gz BJIXNUAIYKUJDQ-VBNZEHGJSA-N 1 1 334.372 2.137 20 5 EEBDMO C[C@@H]1CO[C@@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000893052350 683649888 /nfs/dbraw/zinc/64/98/88/683649888.db2.gz BJIXNUAIYKUJDQ-VBNZEHGJSA-N 1 1 334.372 2.137 20 5 EEBDMO CCn1cccc1C(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001032188053 1192908391 /nfs/dbraw/zinc/90/83/91/1192908391.db2.gz NBIRBHHKGIDGOQ-UHFFFAOYSA-N 1 1 342.399 2.278 20 5 EEBDMO O=C(NCC[NH2+]CCCc1cccc2ccccc21)[C@@H]1CC1[N+](=O)[O-] ZINC001126938478 1189087006 /nfs/dbraw/zinc/08/70/06/1189087006.db2.gz AQWMSEGBGPHBMX-QZTJIDSGSA-N 1 1 341.411 2.143 20 5 EEBDMO C[C@H](CO)[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H](C)O ZINC000809986023 1199179758 /nfs/dbraw/zinc/17/97/58/1199179758.db2.gz WGFXGFZJYPWHFG-BDAKNGLRSA-N 1 1 337.203 2.465 20 5 EEBDMO C[C@H](CO)[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H](C)O ZINC000809986023 1199179759 /nfs/dbraw/zinc/17/97/59/1199179759.db2.gz WGFXGFZJYPWHFG-BDAKNGLRSA-N 1 1 337.203 2.465 20 5 EEBDMO CC(C)[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCS1 ZINC000870894668 1200937836 /nfs/dbraw/zinc/93/78/36/1200937836.db2.gz BTLBENXYNAOJOK-HOCLYGCPSA-N 1 1 337.445 2.369 20 5 EEBDMO COC(=O)CC[C@@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000880040787 1201360347 /nfs/dbraw/zinc/36/03/47/1201360347.db2.gz KBXYEJGLMRAMHV-XJKSGUPXSA-N 1 1 336.388 2.293 20 5 EEBDMO CCO[C@@H]1C[C@@H](N(C)C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1(C)C ZINC000867944932 1201711687 /nfs/dbraw/zinc/71/16/87/1201711687.db2.gz LTYJEPXGTIPOBF-RKVPGOIHSA-N 1 1 349.431 2.431 20 5 EEBDMO O=[N+]([O-])c1c(F)nccc1NCc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000882171567 1201825925 /nfs/dbraw/zinc/82/59/25/1201825925.db2.gz FXYLDTGDPNYSIG-AWEZNQCLSA-N 1 1 346.362 2.308 20 5 EEBDMO Cc1nc(N2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n[nH]1 ZINC000931628758 1207428740 /nfs/dbraw/zinc/42/87/40/1207428740.db2.gz QNSRDNFPNSLRNO-LBPRGKRZSA-N 1 1 330.392 2.213 20 5 EEBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000778268597 1208027580 /nfs/dbraw/zinc/02/75/80/1208027580.db2.gz GGOVKRNLGCOGIW-LLVKDONJSA-N 1 1 349.416 2.204 20 5 EEBDMO CC1=CC[N@@H+](CCNC(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CC1 ZINC000935398388 1208145879 /nfs/dbraw/zinc/14/58/79/1208145879.db2.gz KCFVMHYBFJWFJN-IRXDYDNUSA-N 1 1 329.400 2.467 20 5 EEBDMO Cc1[nH+]ccn1CCCCOC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000778750654 1208343258 /nfs/dbraw/zinc/34/32/58/1208343258.db2.gz XFEJGCYWMKSVGL-UHFFFAOYSA-N 1 1 347.327 2.466 20 5 EEBDMO CCN(CCCNC(=O)Cn1cc[nH+]c1C)c1ccc([N+](=O)[O-])cc1 ZINC001095885974 1213990231 /nfs/dbraw/zinc/99/02/31/1213990231.db2.gz QHVYMVYNWRTXII-UHFFFAOYSA-N 1 1 345.403 2.133 20 5 EEBDMO O=[N+]([O-])c1ccnn1CN1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000795712001 1215000915 /nfs/dbraw/zinc/00/09/15/1215000915.db2.gz UJMIEXOFZDUECY-GOSISDBHSA-N 1 1 341.415 2.347 20 5 EEBDMO CCOC(=O)c1cnn(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000800865448 1234697650 /nfs/dbraw/zinc/69/76/50/1234697650.db2.gz CMYZNUOBNFVBFD-UHFFFAOYSA-N 1 1 332.360 2.100 20 5 EEBDMO CCOC(=O)c1cnn(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000800865448 1234697653 /nfs/dbraw/zinc/69/76/53/1234697653.db2.gz CMYZNUOBNFVBFD-UHFFFAOYSA-N 1 1 332.360 2.100 20 5 EEBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CC3CCCCCC3)C[C@@H]2C1 ZINC001048814656 1238720667 /nfs/dbraw/zinc/72/06/67/1238720667.db2.gz WJPNHCHZYHOVDM-YYIAUSFCSA-N 1 1 335.448 2.012 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@@H+](CC3CCCCCC3)C[C@@H]2C1 ZINC001048814656 1238720677 /nfs/dbraw/zinc/72/06/77/1238720677.db2.gz WJPNHCHZYHOVDM-YYIAUSFCSA-N 1 1 335.448 2.012 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CC3CCCCCC3)C[C@@H]2C1 ZINC001048814656 1238720689 /nfs/dbraw/zinc/72/06/89/1238720689.db2.gz WJPNHCHZYHOVDM-YYIAUSFCSA-N 1 1 335.448 2.012 20 5 EEBDMO CC1(C)OC[C@@H](CC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)O1 ZINC000851843477 1291880306 /nfs/dbraw/zinc/88/03/06/1291880306.db2.gz IEAGTEJACWLYSU-GXTWGEPZSA-N 1 1 336.392 2.018 20 5 EEBDMO CC(F)(F)C(=O)N1CC2(C1)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C2 ZINC001072391324 1295601402 /nfs/dbraw/zinc/60/14/02/1295601402.db2.gz CKKCNBZSPFJZJY-UHFFFAOYSA-N 1 1 339.342 2.284 20 5 EEBDMO C[N@H+]1[C@@H]2C[C@H](Oc3cc(=O)[nH]c4ccc([N+](=O)[O-])cc43)[C@H]1CC(=O)C2 ZINC001227217910 1301736017 /nfs/dbraw/zinc/73/60/17/1301736017.db2.gz AOKIOQRWZCNPOS-JJMVLAAESA-N 1 1 343.339 2.032 20 5 EEBDMO COC(=O)c1cc(Br)c(O)cc1O[C@@H](C)C[N+](C)(C)C ZINC001227360684 1301796490 /nfs/dbraw/zinc/79/64/90/1301796490.db2.gz YFYBSZCNOABRIX-VIFPVBQESA-O 1 1 347.229 2.415 20 5 EEBDMO CC(C)[N@H+]1CC[C@@H](Oc2ccc3c(c2)oc2cc(=O)ccc-2[n+]3[O-])C1 ZINC001227449414 1301832757 /nfs/dbraw/zinc/83/27/57/1301832757.db2.gz PTZKSMSOJIEAAU-OAHLLOKOSA-N 1 1 340.379 2.393 20 5 EEBDMO CC(C)[N@@H+]1CCC[C@H](Oc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC001228665205 1302368803 /nfs/dbraw/zinc/36/88/03/1302368803.db2.gz QFCBYDWRVLWEMX-LBPRGKRZSA-N 1 1 342.417 2.250 20 5 EEBDMO CC(C)[N@H+]1CCC[C@H](Oc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC001228665205 1302368814 /nfs/dbraw/zinc/36/88/14/1302368814.db2.gz QFCBYDWRVLWEMX-LBPRGKRZSA-N 1 1 342.417 2.250 20 5 EEBDMO COC(=O)c1cc(OC2CC[NH+](CCF)CC2)cc([N+](=O)[O-])c1 ZINC001228768904 1302430025 /nfs/dbraw/zinc/43/00/25/1302430025.db2.gz NCGZNGNNJXRUQD-UHFFFAOYSA-N 1 1 326.324 2.194 20 5 EEBDMO C[N@@H+](CCCNC(=O)c1ccccn1)Cc1ccccc1[N+](=O)[O-] ZINC001231183404 1303670689 /nfs/dbraw/zinc/67/06/89/1303670689.db2.gz ILXQLKWAOVTWMH-UHFFFAOYSA-N 1 1 328.372 2.242 20 5 EEBDMO C[N@@H+](CCCNC(=O)c1ccncc1)Cc1cccc([N+](=O)[O-])c1 ZINC001231197014 1303677395 /nfs/dbraw/zinc/67/73/95/1303677395.db2.gz XQTVLAKFPWZXFJ-UHFFFAOYSA-N 1 1 328.372 2.242 20 5 EEBDMO C[N@H+]1CC[C@@H]2CN(Cc3c(Br)cccc3[N+](=O)[O-])C[C@@H]21 ZINC001119789076 1309204056 /nfs/dbraw/zinc/20/40/56/1309204056.db2.gz RUGQMYRDCQZCJO-YGRLFVJLSA-N 1 1 340.221 2.493 20 5 EEBDMO COc1cccc(-c2noc([C@@H]([NH3+])Cc3ccc([N+](=O)[O-])cc3)n2)n1 ZINC001248212532 1310864754 /nfs/dbraw/zinc/86/47/54/1310864754.db2.gz TXIJZCDGRPAWLR-LBPRGKRZSA-N 1 1 341.327 2.291 20 5 EEBDMO CCN1CC[NH+](CC(C)(C)Nc2nc3ccccn3c2[N+](=O)[O-])CC1 ZINC000829493079 1314500019 /nfs/dbraw/zinc/50/00/19/1314500019.db2.gz KJAUHNFFWDOURK-UHFFFAOYSA-N 1 1 346.435 2.071 20 5 EEBDMO COCC[N@@H+]1[C@H](C)CN(Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@@H]1C ZINC000830075271 1314525506 /nfs/dbraw/zinc/52/55/06/1314525506.db2.gz YWYLHCHQSXRWPW-TXEJJXNPSA-N 1 1 343.374 2.414 20 5 EEBDMO C[C@H]1[C@H](CO)CCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000839668617 1315227960 /nfs/dbraw/zinc/22/79/60/1315227960.db2.gz DEBAEYVOHFRXGV-QWRGUYRKSA-N 1 1 341.795 2.280 20 5 EEBDMO C[C@H]1[C@H](CO)CCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000839668617 1315227963 /nfs/dbraw/zinc/22/79/63/1315227963.db2.gz DEBAEYVOHFRXGV-QWRGUYRKSA-N 1 1 341.795 2.280 20 5 EEBDMO C[NH+](C)[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000839727598 1315237446 /nfs/dbraw/zinc/23/74/46/1315237446.db2.gz CKELAYJVNFAVJC-UPJWGTAASA-N 1 1 345.321 2.090 20 5 EEBDMO Cc1[nH+]ccn1CCNC(F)(F)c1cnc(Cl)c([N+](=O)[O-])c1 ZINC001156001602 1317824790 /nfs/dbraw/zinc/82/47/90/1317824790.db2.gz AEKSMUCOPZPIQT-UHFFFAOYSA-N 1 1 331.710 2.487 20 5 EEBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CC([C@@H](N)C(=O)OC(C)(C)C)C1 ZINC001254550368 1318118149 /nfs/dbraw/zinc/11/81/49/1318118149.db2.gz ILMUJHFOBIZGIY-BLLLJJGKSA-N 1 1 349.431 2.127 20 5 EEBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CC([C@@H]([NH3+])C(=O)OC(C)(C)C)C1 ZINC001254550368 1318118162 /nfs/dbraw/zinc/11/81/62/1318118162.db2.gz ILMUJHFOBIZGIY-BLLLJJGKSA-N 1 1 349.431 2.127 20 5 EEBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCC(N2CCN(C)CC2)CC1 ZINC001254562354 1318122612 /nfs/dbraw/zinc/12/26/12/1318122612.db2.gz KVFJLTJQHVHYBA-INIZCTEOSA-N 1 1 346.475 2.238 20 5 EEBDMO Cc1cnc(N2CC[NH+]([C@@H](C)Cc3ccccc3[N+](=O)[O-])CC2)nc1 ZINC001254569708 1318124717 /nfs/dbraw/zinc/12/47/17/1318124717.db2.gz JYVZJPZHNFMCDM-HNNXBMFYSA-N 1 1 341.415 2.446 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CC(N3CCC(F)(F)CC3)C1)C2 ZINC001254603596 1318140708 /nfs/dbraw/zinc/14/07/08/1318140708.db2.gz OKQJBZGRXOJWML-HNNXBMFYSA-N 1 1 337.370 2.477 20 5 EEBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC([NH+]3CCC(F)(F)CC3)C1)C2 ZINC001254603596 1318140718 /nfs/dbraw/zinc/14/07/18/1318140718.db2.gz OKQJBZGRXOJWML-HNNXBMFYSA-N 1 1 337.370 2.477 20 5 EEBDMO COc1cc2ncnc(NCc3ccc(N)[nH+]c3C)c2cc1[N+](=O)[O-] ZINC001156981228 1318325808 /nfs/dbraw/zinc/32/58/08/1318325808.db2.gz VDTMQUAHQABXEN-UHFFFAOYSA-N 1 1 340.343 2.444 20 5 EEBDMO CN(C)/C=C/c1cc(N2C[C@H]3[C@H](C2)CCC[N@H+]3C)ncc1[N+](=O)[O-] ZINC001157272360 1318536762 /nfs/dbraw/zinc/53/67/62/1318536762.db2.gz MOFRIPRDGKOTJG-YKNXIFKJSA-N 1 1 331.420 2.053 20 5 EEBDMO COc1cc(N2CCC([N@H+]3CCC[C@H]3CO)CC2)ccc1[N+](=O)[O-] ZINC001256093951 1318646146 /nfs/dbraw/zinc/64/61/46/1318646146.db2.gz TUVIQJYXVUMSDN-HNNXBMFYSA-N 1 1 335.404 2.029 20 5 EEBDMO COC(=O)[C@H]1C[N@H+](C)CCN1c1ccc2ccc3cccnc3c2n1 ZINC001157770689 1318849867 /nfs/dbraw/zinc/84/98/67/1318849867.db2.gz PCCIUHSDCHYWBB-OAHLLOKOSA-N 1 1 336.395 2.076 20 5 EEBDMO COC(=O)[C@H]1C[N@@H+](C)CCN1c1ccc2ccc3cccnc3c2n1 ZINC001157770689 1318849877 /nfs/dbraw/zinc/84/98/77/1318849877.db2.gz PCCIUHSDCHYWBB-OAHLLOKOSA-N 1 1 336.395 2.076 20 5 EEBDMO CN1CCN(C(=[NH2+])Nc2ccc3c(ccc(Cl)c3[N+](=O)[O-])n2)CC1 ZINC001157915270 1318928235 /nfs/dbraw/zinc/92/82/35/1318928235.db2.gz OQLIDXWBRAHBGV-UHFFFAOYSA-N 1 1 348.794 2.390 20 5 EEBDMO COC(=O)c1cc([N+](=O)[O-])c(NCCn2cc[nH+]c2C)cc1OC ZINC001163929593 1321249704 /nfs/dbraw/zinc/24/97/04/1321249704.db2.gz RZWZYUJKIOBADJ-UHFFFAOYSA-N 1 1 334.332 2.007 20 5 EEBDMO CCOc1nc(N2CCC3(CC(N(C)C)=[NH+]O3)CC2)ccc1[N+](=O)[O-] ZINC001166034997 1321640304 /nfs/dbraw/zinc/64/03/04/1321640304.db2.gz NYURFYIKVDGEKB-UHFFFAOYSA-N 1 1 349.391 2.023 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]CCCC2CCCC2)CC1 ZINC001205223481 1322320081 /nfs/dbraw/zinc/32/00/81/1322320081.db2.gz CCRSGWMWXCKIJV-IAGOWNOFSA-N 1 1 337.464 2.450 20 5 EEBDMO CCOc1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)cc1OC ZINC001322271594 1333239776 /nfs/dbraw/zinc/23/97/76/1333239776.db2.gz DMUBNICQEGZSJX-UHFFFAOYSA-N 1 1 334.376 2.331 20 5 EEBDMO C[C@H](c1ccccn1)[N@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001609141675 1351858674 /nfs/dbraw/zinc/85/86/74/1351858674.db2.gz XHYXKCVVFKGLKN-LLVKDONJSA-N 1 1 339.359 2.363 20 5 EEBDMO C[C@H](c1ccccn1)[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001609141675 1351858675 /nfs/dbraw/zinc/85/86/75/1351858675.db2.gz XHYXKCVVFKGLKN-LLVKDONJSA-N 1 1 339.359 2.363 20 5 EEBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C2CC2)C[C@@H](C)C1 ZINC001330613421 1334877583 /nfs/dbraw/zinc/87/75/83/1334877583.db2.gz KUTWSRKCLXXWEP-GFCCVEGCSA-N 1 1 332.404 2.193 20 5 EEBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c(Br)c1 ZINC001330711077 1334889915 /nfs/dbraw/zinc/88/99/15/1334889915.db2.gz RJGONBFMTGMVCT-PHIMTYICSA-N 1 1 327.178 2.436 20 5 EEBDMO CC[N@@H+](CCC(=O)NC)Cc1ccc([N+](=O)[O-])cc1Br ZINC001333446016 1336048779 /nfs/dbraw/zinc/04/87/79/1336048779.db2.gz WNRASJWREZKSRL-UHFFFAOYSA-N 1 1 344.209 2.315 20 5 EEBDMO CC[N@H+](CCC(=O)NC)Cc1ccc([N+](=O)[O-])cc1Br ZINC001333446016 1336048777 /nfs/dbraw/zinc/04/87/77/1336048777.db2.gz WNRASJWREZKSRL-UHFFFAOYSA-N 1 1 344.209 2.315 20 5 EEBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001333603172 1336084764 /nfs/dbraw/zinc/08/47/64/1336084764.db2.gz ABTKHZZWXBVDKH-AWEZNQCLSA-N 1 1 332.404 2.493 20 5 EEBDMO C[N@H+]1CCCC[C@@H]1CNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC001337304892 1336680233 /nfs/dbraw/zinc/68/02/33/1336680233.db2.gz CHJYZYDYCUUMCS-MRXNPFEDSA-N 1 1 348.447 2.323 20 5 EEBDMO Cn1c2ccccc2c(N2CCC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1=O ZINC001342864925 1337323090 /nfs/dbraw/zinc/32/30/90/1337323090.db2.gz UUEYVYOHXVIKKL-CYBMUJFWSA-N 1 1 342.399 2.121 20 5 EEBDMO C[C@]([NH3+])(C(=O)NCC(=O)CC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC001576080101 1343963157 /nfs/dbraw/zinc/96/31/57/1343963157.db2.gz CAAMUTYWFSKPDU-GOSISDBHSA-N 1 1 347.415 2.424 20 5 EEBDMO Cn1nc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1C1CC1 ZINC001579996413 1344446483 /nfs/dbraw/zinc/44/64/83/1344446483.db2.gz AUESOXVLWJRZSM-INIZCTEOSA-N 1 1 329.360 2.018 20 5 EEBDMO C[C@H](c1cccc(-c2nn[nH]n2)c1)[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC001590046745 1349128445 /nfs/dbraw/zinc/12/84/45/1349128445.db2.gz NSFYNWWWGUPMPQ-LLVKDONJSA-N 1 1 339.359 2.363 20 5 EEBDMO C[C@H](c1cccc(-c2nn[nH]n2)c1)[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC001590046745 1349128452 /nfs/dbraw/zinc/12/84/52/1349128452.db2.gz NSFYNWWWGUPMPQ-LLVKDONJSA-N 1 1 339.359 2.363 20 5 EEBDMO C[C@@H](CNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC001590258908 1349234492 /nfs/dbraw/zinc/23/44/92/1349234492.db2.gz FOYNSIOUNSAPLF-NEPJUHHUSA-N 1 1 345.407 2.307 20 5 EEBDMO Cc1nn(CN2CC[C@H]([N@@H+](C)CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000853560079 1369350477 /nfs/dbraw/zinc/35/04/77/1369350477.db2.gz LJBGLIKEWQHEQT-KRWDZBQOSA-N 1 1 343.431 2.306 20 5 EEBDMO Cn1cc[nH+]c1CCNc1ncc(Br)cc1[N+](=O)[O-] ZINC000048552708 1369792721 /nfs/dbraw/zinc/79/27/21/1369792721.db2.gz IXRQUCWABAUUSC-UHFFFAOYSA-N 1 1 326.154 2.140 20 5 EEBDMO O=[N+]([O-])c1cccc(-c2ncn(C[NH+]3CCC4(CCO4)CC3)n2)c1 ZINC000799957504 1371685779 /nfs/dbraw/zinc/68/57/79/1371685779.db2.gz QUDTYWRSOYTAEP-UHFFFAOYSA-N 1 1 329.360 2.066 20 5 EEBDMO CC[N@H+]1CCC[C@@H](CNC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC001116536245 1371729720 /nfs/dbraw/zinc/72/97/20/1371729720.db2.gz GDQJFGSHJQOMIM-LBPRGKRZSA-N 1 1 336.392 2.457 20 5 EEBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CC1(F)F ZINC000835456298 1372625713 /nfs/dbraw/zinc/62/57/13/1372625713.db2.gz BNTCKIQLJANXHB-STQMWFEESA-N 1 1 326.299 2.368 20 5 EEBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CC1(F)F ZINC000835456298 1372625717 /nfs/dbraw/zinc/62/57/17/1372625717.db2.gz BNTCKIQLJANXHB-STQMWFEESA-N 1 1 326.299 2.368 20 5 EEBDMO CC[C@H]1C[N@@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])CCS1 ZINC001590521323 1403884693 /nfs/dbraw/zinc/88/46/93/1403884693.db2.gz CEQNNIQQKNAYJL-JTQLQIEISA-N 1 1 334.405 2.102 20 5 EEBDMO C[N@H+]1CCO[C@H]2CN(c3cc(Cl)nc4ccc([N+](=O)[O-])cc43)C[C@H]21 ZINC001164672376 719447965 /nfs/dbraw/zinc/44/79/65/719447965.db2.gz RCRRVLLXWPFLMA-CABCVRRESA-N 1 1 348.790 2.316 20 5 EEBDMO O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)c(F)c1 ZINC001164731338 720367578 /nfs/dbraw/zinc/36/75/78/720367578.db2.gz ZDLVBRHWYRHONT-HZPDHXFCSA-N 1 1 343.362 2.377 20 5 EEBDMO O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c(F)c1 ZINC001164731338 720367582 /nfs/dbraw/zinc/36/75/82/720367582.db2.gz ZDLVBRHWYRHONT-HZPDHXFCSA-N 1 1 343.362 2.377 20 5 EEBDMO O=C(NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)c1ccccc1O ZINC001031553818 769588963 /nfs/dbraw/zinc/58/89/63/769588963.db2.gz CJXGCXIJCWWKHI-UHFFFAOYSA-N 1 1 341.367 2.162 20 5 EEBDMO Cc1cc(C(=O)NCCC[N@@H+]2CCCC[C@@H]2C)c(N)c([N+](=O)[O-])c1 ZINC000068510766 774617319 /nfs/dbraw/zinc/61/73/19/774617319.db2.gz CITDBUIDXYPHEF-ZDUSSCGKSA-N 1 1 334.420 2.480 20 5 EEBDMO Cc1cc(NC(=N)NCCCC[NH3+])nc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001167880187 778969580 /nfs/dbraw/zinc/96/95/80/778969580.db2.gz BDVQMNXSTNKHEM-UHFFFAOYSA-N 1 1 343.391 2.035 20 5 EEBDMO O=C(Cc1ccco1)N1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000982325936 779730659 /nfs/dbraw/zinc/73/06/59/779730659.db2.gz VWZPDMVSAVEAMR-UHFFFAOYSA-N 1 1 343.383 2.465 20 5 EEBDMO O=C(Cc1ccco1)N1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000982325936 779730662 /nfs/dbraw/zinc/73/06/62/779730662.db2.gz VWZPDMVSAVEAMR-UHFFFAOYSA-N 1 1 343.383 2.465 20 5 EEBDMO CC(C)[N@@H+](C)C[C@@H](O)COc1cccc(Br)c1[N+](=O)[O-] ZINC000905981771 783615662 /nfs/dbraw/zinc/61/56/62/783615662.db2.gz ZAMYCHHSLXHMII-SNVBAGLBSA-N 1 1 347.209 2.437 20 5 EEBDMO CCC[N@H+]1CCC[C@@H](C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000906356490 783863264 /nfs/dbraw/zinc/86/32/64/783863264.db2.gz WGFWNFBTQBRDBN-CQSZACIVSA-N 1 1 335.404 2.342 20 5 EEBDMO Cc1cc(C[NH2+]CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1 ZINC000997772191 791043115 /nfs/dbraw/zinc/04/31/15/791043115.db2.gz LYUYKEWZFLQOAD-HUUCEWRRSA-N 1 1 337.445 2.050 20 5 EEBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C[NH+](CC3CC4(CCC4)C3)C2)CC1 ZINC001035706040 784987614 /nfs/dbraw/zinc/98/76/14/784987614.db2.gz DWGMWFVPXNGDFX-HZPDHXFCSA-N 1 1 347.459 2.156 20 5 EEBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000820728709 786439914 /nfs/dbraw/zinc/43/99/14/786439914.db2.gz OUAUOKFLTHYELT-QMMMGPOBSA-N 1 1 344.774 2.136 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000820728709 786439921 /nfs/dbraw/zinc/43/99/21/786439921.db2.gz OUAUOKFLTHYELT-QMMMGPOBSA-N 1 1 344.774 2.136 20 5 EEBDMO CC[N@H+]1CCCN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000910280500 786611270 /nfs/dbraw/zinc/61/12/70/786611270.db2.gz BRFZMTGUFXLKBG-JTQLQIEISA-N 1 1 349.416 2.156 20 5 EEBDMO CC[C@H]1C[N@@H+](C)CCN1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000823194972 787613951 /nfs/dbraw/zinc/61/39/51/787613951.db2.gz LBUCIYVGFJTDQS-LBPRGKRZSA-N 1 1 338.383 2.089 20 5 EEBDMO CC[C@H]1CN(C)CC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000823194972 787613958 /nfs/dbraw/zinc/61/39/58/787613958.db2.gz LBUCIYVGFJTDQS-LBPRGKRZSA-N 1 1 338.383 2.089 20 5 EEBDMO CC[C@H]1CN(C)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000823194972 787613965 /nfs/dbraw/zinc/61/39/65/787613965.db2.gz LBUCIYVGFJTDQS-LBPRGKRZSA-N 1 1 338.383 2.089 20 5 EEBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)c1 ZINC000913290761 788767383 /nfs/dbraw/zinc/76/73/83/788767383.db2.gz REKULFREBUPGSY-CALCHBBNSA-N 1 1 333.388 2.017 20 5 EEBDMO CC[N@@H+](CCCNC(=O)c1cc([N+](=O)[O-])cnc1N)C1CCCCC1 ZINC000846368215 790155811 /nfs/dbraw/zinc/15/58/11/790155811.db2.gz FCYMXXNYMJWRRX-UHFFFAOYSA-N 1 1 349.435 2.347 20 5 EEBDMO CC[N@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)CC(C)C ZINC000172171317 791568308 /nfs/dbraw/zinc/56/83/08/791568308.db2.gz MLZYFUIOWNWQLM-UHFFFAOYSA-N 1 1 348.447 2.221 20 5 EEBDMO CC(=O)N1CC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C[C@@H]1C ZINC001172922207 797152821 /nfs/dbraw/zinc/15/28/21/797152821.db2.gz XHOGJYFTCNGBDM-GUYCJALGSA-N 1 1 331.416 2.395 20 5 EEBDMO COC(=O)[C@H]1CC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173182401 797280069 /nfs/dbraw/zinc/28/00/69/797280069.db2.gz ROTPVNMUMVSQJD-QWRGUYRKSA-N 1 1 340.351 2.168 20 5 EEBDMO CCC[N@@H+](C)CC(=O)N1CCC(Nc2ncc(C)cc2[N+](=O)[O-])CC1 ZINC001095233897 797566560 /nfs/dbraw/zinc/56/65/60/797566560.db2.gz YDLOTXIKDFWFON-UHFFFAOYSA-N 1 1 349.435 2.043 20 5 EEBDMO CCC[N@@H+](C)CCC(=O)NCC1(Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC001110191292 798280650 /nfs/dbraw/zinc/28/06/50/798280650.db2.gz NWWCPXPXAJSIGY-UHFFFAOYSA-N 1 1 334.420 2.387 20 5 EEBDMO C[N@H+]1CC[C@H]1CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000922226847 799956147 /nfs/dbraw/zinc/95/61/47/799956147.db2.gz ZGXVGDDBZNZQBB-NSHDSACASA-N 1 1 346.309 2.117 20 5 EEBDMO O=C(NC[C@H]1C[C@@H]([NH2+]CCC2CCCCCC2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086084586 802116545 /nfs/dbraw/zinc/11/65/45/802116545.db2.gz WWWDKHOUMFWKKB-YYIAUSFCSA-N 1 1 337.464 2.497 20 5 EEBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CC[C@H]3O[C@@H](COCC4CC4)CC[C@H]32)C1 ZINC001169020583 803587635 /nfs/dbraw/zinc/58/76/35/803587635.db2.gz JKCNCBRYRNQLFI-YYWYGQEZSA-N 1 1 338.448 2.480 20 5 EEBDMO COCC[C@@H]1CO[C@@]2(C1)CCC[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169022225 803588368 /nfs/dbraw/zinc/58/83/68/803588368.db2.gz QWRZCNJRMGTTJB-YYIAUSFCSA-N 1 1 326.437 2.339 20 5 EEBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCCn3cnc(Cn4cccc4)c3C2)C1 ZINC001169026419 803591921 /nfs/dbraw/zinc/59/19/21/803591921.db2.gz WSWDPBGKQGFKJE-HZPDHXFCSA-N 1 1 343.431 2.384 20 5 EEBDMO CC[N@H+]1CCC[C@H]1CNC(=S)NCc1cccc([N+](=O)[O-])c1C ZINC000790333164 808628020 /nfs/dbraw/zinc/62/80/20/808628020.db2.gz KKIXLZMEHYINIX-AWEZNQCLSA-N 1 1 336.461 2.352 20 5 EEBDMO COc1ccc(C[C@@H](C)[N@@H+](C)C2CCN(C(C)=O)CC2)c([N+](=O)[O-])c1 ZINC001170346552 809916869 /nfs/dbraw/zinc/91/68/69/809916869.db2.gz ODMUUMMKWCPJKX-CYBMUJFWSA-N 1 1 349.431 2.477 20 5 EEBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H](n3ccnn3)C2)c([N+](=O)[O-])c1 ZINC001170351418 809920163 /nfs/dbraw/zinc/92/01/63/809920163.db2.gz BYRLOGVSWHKPDX-DZGCQCFKSA-N 1 1 345.403 2.463 20 5 EEBDMO