smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCC(=O)N1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC001569873153 1085703079 /nfs/dbraw/zinc/70/30/79/1085703079.db2.gz ZKAHGJCDUAXFLC-IYBDPMFKSA-N 1 1 331.416 2.675 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)C=C1CCC1 ZINC001570194964 1086042601 /nfs/dbraw/zinc/04/26/01/1086042601.db2.gz FGLAZULFROKXOG-UHFFFAOYSA-N 1 1 331.416 2.985 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccn(C)c1 ZINC001570195909 1086045978 /nfs/dbraw/zinc/04/59/78/1086045978.db2.gz YVPVRAJGGGUZRZ-UHFFFAOYSA-N 1 1 344.415 2.527 10 5 EFBEMO CC/C=C\CC[N@H+]1Cc2ccc(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2C1 ZINC001570310968 1086139772 /nfs/dbraw/zinc/13/97/72/1086139772.db2.gz LWCGAHFJYZMJIU-GRFNRIFCSA-N 1 1 343.427 2.640 10 5 EFBEMO CC/C=C\CC[N@@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1 ZINC001570310968 1086139776 /nfs/dbraw/zinc/13/97/76/1086139776.db2.gz LWCGAHFJYZMJIU-GRFNRIFCSA-N 1 1 343.427 2.640 10 5 EFBEMO CC/C=C\CC[N@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1 ZINC001570310968 1086139779 /nfs/dbraw/zinc/13/97/79/1086139779.db2.gz LWCGAHFJYZMJIU-GRFNRIFCSA-N 1 1 343.427 2.640 10 5 EFBEMO C[C@@H](CO)[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001647591423 1089587147 /nfs/dbraw/zinc/58/71/47/1089587147.db2.gz ZSPMTPSSSGPUHT-GXTWGEPZSA-N 1 1 346.387 2.628 10 5 EFBEMO C[C@@H]1CCC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])[C@@H]1CO ZINC001647909833 1089907720 /nfs/dbraw/zinc/90/77/20/1089907720.db2.gz JQSWMTVCNMVFEA-QMTHXVAHSA-N 1 1 343.221 2.950 10 5 EFBEMO C[C@@H]1CCC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])[C@@H]1CO ZINC001647909833 1089907739 /nfs/dbraw/zinc/90/77/39/1089907739.db2.gz JQSWMTVCNMVFEA-QMTHXVAHSA-N 1 1 343.221 2.950 10 5 EFBEMO Cc1ccc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cc1[N+](=O)[O-] ZINC001648020501 1089932797 /nfs/dbraw/zinc/93/27/97/1089932797.db2.gz UTPABNVIBHFMIB-KRWDZBQOSA-N 1 1 345.355 2.809 10 5 EFBEMO CC[NH+](CC)CC[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccccc1 ZINC001648042318 1089934349 /nfs/dbraw/zinc/93/43/49/1089934349.db2.gz PQVNRVJUBGBKKC-CQSZACIVSA-N 1 1 345.403 2.521 10 5 EFBEMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ncccn3)CC2)c([N+](=O)[O-])c1 ZINC001648374470 1092208523 /nfs/dbraw/zinc/20/85/23/1092208523.db2.gz DFWLQSDTKJHOPP-UHFFFAOYSA-N 1 1 343.343 2.673 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCCC[C@H]2[C@H]2CCCO2)c1 ZINC001648617755 1092240103 /nfs/dbraw/zinc/24/01/03/1092240103.db2.gz VVUXQVUPZKVWOO-DLBZAZTESA-N 1 1 348.399 2.915 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@H]2[C@H]2CCCO2)c1 ZINC001648617755 1092240117 /nfs/dbraw/zinc/24/01/17/1092240117.db2.gz VVUXQVUPZKVWOO-DLBZAZTESA-N 1 1 348.399 2.915 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)OCC[C@H]1C ZINC001648641688 1092242248 /nfs/dbraw/zinc/24/22/48/1092242248.db2.gz IKUWDKUAQMWCLB-ZIAGYGMSSA-N 1 1 335.404 2.731 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCCC[C@@]23CCOC3)cccc1[N+](=O)[O-] ZINC001648641559 1092243003 /nfs/dbraw/zinc/24/30/03/1092243003.db2.gz DDAIUTXPFHEKEP-SFHVURJKSA-N 1 1 347.415 2.877 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCN(c2cnccn2)[C@H](C)C1 ZINC001648665067 1092250139 /nfs/dbraw/zinc/25/01/39/1092250139.db2.gz HPDNEFNCXCIHJW-HUUCEWRRSA-N 1 1 341.415 2.965 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCN(c2cnccn2)[C@H](C)C1 ZINC001648665067 1092250149 /nfs/dbraw/zinc/25/01/49/1092250149.db2.gz HPDNEFNCXCIHJW-HUUCEWRRSA-N 1 1 341.415 2.965 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC001587990220 1092879869 /nfs/dbraw/zinc/87/98/69/1092879869.db2.gz KSVQTKBRFVZSBR-UONOGXRCSA-N 1 1 347.415 2.550 10 5 EFBEMO CCCc1[nH]ccc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001267211873 1093210729 /nfs/dbraw/zinc/21/07/29/1093210729.db2.gz VAJWDXIDCNGAOS-UHFFFAOYSA-N 1 1 344.415 2.737 10 5 EFBEMO CCCc1[nH]ccc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001267211873 1093210734 /nfs/dbraw/zinc/21/07/34/1093210734.db2.gz VAJWDXIDCNGAOS-UHFFFAOYSA-N 1 1 344.415 2.737 10 5 EFBEMO CC[N@@H+](CCNC(=O)/C=C\c1ccc[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC001267240584 1093336996 /nfs/dbraw/zinc/33/69/96/1093336996.db2.gz QZZHBTSWQYGANC-HJWRWDBZSA-N 1 1 342.399 2.574 10 5 EFBEMO CCC[N@H+]1CC[C@H](CNc2c3cc(F)ccc3ncc2[N+](=O)[O-])C1 ZINC001650677152 1093481996 /nfs/dbraw/zinc/48/19/96/1093481996.db2.gz TWQQTRDXYQTFJH-GFCCVEGCSA-N 1 1 332.379 2.848 10 5 EFBEMO O=[N+]([O-])c1ccc(C(F)(F)F)cc1NC[C@@H]1CCC[N@@H+]1CCCO ZINC001651087445 1093525769 /nfs/dbraw/zinc/52/57/69/1093525769.db2.gz JLKZOOFNTHFNAZ-LBPRGKRZSA-N 1 1 347.337 2.872 10 5 EFBEMO Cc1[nH]c(CNC(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)c(C)[nH+]1 ZINC001596960281 1094555375 /nfs/dbraw/zinc/55/53/75/1094555375.db2.gz UFEIOADMKYAKFK-UHFFFAOYSA-N 1 1 339.355 2.600 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1ccc[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC001481130099 1094883173 /nfs/dbraw/zinc/88/31/73/1094883173.db2.gz KGUAYEGKEYHRAP-UHFFFAOYSA-N 1 1 330.388 2.565 10 5 EFBEMO Cc1ccc(C(=O)NCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC001481156710 1095032171 /nfs/dbraw/zinc/03/21/71/1095032171.db2.gz AYPRUJGOXKAQHL-UHFFFAOYSA-N 1 1 343.383 2.891 10 5 EFBEMO CCC(C)(C)CC(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001267684378 1095445436 /nfs/dbraw/zinc/44/54/36/1095445436.db2.gz WAADSHHJWUWDBQ-UHFFFAOYSA-N 1 1 333.432 2.969 10 5 EFBEMO CC(C)(CC(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)C1CC1 ZINC001481623525 1095847572 /nfs/dbraw/zinc/84/75/72/1095847572.db2.gz SSMVYMSKWZCWIO-UHFFFAOYSA-N 1 1 345.443 2.969 10 5 EFBEMO Cc1cccc(C(=O)N(C)CC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001268231167 1096138788 /nfs/dbraw/zinc/13/87/88/1096138788.db2.gz XTNKFRRUABBNJU-UHFFFAOYSA-N 1 1 342.399 2.502 10 5 EFBEMO Cc1cnccc1C(=O)N(C)CC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001268235334 1096146366 /nfs/dbraw/zinc/14/63/66/1096146366.db2.gz IDTYPMOXAFINDJ-UHFFFAOYSA-N 1 1 342.399 2.502 10 5 EFBEMO Cc1cnccc1C(=O)N(C)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001268235334 1096146369 /nfs/dbraw/zinc/14/63/69/1096146369.db2.gz IDTYPMOXAFINDJ-UHFFFAOYSA-N 1 1 342.399 2.502 10 5 EFBEMO Cc1cc(C(=O)N(C)CC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)ns1 ZINC001268236421 1096150696 /nfs/dbraw/zinc/15/06/96/1096150696.db2.gz XLCIUKCXORDPFK-UHFFFAOYSA-N 1 1 348.428 2.564 10 5 EFBEMO CC(F)(F)CCC(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001268844657 1097680688 /nfs/dbraw/zinc/68/06/88/1097680688.db2.gz WBECTJYNVASYEN-UHFFFAOYSA-N 1 1 341.358 2.578 10 5 EFBEMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC001611860556 1099035655 /nfs/dbraw/zinc/03/56/55/1099035655.db2.gz GPXBIHFRYCDHGX-ZJUUUORDSA-N 1 1 349.357 2.879 10 5 EFBEMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC001611860554 1099035945 /nfs/dbraw/zinc/03/59/45/1099035945.db2.gz GPXBIHFRYCDHGX-UWVGGRQHSA-N 1 1 349.357 2.879 10 5 EFBEMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2c(Cl)cncc2[N+](=O)[O-])C1 ZINC001611908495 1099038238 /nfs/dbraw/zinc/03/82/38/1099038238.db2.gz HXCCQXVCPNHSHC-LLVKDONJSA-N 1 1 326.828 2.988 10 5 EFBEMO CC[N@H+]1CCN(c2c3cc(OC)ccc3ncc2[N+](=O)[O-])C[C@H]1C ZINC001612145766 1099046503 /nfs/dbraw/zinc/04/65/03/1099046503.db2.gz XBWPIJXFTJQJEI-GFCCVEGCSA-N 1 1 330.388 2.682 10 5 EFBEMO COC(=O)[C@@H]([NH2+]CCCNc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC001612422850 1099057070 /nfs/dbraw/zinc/05/70/70/1099057070.db2.gz INJIIVOZELSYHB-AWEZNQCLSA-N 1 1 343.811 2.837 10 5 EFBEMO Cc1[nH+]ccn1CCNc1c2cc(Cl)ccc2ncc1[N+](=O)[O-] ZINC001612820228 1099079563 /nfs/dbraw/zinc/07/95/63/1099079563.db2.gz WVHIGZCTOPSMLX-UHFFFAOYSA-N 1 1 331.763 2.835 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@@H]1C[NH+]2CCC1CC2 ZINC001613060057 1099088453 /nfs/dbraw/zinc/08/84/53/1099088453.db2.gz DRVARDJGIMKCIC-CYBMUJFWSA-N 1 1 339.779 2.541 10 5 EFBEMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CCOc1ccc3c(c1)OCO3)CC2 ZINC001615847058 1099165943 /nfs/dbraw/zinc/16/59/43/1099165943.db2.gz WIHYLFOPDMOEIK-UHFFFAOYSA-N 1 1 342.351 2.761 10 5 EFBEMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCOc1ccc3c(c1)OCO3)CC2 ZINC001615847058 1099165946 /nfs/dbraw/zinc/16/59/46/1099165946.db2.gz WIHYLFOPDMOEIK-UHFFFAOYSA-N 1 1 342.351 2.761 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CC[C@@H](O)C23CCCC3)o1 ZINC001618233666 1099286569 /nfs/dbraw/zinc/28/65/69/1099286569.db2.gz ATELCACLCLLFQA-CQSZACIVSA-N 1 1 344.371 2.524 10 5 EFBEMO COCC[N@H+]1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])C(C)(C)C1 ZINC001619457536 1099328525 /nfs/dbraw/zinc/32/85/25/1099328525.db2.gz TYFVIUDRHBFXIR-UHFFFAOYSA-N 1 1 341.839 2.791 10 5 EFBEMO COc1cccc(C[NH+]2CCN(Cc3csc([N+](=O)[O-])c3)CC2)c1 ZINC001620513146 1099355649 /nfs/dbraw/zinc/35/56/49/1099355649.db2.gz XOSPHWDHGAJPAN-UHFFFAOYSA-N 1 1 347.440 2.983 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@]12CCC[C@H]1OCC2 ZINC001620680747 1099370964 /nfs/dbraw/zinc/37/09/64/1099370964.db2.gz OPHBGQDMHXSPAE-MZMPZRCHSA-N 1 1 347.415 2.813 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC001625590995 1099830517 /nfs/dbraw/zinc/83/05/17/1099830517.db2.gz RSTMXPHYSAVGEP-DGCLKSJQSA-N 1 1 337.395 2.893 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NCCn1cc[nH+]c1C(C)C ZINC001627379025 1099987936 /nfs/dbraw/zinc/98/79/36/1099987936.db2.gz IOLKYRKPOGKVIS-UHFFFAOYSA-N 1 1 346.387 2.743 10 5 EFBEMO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC001630560254 1100317705 /nfs/dbraw/zinc/31/77/05/1100317705.db2.gz JVTDHJPXCMKRCS-OAHLLOKOSA-N 1 1 339.823 2.985 10 5 EFBEMO CC(C)[N@H+]1CCC[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001630936593 1100355573 /nfs/dbraw/zinc/35/55/73/1100355573.db2.gz XDTNRAWBGGJCPT-HNNXBMFYSA-N 1 1 331.416 2.600 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC001631057445 1100365250 /nfs/dbraw/zinc/36/52/50/1100365250.db2.gz NPHHVNMRIAFYMZ-ZIAGYGMSSA-N 1 1 349.431 2.844 10 5 EFBEMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC001634684846 1100624358 /nfs/dbraw/zinc/62/43/58/1100624358.db2.gz CMDKQYBLUULLEN-SUMWQHHRSA-N 1 1 342.399 2.563 10 5 EFBEMO CCc1[nH+]ccn1CCNC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC001637863214 1100812363 /nfs/dbraw/zinc/81/23/63/1100812363.db2.gz FDZKBSNFHBKQNS-UHFFFAOYSA-N 1 1 330.388 2.907 10 5 EFBEMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@@H+](C)CC1(C)C ZINC001639136348 1100918191 /nfs/dbraw/zinc/91/81/91/1100918191.db2.gz VZBGYMHDENNEBH-CQSZACIVSA-N 1 1 337.445 2.777 10 5 EFBEMO CC[N@H+]1C[C@H](NC(=O)c2cccc(Cl)c2[N+](=O)[O-])C(C)(C)C1 ZINC001639266955 1100931308 /nfs/dbraw/zinc/93/13/08/1100931308.db2.gz RCFMIRXHKBGWQR-LBPRGKRZSA-N 1 1 325.796 2.708 10 5 EFBEMO COCC[N@H+]1CC[C@@H](Nc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC001639489451 1100955507 /nfs/dbraw/zinc/95/55/07/1100955507.db2.gz PUPUFBOINZJTMJ-LLVKDONJSA-N 1 1 333.310 2.746 10 5 EFBEMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC001642247909 1101202112 /nfs/dbraw/zinc/20/21/12/1101202112.db2.gz JCHOWRHLBCSQGS-CYBMUJFWSA-N 1 1 330.363 2.600 10 5 EFBEMO C[N@H+](CCc1ccccn1)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001642293617 1101204159 /nfs/dbraw/zinc/20/41/59/1101204159.db2.gz FATJKFBAJJKAMC-UHFFFAOYSA-N 1 1 339.355 2.714 10 5 EFBEMO C[N@@H+](CCc1ccccn1)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001642293617 1101204161 /nfs/dbraw/zinc/20/41/61/1101204161.db2.gz FATJKFBAJJKAMC-UHFFFAOYSA-N 1 1 339.355 2.714 10 5 EFBEMO O=C(c1cc(F)ccc1[N+](=O)[O-])N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001642844062 1101248296 /nfs/dbraw/zinc/24/82/96/1101248296.db2.gz ZPHNBKNWAANUQX-OAHLLOKOSA-N 1 1 329.331 2.521 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N[C@H]2CCC[N@@H+](CC)C2)cc1C ZINC001643240397 1101283606 /nfs/dbraw/zinc/28/36/06/1101283606.db2.gz DMJWYGPUWKBESP-ZDUSSCGKSA-N 1 1 335.404 2.976 10 5 EFBEMO COc1ccc2ncc([N+](=O)[O-])c(N3C[C@H]4C[N@@H+](C)C[C@@]4(C)C3)c2c1 ZINC001643251778 1101284553 /nfs/dbraw/zinc/28/45/53/1101284553.db2.gz QWUOMDLAQVAVJU-XIKOKIGWSA-N 1 1 342.399 2.540 10 5 EFBEMO CC(C)c1ccccc1C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CC1 ZINC001266592555 1101315066 /nfs/dbraw/zinc/31/50/66/1101315066.db2.gz SUZAPNJHTRGZHI-QZTJIDSGSA-N 1 1 345.443 2.556 10 5 EFBEMO CC(C)c1ccccc1C[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CC1 ZINC001266592555 1101315081 /nfs/dbraw/zinc/31/50/81/1101315081.db2.gz SUZAPNJHTRGZHI-QZTJIDSGSA-N 1 1 345.443 2.556 10 5 EFBEMO CC(C)c1ccccc1C[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CC1 ZINC001266592555 1101315095 /nfs/dbraw/zinc/31/50/95/1101315095.db2.gz SUZAPNJHTRGZHI-QZTJIDSGSA-N 1 1 345.443 2.556 10 5 EFBEMO O=[N+]([O-])c1ccc(C(F)(F)F)cc1N1CC[N@@H+]2C[C@@H](F)C[C@H]2C1 ZINC001651486980 1101335640 /nfs/dbraw/zinc/33/56/40/1101335640.db2.gz FRXONNQNWGIYCH-QWRGUYRKSA-N 1 1 333.285 2.846 10 5 EFBEMO O=[N+]([O-])c1ccc(C(F)(F)F)cc1N1CC[N@H+]2C[C@@H](F)C[C@H]2C1 ZINC001651486980 1101335652 /nfs/dbraw/zinc/33/56/52/1101335652.db2.gz FRXONNQNWGIYCH-QWRGUYRKSA-N 1 1 333.285 2.846 10 5 EFBEMO C[N@H+]1C[C@@H]2CC[C@@H](Nc3c4cc(Cl)ccc4ncc3[N+](=O)[O-])[C@H]2C1 ZINC001651524798 1101341497 /nfs/dbraw/zinc/34/14/97/1101341497.db2.gz FMQRKYSLEZLEGZ-VZJVUDMVSA-N 1 1 346.818 2.970 10 5 EFBEMO CC[C@@H]1[C@@H](C(=O)N2CCCCc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C ZINC001167396954 1101440255 /nfs/dbraw/zinc/44/02/55/1101440255.db2.gz IDHQKNPHKCRZMX-JKSUJKDBSA-N 1 1 331.416 2.994 10 5 EFBEMO CCc1[nH+]ccn1CCNc1cc(C)c([N+](=O)[O-])cc1C(=O)OC ZINC001652231318 1101457054 /nfs/dbraw/zinc/45/70/54/1101457054.db2.gz ISACSCCAKCNMQL-UHFFFAOYSA-N 1 1 332.360 2.561 10 5 EFBEMO Cc1ccc(NCCNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])[nH+]c1 ZINC001652428961 1101490464 /nfs/dbraw/zinc/49/04/64/1101490464.db2.gz VXCSGMDFSVNXGF-UHFFFAOYSA-N 1 1 334.763 2.794 10 5 EFBEMO CCc1[nH]nc(C(=O)Nc2cc[nH+]c(N3CCCCC3)c2)c1[N+](=O)[O-] ZINC001652879870 1101560078 /nfs/dbraw/zinc/56/00/78/1101560078.db2.gz JQPZMCXKTCQTKL-UHFFFAOYSA-N 1 1 344.375 2.518 10 5 EFBEMO C[N@H+](CCNC(=O)C1(F)CCCCC1)Cc1ccccc1[N+](=O)[O-] ZINC001266345104 1101634482 /nfs/dbraw/zinc/63/44/82/1101634482.db2.gz UTWFSKYDDULPIE-UHFFFAOYSA-N 1 1 337.395 2.815 10 5 EFBEMO C[N@@H+](CCNC(=O)C1(F)CCCCC1)Cc1ccccc1[N+](=O)[O-] ZINC001266345104 1101634487 /nfs/dbraw/zinc/63/44/87/1101634487.db2.gz UTWFSKYDDULPIE-UHFFFAOYSA-N 1 1 337.395 2.815 10 5 EFBEMO C[N@H+](CCNC(=O)c1ccc(Cl)cn1)Cc1ccccc1[N+](=O)[O-] ZINC001266350325 1101663121 /nfs/dbraw/zinc/66/31/21/1101663121.db2.gz KVXWJJJRMUIXNO-UHFFFAOYSA-N 1 1 348.790 2.505 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccc(Cl)cn1)Cc1ccccc1[N+](=O)[O-] ZINC001266350325 1101663124 /nfs/dbraw/zinc/66/31/24/1101663124.db2.gz KVXWJJJRMUIXNO-UHFFFAOYSA-N 1 1 348.790 2.505 10 5 EFBEMO CC[N@@H+](C)[C@H]1CCN(C(=O)c2cc(Cl)c(C)cc2[N+](=O)[O-])C1 ZINC001654030265 1101671327 /nfs/dbraw/zinc/67/13/27/1101671327.db2.gz IVHZGQOZBHDODU-NSHDSACASA-N 1 1 325.796 2.723 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2Cc3c[nH]nc3[C@H](C)C2)cccc1[N+](=O)[O-] ZINC001654466427 1101721042 /nfs/dbraw/zinc/72/10/42/1101721042.db2.gz YYUPOHOWRFCMLH-LLVKDONJSA-N 1 1 343.387 2.574 10 5 EFBEMO C[C@@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)CCO1 ZINC001655120658 1101788424 /nfs/dbraw/zinc/78/84/24/1101788424.db2.gz UGQJLOXSFAWFME-VXGBXAGGSA-N 1 1 332.360 2.644 10 5 EFBEMO C[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)CCO1 ZINC001655120658 1101788435 /nfs/dbraw/zinc/78/84/35/1101788435.db2.gz UGQJLOXSFAWFME-VXGBXAGGSA-N 1 1 332.360 2.644 10 5 EFBEMO C[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)[C@@H]1CO ZINC001655214904 1101795468 /nfs/dbraw/zinc/79/54/68/1101795468.db2.gz VGRGXOTTXOTVPW-QMTHXVAHSA-N 1 1 343.221 2.950 10 5 EFBEMO C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)[C@@H]1CO ZINC001655214904 1101795480 /nfs/dbraw/zinc/79/54/80/1101795480.db2.gz VGRGXOTTXOTVPW-QMTHXVAHSA-N 1 1 343.221 2.950 10 5 EFBEMO Cc1nc([C@H]2CCC[N@@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)[nH]c1C ZINC001655569162 1101849022 /nfs/dbraw/zinc/84/90/22/1101849022.db2.gz LOSPBNRRSGGFOY-CVEARBPZSA-N 1 1 330.388 2.805 10 5 EFBEMO Cc1nc([C@H]2CCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)[nH]c1C ZINC001655569162 1101849039 /nfs/dbraw/zinc/84/90/39/1101849039.db2.gz LOSPBNRRSGGFOY-CVEARBPZSA-N 1 1 330.388 2.805 10 5 EFBEMO C[C@@]12CSC[C@@H]1C[N@@H+](Cc1nnc(-c3ccccc3[N+](=O)[O-])o1)C2 ZINC001655813179 1101894609 /nfs/dbraw/zinc/89/46/09/1101894609.db2.gz MQZYGWSYNFWAHY-MEDUHNTESA-N 1 1 346.412 2.830 10 5 EFBEMO Cc1c(Cl)cccc1N1CC[NH+](CCn2cc([N+](=O)[O-])cn2)CC1 ZINC001655832812 1101898507 /nfs/dbraw/zinc/89/85/07/1101898507.db2.gz PJPWTIFBYRRGBV-UHFFFAOYSA-N 1 1 349.822 2.575 10 5 EFBEMO CCc1[nH+]ccn1CCNc1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] ZINC001655850544 1101900661 /nfs/dbraw/zinc/90/06/61/1101900661.db2.gz MCUFYBGCOVBQAJ-FNORWQNLSA-N 1 1 344.371 2.652 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN(Cc2ccnn2C)CC1 ZINC001655895000 1101908914 /nfs/dbraw/zinc/90/89/14/1101908914.db2.gz RPDMDHODVQBHIV-HNNXBMFYSA-N 1 1 343.431 2.516 10 5 EFBEMO C[N@H+]1CCN(Cc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC001659280057 1102530543 /nfs/dbraw/zinc/53/05/43/1102530543.db2.gz ATEISEXRQRYKMN-IBGZPJMESA-N 1 1 325.412 2.954 10 5 EFBEMO CN1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC001659280057 1102530555 /nfs/dbraw/zinc/53/05/55/1102530555.db2.gz ATEISEXRQRYKMN-IBGZPJMESA-N 1 1 325.412 2.954 10 5 EFBEMO CN1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC001659280057 1102530563 /nfs/dbraw/zinc/53/05/63/1102530563.db2.gz ATEISEXRQRYKMN-IBGZPJMESA-N 1 1 325.412 2.954 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@@H+]1CCC[C@H](C)C1 ZINC000588445207 1102545151 /nfs/dbraw/zinc/54/51/51/1102545151.db2.gz HDRMMMTYBLMIRF-UZFBZYOGSA-N 1 1 331.416 2.846 10 5 EFBEMO CC[N@H+]1CCCC[C@@H]1CNC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588445633 1102550760 /nfs/dbraw/zinc/55/07/60/1102550760.db2.gz ZNXPVFKYKFJHGP-BHEFUSTPSA-N 1 1 331.416 2.989 10 5 EFBEMO CC[N@H+]1CCCC[C@H]1CNC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588445632 1102551693 /nfs/dbraw/zinc/55/16/93/1102551693.db2.gz ZNXPVFKYKFJHGP-AINHQSCGSA-N 1 1 331.416 2.989 10 5 EFBEMO Cc1cnccc1C(=O)NCCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001660125352 1102607912 /nfs/dbraw/zinc/60/79/12/1102607912.db2.gz CEOLPOPECAXGNU-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@H](c3cnccn3)C2)c([N+](=O)[O-])cc1F ZINC001660351644 1102700720 /nfs/dbraw/zinc/70/07/20/1102700720.db2.gz GANWOZRYEOLZFZ-NSHDSACASA-N 1 1 332.335 2.522 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@H](c3cnccn3)C2)c([N+](=O)[O-])cc1F ZINC001660351644 1102700727 /nfs/dbraw/zinc/70/07/27/1102700727.db2.gz GANWOZRYEOLZFZ-NSHDSACASA-N 1 1 332.335 2.522 10 5 EFBEMO O=C1[C@H]([NH+]2CCC(F)(C3CC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC001660474710 1102781791 /nfs/dbraw/zinc/78/17/91/1102781791.db2.gz RKGZSJGBDZRXBG-MRXNPFEDSA-N 1 1 347.390 2.914 10 5 EFBEMO Cc1cccnc1[C@H](C)[NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001660606679 1102883998 /nfs/dbraw/zinc/88/39/98/1102883998.db2.gz BGHZDAGRRUTFJE-ZDUSSCGKSA-N 1 1 340.383 2.538 10 5 EFBEMO O=C(NCCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1cc[nH]c1 ZINC001660684845 1102927250 /nfs/dbraw/zinc/92/72/50/1102927250.db2.gz BKZVKFAPJCXMTK-UHFFFAOYSA-N 1 1 342.399 2.707 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@]12CCC[C@H]1OCC2 ZINC001660682996 1102927317 /nfs/dbraw/zinc/92/73/17/1102927317.db2.gz NWUHJFPLWPREJU-MZMPZRCHSA-N 1 1 347.415 2.813 10 5 EFBEMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)CCC1(O)CCC1 ZINC000905900575 1103710188 /nfs/dbraw/zinc/71/01/88/1103710188.db2.gz QLPFDIAQVBQSJW-AWEZNQCLSA-N 1 1 342.823 2.736 10 5 EFBEMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)CCC1(O)CCC1 ZINC000905900575 1103710198 /nfs/dbraw/zinc/71/01/98/1103710198.db2.gz QLPFDIAQVBQSJW-AWEZNQCLSA-N 1 1 342.823 2.736 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccc(C(C)(C)C)cc1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001272012968 1103778301 /nfs/dbraw/zinc/77/83/01/1103778301.db2.gz DOLJSUDFDWREJF-IAGOWNOFSA-N 1 1 347.459 2.540 10 5 EFBEMO CN(CC[N@H+](C)Cc1ccc(C(C)(C)C)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001272012968 1103778311 /nfs/dbraw/zinc/77/83/11/1103778311.db2.gz DOLJSUDFDWREJF-IAGOWNOFSA-N 1 1 347.459 2.540 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccc(C(C)(C)C)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001272012968 1103778317 /nfs/dbraw/zinc/77/83/17/1103778317.db2.gz DOLJSUDFDWREJF-IAGOWNOFSA-N 1 1 347.459 2.540 10 5 EFBEMO CC(C)c1cc(C(=O)NCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)no1 ZINC001663240039 1104034480 /nfs/dbraw/zinc/03/44/80/1104034480.db2.gz ZILZBDUXTQTHGE-UHFFFAOYSA-N 1 1 346.387 2.568 10 5 EFBEMO CC[N@@H+](CCNC(=O)/C=C(\C)C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001663359445 1104070818 /nfs/dbraw/zinc/07/08/18/1104070818.db2.gz OGAFWVXMVGDGEX-WYMLVPIESA-N 1 1 331.416 2.889 10 5 EFBEMO CC[N@H+](CCNC(=O)C1(CF)CCC1)Cc1ccccc1[N+](=O)[O-] ZINC001663427165 1104091860 /nfs/dbraw/zinc/09/18/60/1104091860.db2.gz YJVSTDXOZVJKPN-UHFFFAOYSA-N 1 1 337.395 2.673 10 5 EFBEMO CC[N@@H+](CCNC(=O)C1(CF)CCC1)Cc1ccccc1[N+](=O)[O-] ZINC001663427165 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Cc1c[nH+]cn1C1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000373744154 151219940 /nfs/dbraw/zinc/21/99/40/151219940.db2.gz CTOBAKOBHYUUDV-UHFFFAOYSA-N 1 1 332.335 2.716 10 5 EFBEMO Cn1cc([C@@H](O)C[C@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])cn1 ZINC000378365016 152067914 /nfs/dbraw/zinc/06/79/14/152067914.db2.gz SSOQVZXPSPFGTN-WBVHZDCISA-N 1 1 348.378 2.556 10 5 EFBEMO COc1ccc(NC(=O)C[NH2+][C@H](C)c2ccc(C)o2)c([N+](=O)[O-])c1 ZINC000193637070 265337688 /nfs/dbraw/zinc/33/76/88/265337688.db2.gz NTLOYLRARWYJAW-LLVKDONJSA-N 1 1 333.344 2.794 10 5 EFBEMO CCCC[N@@H+](C)CC1CCN(C(=O)c2cc([N+](=O)[O-])cnc2C)CC1 ZINC000193634374 265338261 /nfs/dbraw/zinc/33/82/61/265338261.db2.gz YUXRDDRKACHBCV-UHFFFAOYSA-N 1 1 348.447 2.882 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000272324115 266229559 /nfs/dbraw/zinc/22/95/59/266229559.db2.gz LPPKSHIEMZCTFT-HOCLYGCPSA-N 1 1 349.431 2.571 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000272324115 266229560 /nfs/dbraw/zinc/22/95/60/266229560.db2.gz LPPKSHIEMZCTFT-HOCLYGCPSA-N 1 1 349.431 2.571 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272466484 266274214 /nfs/dbraw/zinc/27/42/14/266274214.db2.gz FCZFFZVLBJUQJX-GFCCVEGCSA-N 1 1 341.358 2.677 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[N@H+](C(C)C)CC1 ZINC000273346959 266485474 /nfs/dbraw/zinc/48/54/74/266485474.db2.gz XIYDDHKRQIHSEJ-FYWRMAATSA-N 1 1 331.416 2.941 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@@H](C)[N@@H+](C)C1CC1 ZINC000276546059 267010306 /nfs/dbraw/zinc/01/03/06/267010306.db2.gz GTYUEHWEUZPIHA-SNVBAGLBSA-N 1 1 325.796 2.769 10 5 EFBEMO COC(=O)c1cc(N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)cc(C)c1[N+](=O)[O-] ZINC000277042960 267104402 /nfs/dbraw/zinc/10/44/02/267104402.db2.gz PIDOHMQDOAQMBN-BBRMVZONSA-N 1 1 347.415 2.610 10 5 EFBEMO O=[N+]([O-])c1cnc(C(F)(F)F)cc1NC[C@H]1CCc2[nH+]ccn2C1 ZINC000278297715 267392561 /nfs/dbraw/zinc/39/25/61/267392561.db2.gz 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C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000249054857 274303263 /nfs/dbraw/zinc/30/32/63/274303263.db2.gz YLBYNYSZTYMVPE-MLGOLLRUSA-N 1 1 345.359 2.783 10 5 EFBEMO O=[N+]([O-])c1ccc(CN2CC[N@H+]3CCC[C@@H]3C2)c(C(F)(F)F)c1 ZINC000178974968 275035346 /nfs/dbraw/zinc/03/53/46/275035346.db2.gz FVDUEAZMGIWXAZ-CYBMUJFWSA-N 1 1 329.322 2.894 10 5 EFBEMO O=[N+]([O-])c1ccc(CN2CC[N@H+]3CCC[C@H]3C2)c(C(F)(F)F)c1 ZINC000246353377 275035352 /nfs/dbraw/zinc/03/53/52/275035352.db2.gz FVDUEAZMGIWXAZ-ZDUSSCGKSA-N 1 1 329.322 2.894 10 5 EFBEMO O=[N+]([O-])c1ccc(CO)cc1N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000097046785 275035604 /nfs/dbraw/zinc/03/56/04/275035604.db2.gz LHGUMWRQERGBPN-UHFFFAOYSA-N 1 1 341.411 2.799 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[N@H+](C2CC2)CC1 ZINC000185689375 275399740 /nfs/dbraw/zinc/39/97/40/275399740.db2.gz NFICOYLFKKQGPE-BUHFOSPRSA-N 1 1 329.400 2.695 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)[C@H](C)C1 ZINC000172765217 276214039 /nfs/dbraw/zinc/21/40/39/276214039.db2.gz UVAQFIIYYQUUDL-IUODEOHRSA-N 1 1 346.431 2.646 10 5 EFBEMO C[N@H+]1CCO[C@@H]2CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])C[C@H]21 ZINC000408027662 277121179 /nfs/dbraw/zinc/12/11/79/277121179.db2.gz ORLDTUJZRFRGCL-CHWSQXEVSA-N 1 1 346.214 2.811 10 5 EFBEMO O=C(CC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)Nc1ccccc1 ZINC000153340103 293371421 /nfs/dbraw/zinc/37/14/21/293371421.db2.gz SUEKRFFYVRAVGT-UHFFFAOYSA-N 1 1 325.368 2.982 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000291039241 294255659 /nfs/dbraw/zinc/25/56/59/294255659.db2.gz ARQPXJMOOXTTLA-HNNXBMFYSA-N 1 1 327.331 2.885 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)Oc2cc(F)cc([N+](=O)[O-])c2)C1 ZINC000291272553 294332000 /nfs/dbraw/zinc/33/20/00/294332000.db2.gz LLVIRXRDMPOMPC-HNNXBMFYSA-N 1 1 328.315 2.852 10 5 EFBEMO CC(C)OCC[NH+]1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000291922315 294522996 /nfs/dbraw/zinc/52/29/96/294522996.db2.gz LPSINIALYCYOLN-UHFFFAOYSA-N 1 1 344.415 2.690 10 5 EFBEMO Cc1sc(C(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000293773348 295046420 /nfs/dbraw/zinc/04/64/20/295046420.db2.gz VKMDLJAJZXGQLS-NSHDSACASA-N 1 1 337.445 2.911 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000294351715 295152126 /nfs/dbraw/zinc/15/21/26/295152126.db2.gz YMJGCXCMNZSEOV-LBKOFNPBSA-N 1 1 343.427 2.942 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000298744575 311019559 /nfs/dbraw/zinc/01/95/59/311019559.db2.gz YTSTUODMSWGWJE-GFCCVEGCSA-N 1 1 332.404 2.766 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000298754224 311020803 /nfs/dbraw/zinc/02/08/03/311020803.db2.gz PJNUVPRXQFRVPG-GFCCVEGCSA-N 1 1 331.372 2.945 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000299609221 311102401 /nfs/dbraw/zinc/10/24/01/311102401.db2.gz IINMMQXJBVAPKQ-MRXNPFEDSA-N 1 1 339.395 2.908 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@H+](C)Cc1ccccc1 ZINC000299673697 311109867 /nfs/dbraw/zinc/10/98/67/311109867.db2.gz TXMVLPNRYOPESW-UHFFFAOYSA-N 1 1 327.384 2.765 10 5 EFBEMO Cc1cc(N(C)C[C@H]2CC[N@@H+](C)C2)nc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000301232790 311125996 /nfs/dbraw/zinc/12/59/96/311125996.db2.gz KGFGIRDVGPGZDJ-AWEZNQCLSA-N 1 1 341.415 2.748 10 5 EFBEMO COc1cc(F)c([N+](=O)[O-])c(NC[C@H]2C[N@@H+](CC(C)C)CCO2)c1 ZINC000301498536 311141017 /nfs/dbraw/zinc/14/10/17/311141017.db2.gz CKISYJVZOJIPRC-ZDUSSCGKSA-N 1 1 341.383 2.511 10 5 EFBEMO COC(=O)c1cc(NCC[N@H+]2CCCC[C@H]2C)cc(C)c1[N+](=O)[O-] ZINC000301685700 311152255 /nfs/dbraw/zinc/15/22/55/311152255.db2.gz LMTZANZZBMQGBL-CYBMUJFWSA-N 1 1 335.404 2.976 10 5 EFBEMO Cc1cc(NC[C@H](C)[N@@H+]2CCOC[C@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000302003725 311171424 /nfs/dbraw/zinc/17/14/24/311171424.db2.gz JZRZCMUTBQAINZ-UONOGXRCSA-N 1 1 344.415 2.973 10 5 EFBEMO Cc1cc(NC[C@H](C)[N@H+]2CCOC[C@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000302003725 311171425 /nfs/dbraw/zinc/17/14/25/311171425.db2.gz JZRZCMUTBQAINZ-UONOGXRCSA-N 1 1 344.415 2.973 10 5 EFBEMO C[C@H](CNc1ccc2ncc([N+](=O)[O-])n2n1)[N@@H+](C)Cc1ccccc1 ZINC000302005954 311171766 /nfs/dbraw/zinc/17/17/66/311171766.db2.gz TWVYDOOWWVPZBB-CYBMUJFWSA-N 1 1 340.387 2.570 10 5 EFBEMO CCc1[nH+]ccn1[C@H]1CCCN(c2cc(CO)ccc2[N+](=O)[O-])C1 ZINC000302039880 311174125 /nfs/dbraw/zinc/17/41/25/311174125.db2.gz NGOFLVLPFJHKMF-AWEZNQCLSA-N 1 1 330.388 2.688 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1N1CCCC[C@H]1C[NH+]1CCOCC1 ZINC000302774139 311200376 /nfs/dbraw/zinc/20/03/76/311200376.db2.gz NZJYIJQAFNCRKP-AWEZNQCLSA-N 1 1 339.823 2.939 10 5 EFBEMO Cc1ccc(OC[C@@H](O)C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000305455300 311223158 /nfs/dbraw/zinc/22/31/58/311223158.db2.gz SVQSFRHOPMVWIZ-INIZCTEOSA-N 1 1 342.395 2.701 10 5 EFBEMO Cc1ccc(OC[C@@H](O)C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000305455300 311223159 /nfs/dbraw/zinc/22/31/59/311223159.db2.gz SVQSFRHOPMVWIZ-INIZCTEOSA-N 1 1 342.395 2.701 10 5 EFBEMO Cc1ccccc1OC[C@@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000305443224 311223202 /nfs/dbraw/zinc/22/32/02/311223202.db2.gz NXTBCRVYRRTTHD-INIZCTEOSA-N 1 1 342.395 2.701 10 5 EFBEMO Cc1ccccc1OC[C@@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000305443224 311223204 /nfs/dbraw/zinc/22/32/04/311223204.db2.gz NXTBCRVYRRTTHD-INIZCTEOSA-N 1 1 342.395 2.701 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c([N+](=O)[O-])cc1F ZINC000330924831 311344107 /nfs/dbraw/zinc/34/41/07/311344107.db2.gz UYNUATXEVGARCJ-WFASDCNBSA-N 1 1 340.395 2.971 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c([N+](=O)[O-])cc1F ZINC000330924831 311344108 /nfs/dbraw/zinc/34/41/08/311344108.db2.gz UYNUATXEVGARCJ-WFASDCNBSA-N 1 1 340.395 2.971 10 5 EFBEMO NC(=O)c1coc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000417315414 312208021 /nfs/dbraw/zinc/20/80/21/312208021.db2.gz BKFQWZGXHMWUDA-MRXNPFEDSA-N 1 1 329.356 2.844 10 5 EFBEMO CCN1C[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1=O ZINC000453375606 312894412 /nfs/dbraw/zinc/89/44/12/312894412.db2.gz XHDAVPJREZUBJO-LPHOPBHVSA-N 1 1 339.395 2.895 10 5 EFBEMO CCC(=O)N[C@H]1CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000470182007 313130452 /nfs/dbraw/zinc/13/04/52/313130452.db2.gz IONKRDRUZIMCHE-DKGMDFAASA-N 1 1 331.416 2.989 10 5 EFBEMO O=[N+]([O-])c1cnc2ccccc2c1NCCc1cn2c([nH+]1)CCCC2 ZINC000487918014 313439070 /nfs/dbraw/zinc/43/90/70/313439070.db2.gz NWKVCTMIFVVKHB-UHFFFAOYSA-N 1 1 337.383 2.752 10 5 EFBEMO O=C(C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1)N1CCCCC1 ZINC000505782136 315465617 /nfs/dbraw/zinc/46/56/17/315465617.db2.gz IBEFOZDXQWBFIJ-UHFFFAOYSA-N 1 1 349.406 2.958 10 5 EFBEMO COc1ccc(C[NH2+][C@H](c2ccccc2F)[C@@H](C)O)cc1[N+](=O)[O-] ZINC000518989584 315839155 /nfs/dbraw/zinc/83/91/55/315839155.db2.gz VDWZLKSXMIUNNQ-DIFFPNOSSA-N 1 1 334.347 2.954 10 5 EFBEMO COc1ccc(C[NH2+][C@H](c2ccccc2F)[C@H](C)O)cc1[N+](=O)[O-] ZINC000518989585 315839160 /nfs/dbraw/zinc/83/91/60/315839160.db2.gz VDWZLKSXMIUNNQ-GTNSWQLSSA-N 1 1 334.347 2.954 10 5 EFBEMO COC(=O)c1cc(NC[C@H]2CC[N@H+](C(C)C)C2)cc(C)c1[N+](=O)[O-] ZINC000531882068 317327420 /nfs/dbraw/zinc/32/74/20/317327420.db2.gz ZRHQFYYYSFQORK-CYBMUJFWSA-N 1 1 335.404 2.832 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)n1 ZINC000541005205 317765255 /nfs/dbraw/zinc/76/52/55/317765255.db2.gz KKRIHCJMDXDRSM-CABCVRRESA-N 1 1 334.420 2.662 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)Cn2c[nH+]c3c2CCCC3)cc1[N+](=O)[O-] ZINC000542722348 317823618 /nfs/dbraw/zinc/82/36/18/317823618.db2.gz GHHXIKFTEUZYFZ-ZDUSSCGKSA-N 1 1 342.399 2.856 10 5 EFBEMO COC[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000181657531 323242535 /nfs/dbraw/zinc/24/25/35/323242535.db2.gz QYOAHAJQZMHGIN-HNNXBMFYSA-N 1 1 329.356 2.511 10 5 EFBEMO C[C@H](C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000184199752 323358638 /nfs/dbraw/zinc/35/86/38/323358638.db2.gz IUUYYJKWGQFDOS-RWMBFGLXSA-N 1 1 337.395 2.779 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H](Nc2ncccn2)C1 ZINC000580312858 324139605 /nfs/dbraw/zinc/13/96/05/324139605.db2.gz JFLQTDRTUYGEBC-YFCVBGDOSA-N 1 1 325.372 2.584 10 5 EFBEMO CCn1cnnc1[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000161265308 473221983 /nfs/dbraw/zinc/22/19/83/473221983.db2.gz JIWGXGRQFRLGGM-OAHLLOKOSA-N 1 1 329.404 2.894 10 5 EFBEMO CC[N@H+]1CCC[C@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000112076022 473241432 /nfs/dbraw/zinc/24/14/32/473241432.db2.gz KMIRUIVPGRJZJI-HNNXBMFYSA-N 1 1 346.431 2.727 10 5 EFBEMO CC[N@H+]1CCC[C@@H](Nc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C1 ZINC000112076085 473241726 /nfs/dbraw/zinc/24/17/26/473241726.db2.gz WGMRSUMWKQKDGC-CQSZACIVSA-N 1 1 334.420 2.629 10 5 EFBEMO Cc1cc(N2CC[C@@H](C[N@H+](C)Cc3cccnc3)C2)ncc1[N+](=O)[O-] ZINC000190449973 473279288 /nfs/dbraw/zinc/27/92/88/473279288.db2.gz UCXHTYWPNDGFQD-INIZCTEOSA-N 1 1 341.415 2.652 10 5 EFBEMO C[C@H]([NH2+]Cc1cc(-c2cnn(C)c2)no1)c1cccc([N+](=O)[O-])c1 ZINC000185051738 473313181 /nfs/dbraw/zinc/31/31/81/473313181.db2.gz UEEOODGGVWZONK-NSHDSACASA-N 1 1 327.344 2.834 10 5 EFBEMO C[C@H](C(=O)N1CCC[N@H+](C2CC2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185156304 473346479 /nfs/dbraw/zinc/34/64/79/473346479.db2.gz CBYOYALJZYMNNR-LBPRGKRZSA-N 1 1 335.379 2.534 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000162581096 473358554 /nfs/dbraw/zinc/35/85/54/473358554.db2.gz NGXHJTBKJFFFOA-UKRRQHHQSA-N 1 1 332.404 2.994 10 5 EFBEMO CSc1ccc(C(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000113232378 473371585 /nfs/dbraw/zinc/37/15/85/473371585.db2.gz NHQPFXCYQGTKGZ-WCQYABFASA-N 1 1 335.429 2.625 10 5 EFBEMO CC[N@H+]1CCC[C@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)C1 ZINC000171430800 473385657 /nfs/dbraw/zinc/38/56/57/473385657.db2.gz YTJBLEODUUXDAR-INIZCTEOSA-N 1 1 348.447 2.999 10 5 EFBEMO CC[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000389402496 476781830 /nfs/dbraw/zinc/78/18/30/476781830.db2.gz PZCYVBODJOZYRR-VIFPVBQESA-N 1 1 329.198 2.567 10 5 EFBEMO CC[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000389402496 476781834 /nfs/dbraw/zinc/78/18/34/476781834.db2.gz PZCYVBODJOZYRR-VIFPVBQESA-N 1 1 329.198 2.567 10 5 EFBEMO C[C@@H](NC(=O)NC[C@H]1CC[N@H+]1C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000595479643 478810639 /nfs/dbraw/zinc/81/06/39/478810639.db2.gz GGQZZLHYCJVADB-IUODEOHRSA-N 1 1 334.420 2.828 10 5 EFBEMO C[N@H+](Cc1ccc(F)cc1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067374943 472025446 /nfs/dbraw/zinc/02/54/46/472025446.db2.gz CJNVWNANCFHQEN-KRWDZBQOSA-N 1 1 343.358 2.971 10 5 EFBEMO C[N@@H+](Cc1ccc(F)cc1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067374943 472025451 /nfs/dbraw/zinc/02/54/51/472025451.db2.gz CJNVWNANCFHQEN-KRWDZBQOSA-N 1 1 343.358 2.971 10 5 EFBEMO O=C(C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1)N1CCCCC1 ZINC000056493338 472328474 /nfs/dbraw/zinc/32/84/74/472328474.db2.gz CLXICFNVEZKOQE-UHFFFAOYSA-N 1 1 337.445 2.881 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(N2CCN(C[C@H]3CCCC[N@@H+]3C)CC2)c1 ZINC000088721313 472380992 /nfs/dbraw/zinc/38/09/92/472380992.db2.gz YIDISKNDPULAPD-MRXNPFEDSA-N 1 1 332.448 2.510 10 5 EFBEMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000154131245 472393260 /nfs/dbraw/zinc/39/32/60/472393260.db2.gz YRBWQLJXQLNJEL-QGZVFWFLSA-N 1 1 348.447 2.557 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H](Cn2cncn2)C1 ZINC000128468932 472455220 /nfs/dbraw/zinc/45/52/20/472455220.db2.gz HOKCJENTJKRIPC-NFBGWVBBSA-N 1 1 327.388 2.612 10 5 EFBEMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC[C@@H](Cn2cncn2)C1 ZINC000119127229 472529688 /nfs/dbraw/zinc/52/96/88/472529688.db2.gz AKOBWIVSNZDGQJ-GFCCVEGCSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@H](Cn2cncn2)C1 ZINC000119127229 472529694 /nfs/dbraw/zinc/52/96/94/472529694.db2.gz AKOBWIVSNZDGQJ-GFCCVEGCSA-N 1 1 335.795 2.752 10 5 EFBEMO CN(C[C@H]1CC[N@@H+](C)C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000071193059 472544771 /nfs/dbraw/zinc/54/47/71/472544771.db2.gz BTKWWJKKIIBTHF-JTQLQIEISA-N 1 1 328.210 2.745 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2C[N@@H+](C(C)C)C[C@@H]2C)c1 ZINC000155525332 472562750 /nfs/dbraw/zinc/56/27/50/472562750.db2.gz RXUXPRRYEHLRSW-GJZGRUSLSA-N 1 1 349.431 2.517 10 5 EFBEMO CCN(CC)C(=O)C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000058524195 472579620 /nfs/dbraw/zinc/57/96/20/472579620.db2.gz TYAYZTAYZJRQSD-UHFFFAOYSA-N 1 1 325.434 2.737 10 5 EFBEMO C[N@H+](Cc1ccc(F)cc1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000046704039 472587415 /nfs/dbraw/zinc/58/74/15/472587415.db2.gz JEKDSWPRWYNBCJ-INIZCTEOSA-N 1 1 334.347 2.606 10 5 EFBEMO C[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]1c1cccc(F)c1 ZINC000090551473 472632815 /nfs/dbraw/zinc/63/28/15/472632815.db2.gz BXTLMBXDNJNSJL-UGSOOPFHSA-N 1 1 345.374 2.979 10 5 EFBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NCCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000047039032 472647521 /nfs/dbraw/zinc/64/75/21/472647521.db2.gz RLWZDPFNOIUPEX-OKILXGFUSA-N 1 1 348.447 2.786 10 5 EFBEMO CC[C@H](NC(=O)N1CC[NH+](C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090688909 472651849 /nfs/dbraw/zinc/65/18/49/472651849.db2.gz NANPSWHNRNQHIT-INIZCTEOSA-N 1 1 332.404 2.536 10 5 EFBEMO CC(=O)CC[NH+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000120337412 472671056 /nfs/dbraw/zinc/67/10/56/472671056.db2.gz SNONVNMUTHPDMB-UHFFFAOYSA-N 1 1 345.321 2.715 10 5 EFBEMO COC(=O)[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000104689631 472684920 /nfs/dbraw/zinc/68/49/20/472684920.db2.gz BZYOAMOHFKXXHY-CYBMUJFWSA-N 1 1 336.388 2.767 10 5 EFBEMO COC(=O)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000104689631 472684928 /nfs/dbraw/zinc/68/49/28/472684928.db2.gz BZYOAMOHFKXXHY-CYBMUJFWSA-N 1 1 336.388 2.767 10 5 EFBEMO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCCN(c2cccnn2)C1 ZINC000105804334 472778616 /nfs/dbraw/zinc/77/86/16/472778616.db2.gz DPJVUTLCLIMVBR-ZDUSSCGKSA-N 1 1 345.378 2.625 10 5 EFBEMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCCN(c2cccnn2)C1 ZINC000105804334 472778622 /nfs/dbraw/zinc/77/86/22/472778622.db2.gz DPJVUTLCLIMVBR-ZDUSSCGKSA-N 1 1 345.378 2.625 10 5 EFBEMO Cc1nc(C)n(C[C@@H]2CCC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)n1 ZINC000105885628 472797252 /nfs/dbraw/zinc/79/72/52/472797252.db2.gz KSYOFJSVQZXQSB-CQSZACIVSA-N 1 1 347.394 2.854 10 5 EFBEMO Cc1nc(C)n(C[C@@H]2CCC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)n1 ZINC000105885628 472797254 /nfs/dbraw/zinc/79/72/54/472797254.db2.gz KSYOFJSVQZXQSB-CQSZACIVSA-N 1 1 347.394 2.854 10 5 EFBEMO Cc1sc(C(=O)NCCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000063665470 472798447 /nfs/dbraw/zinc/79/84/47/472798447.db2.gz DGGZKQTWIVMBKN-NSHDSACASA-N 1 1 325.434 2.959 10 5 EFBEMO CCOCC[N@H+]1CCN(Cc2c(F)cccc2[N+](=O)[O-])C[C@@H]1CC ZINC000106116672 472829788 /nfs/dbraw/zinc/82/97/88/472829788.db2.gz AQLWFAJMWYCPSG-AWEZNQCLSA-N 1 1 339.411 2.667 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134607098 472937214 /nfs/dbraw/zinc/93/72/14/472937214.db2.gz LFSRDTVAVMFGEW-LLVKDONJSA-N 1 1 325.796 2.852 10 5 EFBEMO Cc1cc([N+](=O)[O-])cnc1NCC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000092657961 472954562 /nfs/dbraw/zinc/95/45/62/472954562.db2.gz RSIUIXAQTRAMGS-UHFFFAOYSA-N 1 1 347.463 2.660 10 5 EFBEMO O=[N+]([O-])c1ccc(SC[C@@H](O)C[N@H+]2CCc3ccccc3C2)nc1 ZINC000159190400 473007262 /nfs/dbraw/zinc/00/72/62/473007262.db2.gz SVVIBPNIUZGWJC-INIZCTEOSA-N 1 1 345.424 2.501 10 5 EFBEMO CC[N@H+](CCc1nccs1)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000159311288 473017952 /nfs/dbraw/zinc/01/79/52/473017952.db2.gz LADWYVPSQNQMNZ-UHFFFAOYSA-N 1 1 348.428 2.863 10 5 EFBEMO CC[N@@H+](CCc1nccs1)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000159311288 473017961 /nfs/dbraw/zinc/01/79/61/473017961.db2.gz LADWYVPSQNQMNZ-UHFFFAOYSA-N 1 1 348.428 2.863 10 5 EFBEMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1 ZINC000080375793 473021721 /nfs/dbraw/zinc/02/17/21/473021721.db2.gz HGVGVOBGIPSMCA-NSHDSACASA-N 1 1 339.355 2.908 10 5 EFBEMO Cc1ccc(CN2CCN(C[C@@H]3CCCC[N@@H+]3C)CC2)cc1[N+](=O)[O-] ZINC000093147169 473052733 /nfs/dbraw/zinc/05/27/33/473052733.db2.gz LLXIDVWDZOVVTE-SFHVURJKSA-N 1 1 346.475 2.505 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1N1CCN(C[C@H]2CCCC[N@@H+]2C)CC1 ZINC000080635281 473060663 /nfs/dbraw/zinc/06/06/63/473060663.db2.gz PTEUKCVXLJKDTM-QGZVFWFLSA-N 1 1 332.448 2.510 10 5 EFBEMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2c([N+](=O)[O-])ncn2C)cc1 ZINC000080927748 473104026 /nfs/dbraw/zinc/10/40/26/473104026.db2.gz IOOKECBNMKHYMX-LLVKDONJSA-N 1 1 326.360 2.996 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000123151800 473104308 /nfs/dbraw/zinc/10/43/08/473104308.db2.gz BUXVFZHZXSBZBH-VXGBXAGGSA-N 1 1 336.392 2.550 10 5 EFBEMO COCC[N@H+]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000080948228 473108860 /nfs/dbraw/zinc/10/88/60/473108860.db2.gz VEPBOZYBNPNTRC-UHFFFAOYSA-N 1 1 347.337 2.772 10 5 EFBEMO C[C@H]1C[C@H](N(C)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123464269 473143145 /nfs/dbraw/zinc/14/31/45/473143145.db2.gz APKLWHRINAJVCI-GXFFZTMASA-N 1 1 325.796 2.803 10 5 EFBEMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@]3(O)CCCC[C@@H]3C2)cc1 ZINC000160752272 473170962 /nfs/dbraw/zinc/17/09/62/473170962.db2.gz JURNTKDXBWKOMS-CRAIPNDOSA-N 1 1 334.416 2.991 10 5 EFBEMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000081364205 473191888 /nfs/dbraw/zinc/19/18/88/473191888.db2.gz ZQJXNLNBJZCHCO-ZDUSSCGKSA-N 1 1 344.415 2.880 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000123852874 473192394 /nfs/dbraw/zinc/19/23/94/473192394.db2.gz LKIUJNGLRQGUNA-VXGBXAGGSA-N 1 1 337.445 2.871 10 5 EFBEMO COc1ccc(C[N@H+]2CCC[C@@H](Cc3noc(C)n3)C2)cc1[N+](=O)[O-] ZINC000161050165 473201723 /nfs/dbraw/zinc/20/17/23/473201723.db2.gz MCXZZCRLIXQAHN-ZDUSSCGKSA-N 1 1 346.387 2.750 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+](C)[C@@H](CO)CC(C)C)cccc1[N+](=O)[O-] ZINC000185356449 473404123 /nfs/dbraw/zinc/40/41/23/473404123.db2.gz ZKYNOCWEIFRPJF-CQSZACIVSA-N 1 1 337.420 2.571 10 5 EFBEMO CC(C)C[C@H](CO)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000185364233 473406432 /nfs/dbraw/zinc/40/64/32/473406432.db2.gz SODKQXFNTAWNNZ-GFCCVEGCSA-N 1 1 343.811 2.526 10 5 EFBEMO CC(C)C[C@H](CO)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000185364233 473406439 /nfs/dbraw/zinc/40/64/39/473406439.db2.gz SODKQXFNTAWNNZ-GFCCVEGCSA-N 1 1 343.811 2.526 10 5 EFBEMO COc1cccc(N2CCC(Cc3[nH+]ccn3C)CC2)c1[N+](=O)[O-] ZINC000185375565 473409648 /nfs/dbraw/zinc/40/96/48/473409648.db2.gz SSCPPADDNBJWGU-UHFFFAOYSA-N 1 1 330.388 2.796 10 5 EFBEMO CC[C@@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)CCN1CC(F)F ZINC000153544062 473629329 /nfs/dbraw/zinc/62/93/29/473629329.db2.gz QLUKLXHXVHBLOW-CYBMUJFWSA-N 1 1 343.374 2.635 10 5 EFBEMO CC[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CCN1CC(F)F ZINC000153544062 473629336 /nfs/dbraw/zinc/62/93/36/473629336.db2.gz QLUKLXHXVHBLOW-CYBMUJFWSA-N 1 1 343.374 2.635 10 5 EFBEMO C[C@H]1C[C@H](N(C)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000127602172 473630864 /nfs/dbraw/zinc/63/08/64/473630864.db2.gz QZJWRLYIOSVLNR-WMLDXEAASA-N 1 1 348.447 2.728 10 5 EFBEMO C[C@@H]1C[C@@H](N(C)C(=O)CSc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000127663936 473638629 /nfs/dbraw/zinc/63/86/29/473638629.db2.gz HEQRWHOJUWUJIL-OLZOCXBDSA-N 1 1 337.445 2.628 10 5 EFBEMO O=[N+]([O-])c1cc(F)ccc1OC[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000153896494 473648370 /nfs/dbraw/zinc/64/83/70/473648370.db2.gz WIHZQFVMDVTSIZ-MRXNPFEDSA-N 1 1 346.358 2.532 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1OC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000154013491 473659889 /nfs/dbraw/zinc/65/98/89/473659889.db2.gz JWPTUXIFZVSREZ-SFHVURJKSA-N 1 1 342.395 2.701 10 5 EFBEMO Cc1ccc(OC[C@H](O)C[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000154061445 473663524 /nfs/dbraw/zinc/66/35/24/473663524.db2.gz JONUWZSOYHIITG-QGZVFWFLSA-N 1 1 342.395 2.701 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1OC[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000154071578 473665019 /nfs/dbraw/zinc/66/50/19/473665019.db2.gz DZXBSQVOVDWEEG-GOSISDBHSA-N 1 1 342.395 2.701 10 5 EFBEMO CSc1cccc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000186571281 473692233 /nfs/dbraw/zinc/69/22/33/473692233.db2.gz OLJDTQSLYIEVGM-NWDGAFQWSA-N 1 1 337.445 2.871 10 5 EFBEMO Cc1ccc(N2CCC(NC(=O)c3csc([N+](=O)[O-])c3)CC2)[nH+]c1 ZINC000172872630 473695384 /nfs/dbraw/zinc/69/53/84/473695384.db2.gz RVPGSRPMJIXGDD-UHFFFAOYSA-N 1 1 346.412 2.759 10 5 EFBEMO Cc1nc2n(n1)CCC[C@@H]2[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193016056 473761974 /nfs/dbraw/zinc/76/19/74/473761974.db2.gz CLSSNFBVLIMFLA-HOTGVXAUSA-N 1 1 327.388 2.997 10 5 EFBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NCCC[N@H+](C)C1CCCCC1 ZINC000193053043 473767935 /nfs/dbraw/zinc/76/79/35/473767935.db2.gz FZLWRBWETHUBSZ-UHFFFAOYSA-N 1 1 334.420 2.683 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1C[C@H]2CCC[N@@H+]2C[C@H]1C ZINC000246102727 473782796 /nfs/dbraw/zinc/78/27/96/473782796.db2.gz JIVZOBBLRKUKOZ-UKRRQHHQSA-N 1 1 331.416 2.829 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)CCc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000246177409 473794437 /nfs/dbraw/zinc/79/44/37/473794437.db2.gz MLDXQJONWFSBLY-YOEHRIQHSA-N 1 1 333.432 2.716 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H](c3nccs3)C2)c1 ZINC000246283061 473815696 /nfs/dbraw/zinc/81/56/96/473815696.db2.gz NWEOYSZXZJXPEG-UKRRQHHQSA-N 1 1 333.413 2.964 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000180199215 473825508 /nfs/dbraw/zinc/82/55/08/473825508.db2.gz VAHUFRZDWCEOSD-RDJZCZTQSA-N 1 1 325.368 2.770 10 5 EFBEMO Cc1nn(C)c(C)c1[C@H]1CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000246351129 473836181 /nfs/dbraw/zinc/83/61/81/473836181.db2.gz WBLDEQAKNZKCRJ-IAGOWNOFSA-N 1 1 344.415 2.816 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000246676618 473932361 /nfs/dbraw/zinc/93/23/61/473932361.db2.gz ZBSBQTYCSPIYBE-AAEUAGOBSA-N 1 1 337.807 2.947 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000194783867 473953034 /nfs/dbraw/zinc/95/30/34/473953034.db2.gz GORGKVCCVXIBON-CABCVRRESA-N 1 1 331.416 2.991 10 5 EFBEMO COc1ccc(C[N@H+]2C[C@H](CO)[C@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000188060644 473967201 /nfs/dbraw/zinc/96/72/01/473967201.db2.gz KEHKAMLYVUJTIL-CABCVRRESA-N 1 1 348.424 2.873 10 5 EFBEMO CSc1cccc(C(=O)N2CCC[N@H+](C3CC3)CC2)c1[N+](=O)[O-] ZINC000188097383 473980995 /nfs/dbraw/zinc/98/09/95/473980995.db2.gz GMMINVQYKFLEPZ-UHFFFAOYSA-N 1 1 335.429 2.627 10 5 EFBEMO CCn1c(C)nc([N+](=O)[O-])c1N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000288943638 474097583 /nfs/dbraw/zinc/09/75/83/474097583.db2.gz RTDJMNTWHOWLTG-MRXNPFEDSA-N 1 1 343.431 2.830 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCN(c3cccnn3)CC2)c(Cl)c1 ZINC000182134262 474106635 /nfs/dbraw/zinc/10/66/35/474106635.db2.gz FAQZCWGLXSTNQW-UHFFFAOYSA-N 1 1 347.806 2.751 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCCN(c3cccnn3)CC2)c(Cl)c1 ZINC000182134262 474106641 /nfs/dbraw/zinc/10/66/41/474106641.db2.gz FAQZCWGLXSTNQW-UHFFFAOYSA-N 1 1 347.806 2.751 10 5 EFBEMO CCOc1cc(N2CC[N@@H+](CCOC)[C@@H](CC)C2)ccc1[N+](=O)[O-] ZINC000174914735 474116630 /nfs/dbraw/zinc/11/66/30/474116630.db2.gz ZTIHDMDHCOFKOQ-AWEZNQCLSA-N 1 1 337.420 2.541 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N[C@H]2C[N@@H+](C(C)C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000247399981 474138236 /nfs/dbraw/zinc/13/82/36/474138236.db2.gz RAAWDAGIYVCTRE-YCPHGPKFSA-N 1 1 348.447 2.992 10 5 EFBEMO CSc1cccc(C(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-] ZINC000188922958 474236025 /nfs/dbraw/zinc/23/60/25/474236025.db2.gz LZNBQBRWBRGJMM-VXGBXAGGSA-N 1 1 335.429 2.625 10 5 EFBEMO C[C@H](NC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000289413779 474260429 /nfs/dbraw/zinc/26/04/29/474260429.db2.gz AMHQBLUIMOGWTJ-SJCJKPOMSA-N 1 1 337.395 2.985 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000248387996 474301933 /nfs/dbraw/zinc/30/19/33/474301933.db2.gz CPMRYXDGXUZTRU-AEFFLSMTSA-N 1 1 345.443 2.860 10 5 EFBEMO COCC[N@H+]1CCCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000275864904 474345427 /nfs/dbraw/zinc/34/54/27/474345427.db2.gz NFKSFZPNOSHNHY-UHFFFAOYSA-N 1 1 349.431 2.513 10 5 EFBEMO CCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCS(=O)(=O)C1 ZINC000183231932 474355476 /nfs/dbraw/zinc/35/54/76/474355476.db2.gz DEOIYDWWDLOPGF-MRXNPFEDSA-N 1 1 340.445 2.692 10 5 EFBEMO CCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCS(=O)(=O)C1 ZINC000183231932 474355481 /nfs/dbraw/zinc/35/54/81/474355481.db2.gz DEOIYDWWDLOPGF-MRXNPFEDSA-N 1 1 340.445 2.692 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000248557252 474357825 /nfs/dbraw/zinc/35/78/25/474357825.db2.gz ILCGXBIGOGJFMM-NFAWXSAZSA-N 1 1 349.406 2.923 10 5 EFBEMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC000289659411 474364392 /nfs/dbraw/zinc/36/43/92/474364392.db2.gz UGHFKTJXCMFBNU-KRWDZBQOSA-N 1 1 337.395 2.766 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCNC(=O)C[C@H]1c1ccccc1 ZINC000183289401 474367413 /nfs/dbraw/zinc/36/74/13/474367413.db2.gz HNDAKGLVTNJVHE-SFHVURJKSA-N 1 1 339.395 2.966 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCNC(=O)C[C@H]1c1ccccc1 ZINC000183289401 474367417 /nfs/dbraw/zinc/36/74/17/474367417.db2.gz HNDAKGLVTNJVHE-SFHVURJKSA-N 1 1 339.395 2.966 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1CN1C[C@@H](C)O[C@H](C)C1 ZINC000248598163 474372341 /nfs/dbraw/zinc/37/23/41/474372341.db2.gz INBGFUDPARHABL-GPMSIDNRSA-N 1 1 347.459 2.977 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H]1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000248598163 474372346 /nfs/dbraw/zinc/37/23/46/474372346.db2.gz INBGFUDPARHABL-GPMSIDNRSA-N 1 1 347.459 2.977 10 5 EFBEMO Cc1ccc(C)c([C@@H]2C[N@H+](CCn3ccc([N+](=O)[O-])n3)[C@H](C)CO2)c1 ZINC000176267217 474424647 /nfs/dbraw/zinc/42/46/47/474424647.db2.gz UFJCMNSCYOSNCE-WBVHZDCISA-N 1 1 344.415 2.870 10 5 EFBEMO Cc1ccc(C)c([C@@H]2C[N@@H+](CCn3ccc([N+](=O)[O-])n3)[C@H](C)CO2)c1 ZINC000176267217 474424652 /nfs/dbraw/zinc/42/46/52/474424652.db2.gz UFJCMNSCYOSNCE-WBVHZDCISA-N 1 1 344.415 2.870 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C(F)(F)F)[C@H](CO)C1 ZINC000289797697 474430664 /nfs/dbraw/zinc/43/06/64/474430664.db2.gz SGZOKNOJTPCSLP-JSGCOSHPSA-N 1 1 332.322 2.896 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCN(c2ccccn2)CC1 ZINC000183815688 474433443 /nfs/dbraw/zinc/43/34/43/474433443.db2.gz XNMOMJLGBPHOQH-UHFFFAOYSA-N 1 1 342.399 2.711 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCN(c2ccccn2)CC1 ZINC000183815688 474433453 /nfs/dbraw/zinc/43/34/53/474433453.db2.gz XNMOMJLGBPHOQH-UHFFFAOYSA-N 1 1 342.399 2.711 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@H+](C)C[C@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000266692345 474450547 /nfs/dbraw/zinc/45/05/47/474450547.db2.gz DVTPSNDLLJZZEX-ZIAGYGMSSA-N 1 1 335.404 2.731 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)C[C@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000266692345 474450556 /nfs/dbraw/zinc/45/05/56/474450556.db2.gz DVTPSNDLLJZZEX-ZIAGYGMSSA-N 1 1 335.404 2.731 10 5 EFBEMO C[N@H+](CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1CC1 ZINC000266699969 474453196 /nfs/dbraw/zinc/45/31/96/474453196.db2.gz XQKCFZKTAWPGJQ-UHFFFAOYSA-N 1 1 332.385 2.751 10 5 EFBEMO C[N@@H+](CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1CC1 ZINC000266699969 474453206 /nfs/dbraw/zinc/45/32/06/474453206.db2.gz XQKCFZKTAWPGJQ-UHFFFAOYSA-N 1 1 332.385 2.751 10 5 EFBEMO CSc1cccc(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-] ZINC000249131824 474534784 /nfs/dbraw/zinc/53/47/84/474534784.db2.gz LZNBQBRWBRGJMM-RYUDHWBXSA-N 1 1 335.429 2.625 10 5 EFBEMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1C[C@H]2CCC[N@@H+]2C[C@H]1C ZINC000249138025 474536377 /nfs/dbraw/zinc/53/63/77/474536377.db2.gz VTQDDVNPIHWRLH-ZIAGYGMSSA-N 1 1 332.404 2.912 10 5 EFBEMO Cc1cc(N2CC[N@H+]3CCC[C@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000250213757 474631156 /nfs/dbraw/zinc/63/11/56/474631156.db2.gz 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BDSHHVPYGJVDOJ-LLVKDONJSA-N 1 1 325.796 2.628 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](c2nc(C3CC3)no2)C1 ZINC000375465259 476852382 /nfs/dbraw/zinc/85/23/82/476852382.db2.gz MVOVNFOKUQTKEU-CYBMUJFWSA-N 1 1 344.371 2.853 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411416479 477227366 /nfs/dbraw/zinc/22/73/66/477227366.db2.gz ORLYFQOVZKTDDL-XOKHGSTOSA-N 1 1 331.416 2.689 10 5 EFBEMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)c2c(N)cccc2[N+](=O)[O-])CC1 ZINC000432772751 477261976 /nfs/dbraw/zinc/26/19/76/477261976.db2.gz XRRCMUZBSKASPU-UHFFFAOYSA-N 1 1 346.431 2.585 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC12CCC2 ZINC000411638481 477305231 /nfs/dbraw/zinc/30/52/31/477305231.db2.gz HLRKFUBNCWPGBR-UHFFFAOYSA-N 1 1 333.388 2.951 10 5 EFBEMO C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000371528345 477372789 /nfs/dbraw/zinc/37/27/89/477372789.db2.gz LCHOWKGOEIPVOA-JKSUJKDBSA-N 1 1 343.358 2.562 10 5 EFBEMO CC1=CC[N@@H+](CCNC(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000454792049 477379350 /nfs/dbraw/zinc/37/93/50/477379350.db2.gz SRLRXFZOOMNROY-AWEZNQCLSA-N 1 1 332.404 2.607 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@H](C2CCC2)C1 ZINC000411846651 477392445 /nfs/dbraw/zinc/39/24/45/477392445.db2.gz LVZIRWFWANOLLU-KRWDZBQOSA-N 1 1 347.415 2.733 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@](C(N)=O)(c2ccccc2)C1 ZINC000411969023 477399404 /nfs/dbraw/zinc/39/94/04/477399404.db2.gz PKZBSKBXLRWSRB-LIRRHRJNSA-N 1 1 339.395 2.785 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@](C(N)=O)(c2ccccc2)C1 ZINC000411969022 477400184 /nfs/dbraw/zinc/40/01/84/477400184.db2.gz PKZBSKBXLRWSRB-KUHUBIRLSA-N 1 1 339.395 2.785 10 5 EFBEMO CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NCc1ccccc1[N+](=O)[O-])C2 ZINC000376622227 477433000 /nfs/dbraw/zinc/43/30/00/477433000.db2.gz INPBFFCQEPUZCX-LBPRGKRZSA-N 1 1 342.399 2.863 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@]3(C2)CCCOC3)c([N+](=O)[O-])cc1OC ZINC000367438527 477509661 /nfs/dbraw/zinc/50/96/61/477509661.db2.gz NNBLQFFTJXZMOT-KRWDZBQOSA-N 1 1 336.388 2.615 10 5 EFBEMO C[C@@H](c1ccccc1)[C@@H](O)C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000450690438 477683278 /nfs/dbraw/zinc/68/32/78/477683278.db2.gz GVINFEXKANHVAZ-UGSOOPFHSA-N 1 1 327.384 2.513 10 5 EFBEMO C[C@@H](c1ccccc1)[C@@H](O)C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000450690438 477683286 /nfs/dbraw/zinc/68/32/86/477683286.db2.gz GVINFEXKANHVAZ-UGSOOPFHSA-N 1 1 327.384 2.513 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000372246732 477711103 /nfs/dbraw/zinc/71/11/03/477711103.db2.gz GWKKDEPUXIKDIR-UHFFFAOYSA-N 1 1 332.335 2.716 10 5 EFBEMO C[C@H]1CN(c2ccncc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000450809671 477725260 /nfs/dbraw/zinc/72/52/60/477725260.db2.gz KYZIMOMWPPBCST-OAHLLOKOSA-N 1 1 326.400 2.948 10 5 EFBEMO CCOC(=O)c1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])nc1 ZINC000450977073 477780812 /nfs/dbraw/zinc/78/08/12/477780812.db2.gz SUIFKJQVAVWARD-UHFFFAOYSA-N 1 1 343.383 2.841 10 5 EFBEMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000438483196 477849175 /nfs/dbraw/zinc/84/91/75/477849175.db2.gz CURNXMZLOYGCMK-CHWSQXEVSA-N 1 1 335.404 2.908 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@@H](O)CC34CCC4)n2)cc1 ZINC000420990185 477883640 /nfs/dbraw/zinc/88/36/40/477883640.db2.gz DUPCXWCRDXGSSV-CQSZACIVSA-N 1 1 344.371 2.524 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@@H](O)CC34CCC4)n2)cc1 ZINC000420990185 477883645 /nfs/dbraw/zinc/88/36/45/477883645.db2.gz DUPCXWCRDXGSSV-CQSZACIVSA-N 1 1 344.371 2.524 10 5 EFBEMO COc1ccc(-c2ccc(C[N@H+]3C[C@H](O)C4(CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000428388228 477884458 /nfs/dbraw/zinc/88/44/58/477884458.db2.gz VZGLHGOGTXSDIY-KRWDZBQOSA-N 1 1 344.367 2.820 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@H](CC(C)(C)C(N)=O)C2)ccc1[N+](=O)[O-] ZINC000451220380 477885944 /nfs/dbraw/zinc/88/59/44/477885944.db2.gz VOXQKZKCUZQQAV-CQSZACIVSA-N 1 1 349.431 2.717 10 5 EFBEMO O=[N+]([O-])c1ccc(CC[N@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)cc1 ZINC000451261929 477916827 /nfs/dbraw/zinc/91/68/27/477916827.db2.gz KEUKRXULGLSCPR-MOPGFXCFSA-N 1 1 344.386 2.937 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](OC(F)F)C1 ZINC000558864422 477937128 /nfs/dbraw/zinc/93/71/28/477937128.db2.gz UMKNEGCLNTYVST-LBPRGKRZSA-N 1 1 343.330 2.545 10 5 EFBEMO C[C@@]12CC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@@H]1C2(F)F ZINC000428727703 477968782 /nfs/dbraw/zinc/96/87/82/477968782.db2.gz CUOFECJEKQDGIU-DZGCQCFKSA-N 1 1 339.342 2.901 10 5 EFBEMO COC(=O)C(C)(C)N1CC[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000494462753 477991021 /nfs/dbraw/zinc/99/10/21/477991021.db2.gz HKWXDKDFYJTYBJ-AWEZNQCLSA-N 1 1 349.431 2.533 10 5 EFBEMO CNC(=O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000421371863 478059632 /nfs/dbraw/zinc/05/96/32/478059632.db2.gz DBBVDLGJCHMUDQ-ZDUSSCGKSA-N 1 1 345.424 2.891 10 5 EFBEMO O=[N+]([O-])c1cnc2ccccc2c1NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000487764813 478070843 /nfs/dbraw/zinc/07/08/43/478070843.db2.gz WUDUKYJTJAEZTG-AWEZNQCLSA-N 1 1 326.400 2.994 10 5 EFBEMO CN(CC1CC1)C(=O)C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548837 478084891 /nfs/dbraw/zinc/08/48/91/478084891.db2.gz OPPHXQHVMXRLAL-INIZCTEOSA-N 1 1 331.416 2.643 10 5 EFBEMO Cc1cc(F)ccc1C[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000487965734 478093487 /nfs/dbraw/zinc/09/34/87/478093487.db2.gz URBCOQKASRQOHQ-QGZVFWFLSA-N 1 1 348.374 2.914 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@@H]1C1(O)CC1 ZINC000560590669 478114067 /nfs/dbraw/zinc/11/40/67/478114067.db2.gz DXGJQPUFZQMQDM-MRXNPFEDSA-N 1 1 347.415 2.611 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H]3CC[C@@H](C1)S3)OCCO2 ZINC000600190459 478272266 /nfs/dbraw/zinc/27/22/66/478272266.db2.gz PGNGFWCDMKNIIY-OLZOCXBDSA-N 1 1 336.413 2.836 10 5 EFBEMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)c1 ZINC000600228375 478298983 /nfs/dbraw/zinc/29/89/83/478298983.db2.gz KOLRIUFVCHJATN-AWEZNQCLSA-N 1 1 347.415 2.740 10 5 EFBEMO Cc1c(CC(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)cccc1[N+](=O)[O-] ZINC000600228491 478299596 /nfs/dbraw/zinc/29/95/96/478299596.db2.gz BTWKMUBMRRXTSG-QGZVFWFLSA-N 1 1 345.443 2.969 10 5 EFBEMO COc1cccc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000600230346 478300306 /nfs/dbraw/zinc/30/03/06/478300306.db2.gz RFCCPNDMVRDGGX-AWEZNQCLSA-N 1 1 347.415 2.740 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000600229990 478300834 /nfs/dbraw/zinc/30/08/34/478300834.db2.gz MSLYPRCYVLEYHU-OAHLLOKOSA-N 1 1 347.415 2.740 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000600229870 478301591 /nfs/dbraw/zinc/30/15/91/478301591.db2.gz WIAHCBFZIZZZPE-OAHLLOKOSA-N 1 1 347.415 2.740 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1N1CCC([N@H+]2CCCOCC2)CC1 ZINC000521395245 478374760 /nfs/dbraw/zinc/37/47/60/478374760.db2.gz GWYHBJXIACDEIA-UHFFFAOYSA-N 1 1 339.823 2.939 10 5 EFBEMO COc1cc(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc([N+](=O)[O-])c1C ZINC000600469873 478382152 /nfs/dbraw/zinc/38/21/52/478382152.db2.gz LTRBFSBREAUZAS-OAHLLOKOSA-N 1 1 347.415 2.659 10 5 EFBEMO CC[C@H](NC(=O)N1CC[N@@H+](C)C[C@H]1CC)c1cccc([N+](=O)[O-])c1 ZINC000590928052 478402485 /nfs/dbraw/zinc/40/24/85/478402485.db2.gz OZRKNBQAZPHNFC-ZBFHGGJFSA-N 1 1 334.420 2.782 10 5 EFBEMO COc1c(C)cccc1C[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000594523004 478425070 /nfs/dbraw/zinc/42/50/70/478425070.db2.gz UUMYKZOGLXNECQ-UHFFFAOYSA-N 1 1 344.367 2.973 10 5 EFBEMO Cc1[nH+]cn(CCCCc2noc(-c3cc([N+](=O)[O-])cn3C)n2)c1C ZINC000594534233 478428374 /nfs/dbraw/zinc/42/83/74/478428374.db2.gz JIGGGCLLQNGRBB-UHFFFAOYSA-N 1 1 344.375 2.820 10 5 EFBEMO O=C(CC[N@H+]1CCc2ccccc2C1)NCc1cccc([N+](=O)[O-])c1 ZINC000581775395 478440856 /nfs/dbraw/zinc/44/08/56/478440856.db2.gz NFEKJXREPHTZAL-UHFFFAOYSA-N 1 1 339.395 2.659 10 5 EFBEMO Cn1cc(C[NH+]2CC3(CC3(F)F)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594608530 478463536 /nfs/dbraw/zinc/46/35/36/478463536.db2.gz ANIDYPZOPLCNHJ-UHFFFAOYSA-N 1 1 334.326 2.836 10 5 EFBEMO C[NH2+]CCOCCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000600708740 478479547 /nfs/dbraw/zinc/47/95/47/478479547.db2.gz FPIPSMQINCQGAB-GOSISDBHSA-N 1 1 329.400 2.510 10 5 EFBEMO COc1cc(C[N@H+](Cc2ccccc2)C[C@@H](C)O)ccc1[N+](=O)[O-] ZINC000540908277 478506116 /nfs/dbraw/zinc/50/61/16/478506116.db2.gz BGVWJRMLLHBACR-CQSZACIVSA-N 1 1 330.384 2.986 10 5 EFBEMO COc1cc(C[N@H+]2C[C@H](c3cnn(C)c3)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000571176547 478538478 /nfs/dbraw/zinc/53/84/78/478538478.db2.gz XBOXMDOOOGWSEF-OAHLLOKOSA-N 1 1 344.415 2.963 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000597853967 478540766 /nfs/dbraw/zinc/54/07/66/478540766.db2.gz FPBSRCGOAJYVAQ-LBPRGKRZSA-N 1 1 344.415 2.926 10 5 EFBEMO C[C@H](C(=O)NC[C@H]1CC[N@H+]1C(C)(C)C)c1ccc([N+](=O)[O-])cc1F ZINC000597856846 478541710 /nfs/dbraw/zinc/54/17/10/478541710.db2.gz BFUINLXGWMESLG-WCQYABFASA-N 1 1 337.395 2.826 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000597858892 478543749 /nfs/dbraw/zinc/54/37/49/478543749.db2.gz PWHPNOUNGQHNTF-CYBMUJFWSA-N 1 1 337.445 2.676 10 5 EFBEMO CSc1cccc(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)c1[N+](=O)[O-] ZINC000597859034 478543931 /nfs/dbraw/zinc/54/39/31/478543931.db2.gz QGAWVKXYLZMEBX-LLVKDONJSA-N 1 1 337.445 2.919 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000597859696 478545888 /nfs/dbraw/zinc/54/58/88/478545888.db2.gz FUAQATMSUDXXGV-OWCLPIDISA-N 1 1 331.416 2.687 10 5 EFBEMO CC(C)Oc1cc(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC000597861290 478547891 /nfs/dbraw/zinc/54/78/91/478547891.db2.gz SHVURVWNFDESLU-AWEZNQCLSA-N 1 1 349.431 2.985 10 5 EFBEMO COc1cc(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)cc([N+](=O)[O-])c1C ZINC000597861744 478548762 /nfs/dbraw/zinc/54/87/62/478548762.db2.gz WRFCQAUKRPNVIW-CYBMUJFWSA-N 1 1 335.404 2.514 10 5 EFBEMO CCN(C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](C)C1 ZINC000597947169 478590544 /nfs/dbraw/zinc/59/05/44/478590544.db2.gz UQYNJUACXPDSGZ-GXTWGEPZSA-N 1 1 337.445 2.628 10 5 EFBEMO CCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)[C@H]1CC[N@@H+](C)C1 ZINC000597947591 478592213 /nfs/dbraw/zinc/59/22/13/478592213.db2.gz ZLKLSDLSMFNMEQ-AWEZNQCLSA-N 1 1 335.404 2.548 10 5 EFBEMO CCC[N@@H+](C)C[C@@H]1CCN(c2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC000542048345 478626071 /nfs/dbraw/zinc/62/60/71/478626071.db2.gz XPVVFWQTMWFBNE-ZDUSSCGKSA-N 1 1 335.404 2.550 10 5 EFBEMO CCN(C(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@@H+](CC)C1 ZINC000598041273 478629262 /nfs/dbraw/zinc/62/92/62/478629262.db2.gz KUCMRUMHCDVJHX-LBPRGKRZSA-N 1 1 325.796 2.805 10 5 EFBEMO CC[C@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C[C@]2(CCOC2)O1 ZINC000601157836 478696228 /nfs/dbraw/zinc/69/62/28/478696228.db2.gz GWHNOIVLIPCULU-KSSFIOAISA-N 1 1 343.383 2.917 10 5 EFBEMO CC[C@@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C[C@@]2(CCOC2)O1 ZINC000601157837 478696706 /nfs/dbraw/zinc/69/67/06/478696706.db2.gz GWHNOIVLIPCULU-RDTXWAMCSA-N 1 1 343.383 2.917 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCO[C@]4(CCCOC4)C3)c2c1 ZINC000601164707 478700874 /nfs/dbraw/zinc/70/08/74/478700874.db2.gz FLJYDCCGSQJDTM-QGZVFWFLSA-N 1 1 329.356 2.529 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCO[C@@]4(CCCOC4)C3)c2c1 ZINC000601164706 478701137 /nfs/dbraw/zinc/70/11/37/478701137.db2.gz FLJYDCCGSQJDTM-KRWDZBQOSA-N 1 1 329.356 2.529 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3C[C@H](O)C[C@@H]3[C@H]3CCCOC3)c2c1 ZINC000601170623 478702700 /nfs/dbraw/zinc/70/27/00/478702700.db2.gz RMXZBSITUFIECO-WPKBUWHJSA-N 1 1 343.383 2.509 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1 ZINC000601171957 478704317 /nfs/dbraw/zinc/70/43/17/478704317.db2.gz SWVBKKQHUPCFSM-XPTSAGLGSA-N 1 1 341.289 2.893 10 5 EFBEMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(c2ncc(F)cc2[N+](=O)[O-])C1 ZINC000601194212 478716780 /nfs/dbraw/zinc/71/67/80/478716780.db2.gz GHCRAUDUIXECQT-MRXNPFEDSA-N 1 1 344.390 2.882 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@H]4CC[C@@H](C3)[S@]4=O)c2c1 ZINC000601202752 478721563 /nfs/dbraw/zinc/72/15/63/478721563.db2.gz HKOSUBQOFVTHEY-PSVOKBTDSA-N 1 1 331.397 2.633 10 5 EFBEMO CCc1nn(C)c(NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000591985865 478734170 /nfs/dbraw/zinc/73/41/70/478734170.db2.gz PDCNLEYENAVXAB-CABCVRRESA-N 1 1 343.431 2.648 10 5 EFBEMO Cc1noc(CN(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595385416 478757964 /nfs/dbraw/zinc/75/79/64/478757964.db2.gz VYRQLMYFIBYWLY-OAHLLOKOSA-N 1 1 330.388 2.598 10 5 EFBEMO COC(=O)c1cc(N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)cc(C)c1[N+](=O)[O-] ZINC000564567617 478761470 /nfs/dbraw/zinc/76/14/70/478761470.db2.gz LRZDZZQWKNATGU-YPMHNXCESA-N 1 1 333.388 2.727 10 5 EFBEMO CCC[N@H+]1CC[C@@H](NC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000598343409 478776808 /nfs/dbraw/zinc/77/68/08/478776808.db2.gz UMULQXAIEOMYJB-GFCCVEGCSA-N 1 1 325.796 2.771 10 5 EFBEMO CC1(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)COC1 ZINC000592131291 478789719 /nfs/dbraw/zinc/78/97/19/478789719.db2.gz WKKXXCRRBIIBKM-WKILWMFISA-N 1 1 334.416 2.737 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N2CCC(C[N@@H+](C)C(C)C)CC2)c1 ZINC000543899457 478797061 /nfs/dbraw/zinc/79/70/61/478797061.db2.gz OLFOWDXRCGGSBQ-UHFFFAOYSA-N 1 1 349.431 2.938 10 5 EFBEMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601402779 478820703 /nfs/dbraw/zinc/82/07/03/478820703.db2.gz WCLAPABXTVZSMB-UONOGXRCSA-N 1 1 331.416 2.568 10 5 EFBEMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601402779 478820709 /nfs/dbraw/zinc/82/07/09/478820709.db2.gz WCLAPABXTVZSMB-UONOGXRCSA-N 1 1 331.416 2.568 10 5 EFBEMO CO[C@H](C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)[C@H]1CCOC1 ZINC000595520781 478832839 /nfs/dbraw/zinc/83/28/39/478832839.db2.gz DQLQUPGNRYSMLW-XYJFISCASA-N 1 1 334.416 2.826 10 5 EFBEMO CO[C@H](C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)[C@@H]1CCOC1 ZINC000595520779 478833074 /nfs/dbraw/zinc/83/30/74/478833074.db2.gz DQLQUPGNRYSMLW-LZLYRXPVSA-N 1 1 334.416 2.826 10 5 EFBEMO CC1=CC[N@@H+](CCNC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)CC1 ZINC000601445632 478836199 /nfs/dbraw/zinc/83/61/99/478836199.db2.gz ZYJQVLIUJZCZHX-UHFFFAOYSA-N 1 1 343.427 2.785 10 5 EFBEMO Cc1noc(C[N@H+]2CCC[C@H](O)[C@@H]2CCc2ccccc2)c1[N+](=O)[O-] ZINC000595556755 478852535 /nfs/dbraw/zinc/85/25/35/478852535.db2.gz FTWBWUDLNNOANX-HOTGVXAUSA-N 1 1 345.399 2.849 10 5 EFBEMO Cc1c(CNC(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000595588060 478871542 /nfs/dbraw/zinc/87/15/42/478871542.db2.gz ONVMDOYXQPOSQR-AWEZNQCLSA-N 1 1 334.420 2.575 10 5 EFBEMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3cncc(Cl)c3)C2)nc1 ZINC000598596381 478919088 /nfs/dbraw/zinc/91/90/88/478919088.db2.gz PCDCPRXYDZOXAP-CYBMUJFWSA-N 1 1 333.779 2.725 10 5 EFBEMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cncc(Cl)c3)C2)nc1 ZINC000598596381 478919094 /nfs/dbraw/zinc/91/90/94/478919094.db2.gz PCDCPRXYDZOXAP-CYBMUJFWSA-N 1 1 333.779 2.725 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC3(C[C@H]2C)CCOCC3)c1 ZINC000592525658 478932269 /nfs/dbraw/zinc/93/22/69/478932269.db2.gz CQNFORXVGCJCLT-CYBMUJFWSA-N 1 1 348.399 2.772 10 5 EFBEMO O=C1[C@@H]([N@H+]2CCC[C@H](CCF)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595756299 478978615 /nfs/dbraw/zinc/97/86/15/478978615.db2.gz SMROFWORNSVOSY-CJNGLKHVSA-N 1 1 335.379 2.772 10 5 EFBEMO C[C@]12COC[C@@H]1C[N@@H+](Cc1coc(-c3ccc([N+](=O)[O-])cc3)n1)C2 ZINC000595760262 478981830 /nfs/dbraw/zinc/98/18/30/478981830.db2.gz SLMZKXGURFZTBE-GUYCJALGSA-N 1 1 329.356 2.718 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2COC[C@]2(C)C1 ZINC000595761486 478982449 /nfs/dbraw/zinc/98/24/49/478982449.db2.gz XABNGNACGREXBQ-NDGTYSDOSA-N 1 1 344.371 2.674 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](Nc2ncccn2)C1 ZINC000583995168 478990829 /nfs/dbraw/zinc/99/08/29/478990829.db2.gz PCHZYYOENRYVBS-HFQYIWAZSA-N 1 1 339.399 2.975 10 5 EFBEMO CCC[N@H+]1CC[C@H](NC(=O)N[C@H](CC)c2cccc([N+](=O)[O-])c2)C1 ZINC000595808786 479010480 /nfs/dbraw/zinc/01/04/80/479010480.db2.gz WJZZZSVZTLEKIN-GOEBONIOSA-N 1 1 334.420 2.829 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H](C2CCC2)C1 ZINC000595832071 479022665 /nfs/dbraw/zinc/02/26/65/479022665.db2.gz HJVQPYGEVWCUGG-HOTGVXAUSA-N 1 1 334.416 2.847 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000592747399 479024008 /nfs/dbraw/zinc/02/40/08/479024008.db2.gz XSUVRHLWXSAPPL-CYBMUJFWSA-N 1 1 345.403 2.533 10 5 EFBEMO CCOC(=O)c1cc(NCC[N@@H+]2CC=C(C)CC2)ccc1[N+](=O)[O-] ZINC000546580562 479036331 /nfs/dbraw/zinc/03/63/31/479036331.db2.gz VQELRZHRDHFFAM-UHFFFAOYSA-N 1 1 333.388 2.835 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NCc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000595874639 479043736 /nfs/dbraw/zinc/04/37/36/479043736.db2.gz XKDUIXIXGGQIPI-UHFFFAOYSA-N 1 1 327.400 2.953 10 5 EFBEMO CCCN(C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CC[N@@H+](C)C1 ZINC000592832155 479064021 /nfs/dbraw/zinc/06/40/21/479064021.db2.gz RRLYAVOZSSBANB-CYBMUJFWSA-N 1 1 330.388 2.632 10 5 EFBEMO NC(=O)c1ccc(C[N@H+]2CC3CC2(c2ccccc2)C3)c([N+](=O)[O-])c1 ZINC000595911063 479065360 /nfs/dbraw/zinc/06/53/60/479065360.db2.gz LQXSHVRNDARUMO-UHFFFAOYSA-N 1 1 337.379 2.815 10 5 EFBEMO O=[N+]([O-])c1cc2c(nc1N1CCC[C@H](c3[nH]cc[nH+]3)C1)CCCC2 ZINC000565713193 479069178 /nfs/dbraw/zinc/06/91/78/479069178.db2.gz UDWRBFCGHLRLQR-ZDUSSCGKSA-N 1 1 327.388 2.976 10 5 EFBEMO CC[C@@H](CSC)[N@@H+](C)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000593018993 479127687 /nfs/dbraw/zinc/12/76/87/479127687.db2.gz HLPPQHUBKLBGLN-ZDUSSCGKSA-N 1 1 326.418 2.955 10 5 EFBEMO CCC[C@@]1(CO)CCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000593027640 479131333 /nfs/dbraw/zinc/13/13/33/479131333.db2.gz UWARWIGQPXFPGI-KRWDZBQOSA-N 1 1 336.388 2.508 10 5 EFBEMO COc1cc(N2CC[NH+](CC3CC3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596089040 479132033 /nfs/dbraw/zinc/13/20/33/479132033.db2.gz VXVVFMPLCXFBFF-UHFFFAOYSA-N 1 1 325.796 2.789 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H](CO)CC(C)(C)C)c1 ZINC000593029715 479133847 /nfs/dbraw/zinc/13/38/47/479133847.db2.gz GGIXFAYVIJWEHC-CQSZACIVSA-N 1 1 338.404 2.610 10 5 EFBEMO C[C@H](Nc1ccc2cnccc2c1[N+](=O)[O-])[C@H](C)[NH+]1CCOCC1 ZINC000599038561 479134303 /nfs/dbraw/zinc/13/43/03/479134303.db2.gz LSACORFHNAUZJZ-STQMWFEESA-N 1 1 330.388 2.664 10 5 EFBEMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCC12CCCC2 ZINC000593037883 479137159 /nfs/dbraw/zinc/13/71/59/479137159.db2.gz DESMYKDTQXYSRC-UHFFFAOYSA-N 1 1 331.372 2.911 10 5 EFBEMO Cn1ccnc1[C@@H]([NH2+]CC[C@@H]1CCCOC1)c1ccc([N+](=O)[O-])cc1 ZINC000599054461 479141007 /nfs/dbraw/zinc/14/10/07/479141007.db2.gz ABLFOFIASMNOAJ-YOEHRIQHSA-N 1 1 344.415 2.824 10 5 EFBEMO COCC[N@H+]1CCC[C@H](Nc2cc(OC)c([N+](=O)[O-])cc2Cl)C1 ZINC000596115550 479148681 /nfs/dbraw/zinc/14/86/81/479148681.db2.gz BEVRYJTYECLLKK-NSHDSACASA-N 1 1 343.811 2.780 10 5 EFBEMO Cc1cc(N2CCN(C[C@H]3CCCC[N@@H+]3C)CC2)c([N+](=O)[O-])s1 ZINC000596122887 479151566 /nfs/dbraw/zinc/15/15/66/479151566.db2.gz QEFLZPCXCUMUPD-CQSZACIVSA-N 1 1 338.477 2.571 10 5 EFBEMO CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCCOC1 ZINC000593066823 479155157 /nfs/dbraw/zinc/15/51/57/479155157.db2.gz GELNMBMRJRAEFE-CQSZACIVSA-N 1 1 332.360 2.646 10 5 EFBEMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCCOC1 ZINC000593066823 479155166 /nfs/dbraw/zinc/15/51/66/479155166.db2.gz GELNMBMRJRAEFE-CQSZACIVSA-N 1 1 332.360 2.646 10 5 EFBEMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H]1CCCOC1 ZINC000593069518 479155881 /nfs/dbraw/zinc/15/58/81/479155881.db2.gz TWBKLBRFRPUHMS-HNNXBMFYSA-N 1 1 335.404 2.733 10 5 EFBEMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Cn3cnnc3)CC2)c(Cl)c1 ZINC000593077922 479160577 /nfs/dbraw/zinc/16/05/77/479160577.db2.gz SFFKEHNXONSNAI-UHFFFAOYSA-N 1 1 335.795 2.752 10 5 EFBEMO C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C2(CCC2)CO1 ZINC000593090648 479168201 /nfs/dbraw/zinc/16/82/01/479168201.db2.gz BTPOTQOJBXHAPA-CYBMUJFWSA-N 1 1 333.388 2.567 10 5 EFBEMO O=[N+]([O-])c1cccc2ncnc(NC[C@H]3CC[N@H+]3C3CCCCC3)c21 ZINC000599127000 479170346 /nfs/dbraw/zinc/17/03/46/479170346.db2.gz LJDKQBVFPVZONO-CQSZACIVSA-N 1 1 341.415 2.779 10 5 EFBEMO O=[N+]([O-])c1ccc2ncnc(NC[C@@H]3CC[N@H+]3C3CCCCC3)c2c1 ZINC000599127178 479170836 /nfs/dbraw/zinc/17/08/36/479170836.db2.gz QPDKILWWQYLACU-HNNXBMFYSA-N 1 1 341.415 2.779 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@@H]2CNc2ncccc2[N+](=O)[O-])cc1 ZINC000599140446 479179337 /nfs/dbraw/zinc/17/93/37/479179337.db2.gz STGCKRIIUDVUED-CQSZACIVSA-N 1 1 328.372 2.685 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2ncccc2[N+](=O)[O-])cc1 ZINC000599140446 479179342 /nfs/dbraw/zinc/17/93/42/479179342.db2.gz STGCKRIIUDVUED-CQSZACIVSA-N 1 1 328.372 2.685 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000593115222 479184171 /nfs/dbraw/zinc/18/41/71/479184171.db2.gz AOAKZSVTERIBQW-IAQYHMDHSA-N 1 1 339.342 2.961 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000593115222 479184178 /nfs/dbraw/zinc/18/41/78/479184178.db2.gz AOAKZSVTERIBQW-IAQYHMDHSA-N 1 1 339.342 2.961 10 5 EFBEMO COc1ccc(OCC[N@H+]2CC[C@]3(CC3(F)F)C2)c([N+](=O)[O-])c1 ZINC000593117113 479186193 /nfs/dbraw/zinc/18/61/93/479186193.db2.gz OWBOMIIIASCHFV-AWEZNQCLSA-N 1 1 328.315 2.713 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@]4(CC4(F)F)C3)n2)c1 ZINC000593118823 479186740 /nfs/dbraw/zinc/18/67/40/479186740.db2.gz YRGKRTDHDWLNSI-AWEZNQCLSA-N 1 1 336.298 2.876 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@]4(CC4(F)F)C3)n2)c1 ZINC000593118823 479186749 /nfs/dbraw/zinc/18/67/49/479186749.db2.gz YRGKRTDHDWLNSI-AWEZNQCLSA-N 1 1 336.298 2.876 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593118780 479187550 /nfs/dbraw/zinc/18/75/50/479187550.db2.gz RYCDUPLQWKTICV-OAHLLOKOSA-N 1 1 339.342 2.963 10 5 EFBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593119346 479187822 /nfs/dbraw/zinc/18/78/22/479187822.db2.gz WFECGTQVGTXBOQ-HZMBPMFUSA-N 1 1 325.315 2.653 10 5 EFBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593119346 479187828 /nfs/dbraw/zinc/18/78/28/479187828.db2.gz WFECGTQVGTXBOQ-HZMBPMFUSA-N 1 1 325.315 2.653 10 5 EFBEMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)c1 ZINC000593126370 479192686 /nfs/dbraw/zinc/19/26/86/479192686.db2.gz UJAGMMCZQSZXHD-BZSNNMDCSA-N 1 1 342.399 2.786 10 5 EFBEMO O=c1[nH]ccc(NCC[N@@H+]2CCc3c(Cl)cccc3C2)c1[N+](=O)[O-] ZINC000596202478 479195776 /nfs/dbraw/zinc/19/57/76/479195776.db2.gz FTNAWTPZTWEBNN-UHFFFAOYSA-N 1 1 348.790 2.819 10 5 EFBEMO O=c1[nH]ccc(NCC[N@H+]2CCc3c(Cl)cccc3C2)c1[N+](=O)[O-] ZINC000596202478 479195784 /nfs/dbraw/zinc/19/57/84/479195784.db2.gz FTNAWTPZTWEBNN-UHFFFAOYSA-N 1 1 348.790 2.819 10 5 EFBEMO COc1cc(N2CC[C@]3(CC[N@@H+](C)C3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596241470 479219224 /nfs/dbraw/zinc/21/92/24/479219224.db2.gz FTAYPRGRIRMXTF-HNNXBMFYSA-N 1 1 325.796 2.789 10 5 EFBEMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC000596275386 479235868 /nfs/dbraw/zinc/23/58/68/479235868.db2.gz RBTRXVFGBNTHCQ-WDEREUQCSA-N 1 1 347.337 2.505 10 5 EFBEMO CC[N@H+]1CC[C@H]2OCCN(C/C(C)=C/c3cccc([N+](=O)[O-])c3)[C@H]2C1 ZINC000556927604 479239421 /nfs/dbraw/zinc/23/94/21/479239421.db2.gz UNCKODLNLZODPQ-YOYDVCCWSA-N 1 1 345.443 2.793 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000593207467 479239972 /nfs/dbraw/zinc/23/99/72/479239972.db2.gz HVRYRIOIQMJIOW-UHFFFAOYSA-N 1 1 327.812 2.956 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1ccc([N+](=O)[O-])cn1)C1CCCCC1 ZINC000593248220 479260233 /nfs/dbraw/zinc/26/02/33/479260233.db2.gz CDILSAVSTBTRSE-UHFFFAOYSA-N 1 1 334.420 2.764 10 5 EFBEMO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1nccc2c1cccc2[N+](=O)[O-] ZINC000596361919 479265423 /nfs/dbraw/zinc/26/54/23/479265423.db2.gz MCMWGYZBPGMCIX-AWEZNQCLSA-N 1 1 345.447 2.827 10 5 EFBEMO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1nccc2c1cccc2[N+](=O)[O-] ZINC000596361919 479265431 /nfs/dbraw/zinc/26/54/31/479265431.db2.gz MCMWGYZBPGMCIX-AWEZNQCLSA-N 1 1 345.447 2.827 10 5 EFBEMO C[N@H+]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C[C@H]1C(C)(C)C ZINC000603147217 479273701 /nfs/dbraw/zinc/27/37/01/479273701.db2.gz XSOKBAFMVYQFCM-BBWFWOEESA-N 1 1 345.443 2.887 10 5 EFBEMO C[N@H+]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C[C@@H]1C(C)(C)C ZINC000603147225 479274558 /nfs/dbraw/zinc/27/45/58/479274558.db2.gz XSOKBAFMVYQFCM-GVDBMIGSSA-N 1 1 345.443 2.887 10 5 EFBEMO C[C@@H]1C[N@H+](CCNc2ccnc3cc([N+](=O)[O-])ccc32)[C@H](C)CO1 ZINC000596426905 479290126 /nfs/dbraw/zinc/29/01/26/479290126.db2.gz CXMWNEMYYDKNRJ-CHWSQXEVSA-N 1 1 330.388 2.664 10 5 EFBEMO C[C@@H]1C[N@@H+](CCNc2ccnc3cc([N+](=O)[O-])ccc32)[C@H](C)CO1 ZINC000596426905 479290132 /nfs/dbraw/zinc/29/01/32/479290132.db2.gz CXMWNEMYYDKNRJ-CHWSQXEVSA-N 1 1 330.388 2.664 10 5 EFBEMO CC[C@@H](NC(=O)N(CC)[C@H]1CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000596456930 479302485 /nfs/dbraw/zinc/30/24/85/479302485.db2.gz UZOKCRWXMFILQW-JKSUJKDBSA-N 1 1 334.420 2.782 10 5 EFBEMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(c2ccncc2[N+](=O)[O-])C1 ZINC000596461369 479305448 /nfs/dbraw/zinc/30/54/48/479305448.db2.gz HOCITJAYZPAEGB-MRXNPFEDSA-N 1 1 326.400 2.743 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000585717001 479315764 /nfs/dbraw/zinc/31/57/64/479315764.db2.gz SQMMAJGOJAUPRW-DOTOQJQBSA-N 1 1 333.432 2.843 10 5 EFBEMO CCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)C1 ZINC000596516005 479324290 /nfs/dbraw/zinc/32/42/90/479324290.db2.gz BQFGZCIMRJMEHZ-JTQLQIEISA-N 1 1 341.795 2.931 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553524 479331198 /nfs/dbraw/zinc/33/11/98/479331198.db2.gz YBPAVUXGXOTFOL-DFBGVHRSSA-N 1 1 335.429 2.892 10 5 EFBEMO Cc1cnc(CC[N@H+](C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)s1 ZINC000611275040 479333177 /nfs/dbraw/zinc/33/31/77/479333177.db2.gz RESPWLHOHXFWKZ-UHFFFAOYSA-N 1 1 349.412 2.805 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000596543421 479334489 /nfs/dbraw/zinc/33/44/89/479334489.db2.gz UCLQUXXUMVCFRK-UHFFFAOYSA-N 1 1 343.449 2.531 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000596544103 479335552 /nfs/dbraw/zinc/33/55/52/479335552.db2.gz YAJNUKARGVEQKU-UHFFFAOYSA-N 1 1 349.478 2.592 10 5 EFBEMO O=[N+]([O-])c1ccc2c(c1)nccc2N1CC[NH+](Cc2cccnc2)CC1 ZINC000593459028 479349273 /nfs/dbraw/zinc/34/92/73/479349273.db2.gz VXBLNUQXACSSRD-UHFFFAOYSA-N 1 1 349.394 2.860 10 5 EFBEMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2cc(N)c([N+](=O)[O-])c(CO)c2)C1 ZINC000587344471 479370571 /nfs/dbraw/zinc/37/05/71/479370571.db2.gz KBEYYJNZBKAYOG-GUTXKFCHSA-N 1 1 348.447 2.511 10 5 EFBEMO C[C@@H]1CCC[N@@H+](CCCCNc2cc(N)c([N+](=O)[O-])c(CO)c2)C1 ZINC000587240127 479370766 /nfs/dbraw/zinc/37/07/66/479370766.db2.gz ODQQWIHSAAPPPX-CYBMUJFWSA-N 1 1 336.436 2.593 10 5 EFBEMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2cc(N)c([N+](=O)[O-])c(CO)c2)C1 ZINC000587344482 479370820 /nfs/dbraw/zinc/37/08/20/479370820.db2.gz KBEYYJNZBKAYOG-VNHYZAJKSA-N 1 1 348.447 2.511 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H]2CCC[C@@H]21 ZINC000599661107 479376823 /nfs/dbraw/zinc/37/68/23/479376823.db2.gz SCWOOSQOUZYVOS-ZACQAIPSSA-N 1 1 348.399 2.637 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@H]21 ZINC000599662768 479378357 /nfs/dbraw/zinc/37/83/57/479378357.db2.gz XJLWZOAQEHGAOZ-BBWFWOEESA-N 1 1 348.399 2.637 10 5 EFBEMO O=C(C[N@H+]1CCCC2(CC2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000599672914 479383698 /nfs/dbraw/zinc/38/36/98/479383698.db2.gz JPLSQGMUPHFUIE-UHFFFAOYSA-N 1 1 329.400 2.750 10 5 EFBEMO CC[C@H](NC(=O)N1CC[N@@H+](C)C(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000603434989 479384695 /nfs/dbraw/zinc/38/46/95/479384695.db2.gz VWXCKRRGGAQPKO-HNNXBMFYSA-N 1 1 334.420 2.782 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599693850 479394133 /nfs/dbraw/zinc/39/41/33/479394133.db2.gz NNFCIWFWJCQEAZ-AWEZNQCLSA-N 1 1 348.403 2.742 10 5 EFBEMO COC(=O)C1C[C@@H](C)[NH+](Cc2ccc([N+](=O)[O-])cc2OC)[C@H](C)C1 ZINC000599699732 479396838 /nfs/dbraw/zinc/39/68/38/479396838.db2.gz YTNOABCPCVRNGN-VXGBXAGGSA-N 1 1 336.388 2.765 10 5 EFBEMO COC(=O)C1C[C@@H](C)[NH+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000599709110 479401208 /nfs/dbraw/zinc/40/12/08/479401208.db2.gz PLGKAKIYCNMTES-VXGBXAGGSA-N 1 1 336.388 2.765 10 5 EFBEMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+](C)C1 ZINC000611554636 479414121 /nfs/dbraw/zinc/41/41/21/479414121.db2.gz JJYQWQYWHOQBHU-LBPRGKRZSA-N 1 1 337.445 2.921 10 5 EFBEMO COC[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000593669879 479417691 /nfs/dbraw/zinc/41/76/91/479417691.db2.gz BYIMPOPRCSGZSX-QWHCGFSZSA-N 1 1 348.424 2.905 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@@H]4C[C@H]3C[S@@]4=O)o2)cc1 ZINC000593686472 479423277 /nfs/dbraw/zinc/42/32/77/479423277.db2.gz FLVLLRNTIOKAJS-HMFCALDFSA-N 1 1 332.381 2.560 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H]4C[C@H]3C[S@@]4=O)o2)cc1 ZINC000593686472 479423280 /nfs/dbraw/zinc/42/32/80/479423280.db2.gz FLVLLRNTIOKAJS-HMFCALDFSA-N 1 1 332.381 2.560 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@H](OC(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000611579289 479423655 /nfs/dbraw/zinc/42/36/55/479423655.db2.gz UZTVBWVEIRIUDI-NSHDSACASA-N 1 1 343.330 2.627 10 5 EFBEMO Cc1cc[nH+]c(N2CCN(c3nc(C)cc(C)c3[N+](=O)[O-])CC2)c1 ZINC000611617161 479430289 /nfs/dbraw/zinc/43/02/89/479430289.db2.gz LHPHQGDRHPPZCN-UHFFFAOYSA-N 1 1 327.388 2.637 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000603833260 479434063 /nfs/dbraw/zinc/43/40/63/479434063.db2.gz DBKLHPQWUHRFQJ-CYBMUJFWSA-N 1 1 328.372 2.773 10 5 EFBEMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599833936 479445742 /nfs/dbraw/zinc/44/57/42/479445742.db2.gz AYGPOFSUEMCKGP-LBPRGKRZSA-N 1 1 345.403 2.993 10 5 EFBEMO CCN(C(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H]1CC[N@@H+](CC)C1 ZINC000596843322 479451722 /nfs/dbraw/zinc/45/17/22/479451722.db2.gz KCHKWSAKOMOYDZ-ZDUSSCGKSA-N 1 1 336.392 2.551 10 5 EFBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCOCC2(CC2)C1 ZINC000611815435 479491402 /nfs/dbraw/zinc/49/14/02/479491402.db2.gz CYRANXOJLXMDLI-LBPRGKRZSA-N 1 1 344.371 2.818 10 5 EFBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCOCC2(CC2)C1 ZINC000611815435 479491407 /nfs/dbraw/zinc/49/14/07/479491407.db2.gz CYRANXOJLXMDLI-LBPRGKRZSA-N 1 1 344.371 2.818 10 5 EFBEMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000575945402 479508311 /nfs/dbraw/zinc/50/83/11/479508311.db2.gz AYKBLHOKXMZKFL-ZDUSSCGKSA-N 1 1 335.404 2.550 10 5 EFBEMO CC[N@@H+](CCc1nccs1)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000589502632 479533961 /nfs/dbraw/zinc/53/39/61/479533961.db2.gz 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CCOC(=O)c1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000600157793 479549754 /nfs/dbraw/zinc/54/97/54/479549754.db2.gz XWJFVONCSOSLKU-UHFFFAOYSA-N 1 1 329.356 2.765 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](OC3CCC3)C2)c1 ZINC000594021240 479551915 /nfs/dbraw/zinc/55/19/15/479551915.db2.gz PTFFNAFRBLRKCR-INIZCTEOSA-N 1 1 348.399 2.915 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](OC3CCC3)C2)c1 ZINC000594021240 479551921 /nfs/dbraw/zinc/55/19/21/479551921.db2.gz PTFFNAFRBLRKCR-INIZCTEOSA-N 1 1 348.399 2.915 10 5 EFBEMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597092743 479568628 /nfs/dbraw/zinc/56/86/28/479568628.db2.gz RWDCOYXEIPVMGP-VIFPVBQESA-N 1 1 343.815 2.681 10 5 EFBEMO O=[N+]([O-])c1cnc2ccccc2c1NCC[NH+]1Cc2ccccc2C1 ZINC000589860704 479577269 /nfs/dbraw/zinc/57/72/69/479577269.db2.gz IILCWNUKRFDIEL-UHFFFAOYSA-N 1 1 334.379 2.993 10 5 EFBEMO C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000590044639 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QEIGXOHVXAYPAC-LBPRGKRZSA-N 1 1 347.371 2.550 10 5 EFBEMO C[N@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C[C@@H]1CC=CCC1 ZINC000344068208 536173765 /nfs/dbraw/zinc/17/37/65/536173765.db2.gz QEIGXOHVXAYPAC-GFCCVEGCSA-N 1 1 347.371 2.550 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])cc1F ZINC000362312845 536752966 /nfs/dbraw/zinc/75/29/66/536752966.db2.gz BDCNQQHCAOAJIS-CHWSQXEVSA-N 1 1 338.379 2.991 10 5 EFBEMO C[N@@H+]1CCC[C@@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000683541628 549915097 /nfs/dbraw/zinc/91/50/97/549915097.db2.gz LRTAWIIXOPCIGF-CYBMUJFWSA-N 1 1 335.407 2.505 10 5 EFBEMO C[N@H+]1CCC[C@@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000683541628 549915098 /nfs/dbraw/zinc/91/50/98/549915098.db2.gz LRTAWIIXOPCIGF-CYBMUJFWSA-N 1 1 335.407 2.505 10 5 EFBEMO CC[N@@H+](CCc1nccs1)Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000753982534 575370229 /nfs/dbraw/zinc/37/02/29/575370229.db2.gz VCSIPKXVWMUADN-UHFFFAOYSA-N 1 1 346.416 2.627 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(OCCCO)CC2)c1 ZINC000756907730 575800049 /nfs/dbraw/zinc/80/00/49/575800049.db2.gz ZLDNPHMFZHVZOT-UHFFFAOYSA-N 1 1 328.796 2.612 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761291813 576141043 /nfs/dbraw/zinc/14/10/43/576141043.db2.gz KBUAOJGIWCPLOO-CABCVRRESA-N 1 1 344.415 2.959 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@@H+]1CC=C(C)CC1 ZINC000762702756 576325902 /nfs/dbraw/zinc/32/59/02/576325902.db2.gz JVXWHOVYIMUCDX-SQFISAMPSA-N 1 1 329.400 2.766 10 5 EFBEMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000773216167 581406346 /nfs/dbraw/zinc/40/63/46/581406346.db2.gz XAFHTCBEHHRKKA-UHFFFAOYSA-N 1 1 346.431 2.585 10 5 EFBEMO Cc1ccc(F)c(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC001690979255 1247909437 /nfs/dbraw/zinc/90/94/37/1247909437.db2.gz LFLUIYJAIHSYCI-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO Cc1ccc(F)c(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC001690979255 1247909442 /nfs/dbraw/zinc/90/94/42/1247909442.db2.gz LFLUIYJAIHSYCI-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ccc(C)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC001691005658 1247918700 /nfs/dbraw/zinc/91/87/00/1247918700.db2.gz AJTHSSOYHFOMEA-UHFFFAOYSA-N 1 1 331.372 2.748 10 5 EFBEMO CO[C@H]1CC[C@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000851035539 1250766173 /nfs/dbraw/zinc/76/61/73/1250766173.db2.gz QDESCTGNJYSJOM-XIRDDKMYSA-N 1 1 348.399 2.527 10 5 EFBEMO CO[C@H]1CC[C@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000851035539 1250766196 /nfs/dbraw/zinc/76/61/96/1250766196.db2.gz QDESCTGNJYSJOM-XIRDDKMYSA-N 1 1 348.399 2.527 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cccnc1 ZINC001484731058 1252827971 /nfs/dbraw/zinc/82/79/71/1252827971.db2.gz KHAZSPUIPTZPMH-UHFFFAOYSA-N 1 1 342.399 2.584 10 5 EFBEMO C[C@@H]1CN(Cc2cc([N+](=O)[O-])ccc2Br)CC[C@H]1C[NH3+] ZINC000923494413 1261779875 /nfs/dbraw/zinc/77/98/75/1261779875.db2.gz WYRJFBOKXSIWFZ-MNOVXSKESA-N 1 1 342.237 2.774 10 5 EFBEMO Cc1ccc(CNC2CC[NH+](C[C@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000733329412 1265172290 /nfs/dbraw/zinc/17/22/90/1265172290.db2.gz SOOPTMODLYQTGO-QGZVFWFLSA-N 1 1 333.432 2.636 10 5 EFBEMO Cc1ccc(CNC2CC[NH+](C[C@@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000733329411 1265173063 /nfs/dbraw/zinc/17/30/63/1265173063.db2.gz SOOPTMODLYQTGO-KRWDZBQOSA-N 1 1 333.432 2.636 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(c2ccnc(F)c2)CC1 ZINC000824805677 1278292611 /nfs/dbraw/zinc/29/26/11/1278292611.db2.gz NWPRLERZRRQUJN-UHFFFAOYSA-N 1 1 330.363 2.760 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]([C@H](O)C(F)(F)F)C2)cc1Cl ZINC000825123693 1278418843 /nfs/dbraw/zinc/41/88/43/1278418843.db2.gz BVMLACAROCKPGC-CABZTGNLSA-N 1 1 338.713 2.993 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]([C@H](O)C(F)(F)F)C2)cc1Cl ZINC000825123693 1278418846 /nfs/dbraw/zinc/41/88/46/1278418846.db2.gz BVMLACAROCKPGC-CABZTGNLSA-N 1 1 338.713 2.993 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H]([C@H](O)C(F)(F)F)C2)ccc1Cl ZINC000825124449 1278420356 /nfs/dbraw/zinc/42/03/56/1278420356.db2.gz QAEYMWYIOSPQPF-SKDRFNHKSA-N 1 1 338.713 2.993 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H]([C@H](O)C(F)(F)F)C2)ccc1Cl ZINC000825124449 1278420365 /nfs/dbraw/zinc/42/03/65/1278420365.db2.gz QAEYMWYIOSPQPF-SKDRFNHKSA-N 1 1 338.713 2.993 10 5 EFBEMO COC(=O)/C=C\c1ccc(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000742412366 1270039321 /nfs/dbraw/zinc/03/93/21/1270039321.db2.gz PUNJFXNVONRXBM-OJWNKBRNSA-N 1 1 333.388 2.676 10 5 EFBEMO O=[N+]([O-])c1cc(C[NH+]2CCC(Cn3cnnc3)CC2)ccc1Cl ZINC000844412216 1278958635 /nfs/dbraw/zinc/95/86/35/1278958635.db2.gz NJXIQTIBRPVHFF-UHFFFAOYSA-N 1 1 335.795 2.752 10 5 EFBEMO Cc1ccc(N2CC[NH+](C3CC3)CC2)c([N+](=O)[O-])c1Br ZINC000787896021 1275975808 /nfs/dbraw/zinc/97/58/08/1275975808.db2.gz DQNXMLWTIXNBET-UHFFFAOYSA-N 1 1 340.221 2.950 10 5 EFBEMO CN(C)Cc1cc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000819073251 1276621254 /nfs/dbraw/zinc/62/12/54/1276621254.db2.gz LNBZEJLOSJVRGN-SFHVURJKSA-N 1 1 347.390 2.619 10 5 EFBEMO C[C@H]1CCC[N@@H+](CCNC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001136224572 1276776151 /nfs/dbraw/zinc/77/61/51/1276776151.db2.gz ABTDGHHQLDQTGZ-LBPRGKRZSA-N 1 1 339.823 2.639 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CC[C@@]4(C3)CCCOC4)c2)c1 ZINC000789548124 1276803576 /nfs/dbraw/zinc/80/35/76/1276803576.db2.gz ZZUOEAXZCFWJBT-GOSISDBHSA-N 1 1 342.399 2.918 10 5 EFBEMO Cc1nn(C[N@H+]2CC[C@]3(C2)CCCOC3)c2ccc([N+](=O)[O-])cc12 ZINC000789566068 1276816365 /nfs/dbraw/zinc/81/63/65/1276816365.db2.gz NVRNKZRREYJJGR-KRWDZBQOSA-N 1 1 330.388 2.713 10 5 EFBEMO C/C(=C\C(=O)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2)c1ccc([N+](=O)[O-])cc1 ZINC000923271060 1277436915 /nfs/dbraw/zinc/43/69/15/1277436915.db2.gz JILLJFXNZZGLFM-HSYXRWIHSA-N 1 1 329.400 2.693 10 5 EFBEMO C/C(=C/C(=O)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2)c1ccc([N+](=O)[O-])cc1 ZINC000923271059 1277437787 /nfs/dbraw/zinc/43/77/87/1277437787.db2.gz JILLJFXNZZGLFM-FONJURLJSA-N 1 1 329.400 2.693 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000844658452 1279142803 /nfs/dbraw/zinc/14/28/03/1279142803.db2.gz YWRIBNCOAQJNDK-UHFFFAOYSA-N 1 1 327.812 2.956 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@@H]1C ZINC000844642812 1279162728 /nfs/dbraw/zinc/16/27/28/1279162728.db2.gz LPHVCSSPWHODJO-WERPAELLSA-N 1 1 331.416 2.938 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@H]1C ZINC000844642811 1279162901 /nfs/dbraw/zinc/16/29/01/1279162901.db2.gz LPHVCSSPWHODJO-HQZAUCPKSA-N 1 1 331.416 2.938 10 5 EFBEMO C[C@H]([NH2+]C[C@H](O)COc1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020234 1287401116 /nfs/dbraw/zinc/40/11/16/1287401116.db2.gz FXVUZJHDARROLF-STQMWFEESA-N 1 1 334.347 2.824 10 5 EFBEMO C[C@@H](NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872019575 1287401245 /nfs/dbraw/zinc/40/12/45/1287401245.db2.gz WXIQZYRMUUQPPB-HZSPNIEDSA-N 1 1 339.411 2.884 10 5 EFBEMO CCO[C@@H](CC[NH+](C)C)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872041669 1287409636 /nfs/dbraw/zinc/40/96/36/1287409636.db2.gz JRBJBPQIXUEEPF-STQMWFEESA-N 1 1 327.400 2.741 10 5 EFBEMO C[C@@H]([NH2+]C[C@@]1(N(C)C)CCSC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872039481 1287408299 /nfs/dbraw/zinc/40/82/99/1287408299.db2.gz FXCVOCUAFAKCLA-ABAIWWIYSA-N 1 1 327.425 2.822 10 5 EFBEMO C[C@H]([NH2+]CC[S@](=O)CC(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872085880 1287424493 /nfs/dbraw/zinc/42/44/93/1287424493.db2.gz RNSRSYPCMFDDOO-ZCAPAMDOSA-N 1 1 342.314 2.696 10 5 EFBEMO C[C@@H](N[C@@H](C)CN(C)CCC[NH+](C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872086007 1287424842 /nfs/dbraw/zinc/42/48/42/1287424842.db2.gz SWIYXGGDHOYJBV-UONOGXRCSA-N 1 1 340.443 2.657 10 5 EFBEMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1 ZINC000846989778 1280675914 /nfs/dbraw/zinc/67/59/14/1280675914.db2.gz USAIIKVCWPXZFW-GRNBYLDVSA-N 1 1 331.416 2.941 10 5 EFBEMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)/C=C(/C)c1ccc([N+](=O)[O-])cc1 ZINC000846988513 1280676150 /nfs/dbraw/zinc/67/61/50/1280676150.db2.gz MHVQWFVVXVZMKD-HECSCLNYSA-N 1 1 331.416 2.941 10 5 EFBEMO CC1(C)[C@H]2[C@H](CCC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)[C@@H]1O ZINC000872255703 1287505197 /nfs/dbraw/zinc/50/51/97/1287505197.db2.gz CGIJSADUWPXNSM-BBWFWOEESA-N 1 1 334.416 2.845 10 5 EFBEMO COc1cc(C[N@@H+]2CCC[C@H]3[C@@H]2C(C)(C)[C@H]3O)c([N+](=O)[O-])cc1F ZINC000872261599 1287506024 /nfs/dbraw/zinc/50/60/24/1287506024.db2.gz IBUNYJRRALYZDO-XZJROXQQSA-N 1 1 338.379 2.724 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@H]3[C@@H]2C(C)(C)[C@H]3O)c([N+](=O)[O-])cc1F ZINC000872261599 1287506029 /nfs/dbraw/zinc/50/60/29/1287506029.db2.gz IBUNYJRRALYZDO-XZJROXQQSA-N 1 1 338.379 2.724 10 5 EFBEMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c([N+](=O)[O-])c1 ZINC000872280393 1287518506 /nfs/dbraw/zinc/51/85/06/1287518506.db2.gz RBFCQRLAKAYKMF-MRXNPFEDSA-N 1 1 347.415 2.617 10 5 EFBEMO C[N@H+]1CCCC[C@@H]1CCOC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000808563285 1281797457 /nfs/dbraw/zinc/79/74/57/1281797457.db2.gz JZPMKBWIOXNLKU-LLVKDONJSA-N 1 1 342.342 2.833 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@@H]1COC(=O)N(C)C ZINC000809709340 1282421054 /nfs/dbraw/zinc/42/10/54/1282421054.db2.gz PYMKHZZFHOIVGU-MRXNPFEDSA-N 1 1 335.404 2.956 10 5 EFBEMO C[C@H]1OCC[C@@H]1[N@H+](CCO)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809997925 1282733891 /nfs/dbraw/zinc/73/38/91/1282733891.db2.gz IZKJEYYXCDKPSE-RNCFNFMXSA-N 1 1 349.214 2.873 10 5 EFBEMO C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809997925 1282733900 /nfs/dbraw/zinc/73/39/00/1282733900.db2.gz IZKJEYYXCDKPSE-RNCFNFMXSA-N 1 1 349.214 2.873 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000810694014 1283528726 /nfs/dbraw/zinc/52/87/26/1283528726.db2.gz CGHHCQNAZXYTDU-KRWDZBQOSA-N 1 1 338.379 2.893 10 5 EFBEMO COC(=O)/C=C/c1ccc(N[C@@H](C)C[N@@H+](C)C(C)C)c([N+](=O)[O-])c1 ZINC000811848666 1284717404 /nfs/dbraw/zinc/71/74/04/1284717404.db2.gz NUCPTBXYNPOOSH-XOVSCCBYSA-N 1 1 335.404 2.922 10 5 EFBEMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1(CCF)CC1 ZINC000813171374 1285703198 /nfs/dbraw/zinc/70/31/98/1285703198.db2.gz JLHIZAWJYFALBC-HNNXBMFYSA-N 1 1 336.363 2.852 10 5 EFBEMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1(CCF)CC1 ZINC000813171374 1285703205 /nfs/dbraw/zinc/70/32/05/1285703205.db2.gz JLHIZAWJYFALBC-HNNXBMFYSA-N 1 1 336.363 2.852 10 5 EFBEMO CC(C)OCCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172984 1285703824 /nfs/dbraw/zinc/70/38/24/1285703824.db2.gz QBKOJAOACOEETM-INIZCTEOSA-N 1 1 336.388 2.527 10 5 EFBEMO CC(C)OCCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172984 1285703827 /nfs/dbraw/zinc/70/38/27/1285703827.db2.gz QBKOJAOACOEETM-INIZCTEOSA-N 1 1 336.388 2.527 10 5 EFBEMO CS[C@@H](C)CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174107 1285704095 /nfs/dbraw/zinc/70/40/95/1285704095.db2.gz PTOWMGUNGIWIMG-WFASDCNBSA-N 1 1 338.429 2.854 10 5 EFBEMO CS[C@@H](C)CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174107 1285704100 /nfs/dbraw/zinc/70/41/00/1285704100.db2.gz PTOWMGUNGIWIMG-WFASDCNBSA-N 1 1 338.429 2.854 10 5 EFBEMO COCCC1(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000813173273 1285705750 /nfs/dbraw/zinc/70/57/50/1285705750.db2.gz ZPIBCJIHYFQGAA-INIZCTEOSA-N 1 1 348.399 2.529 10 5 EFBEMO COCCC1(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000813173273 1285705763 /nfs/dbraw/zinc/70/57/63/1285705763.db2.gz ZPIBCJIHYFQGAA-INIZCTEOSA-N 1 1 348.399 2.529 10 5 EFBEMO C[C@H](C[N+](=O)[O-])OC(=O)[C@@H](C)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000814049541 1286277901 /nfs/dbraw/zinc/27/79/01/1286277901.db2.gz SICLYUGTCYCDQB-HUUCEWRRSA-N 1 1 334.416 2.538 10 5 EFBEMO CC(C)c1ccc(C(=O)N2C[C@H]3C[N@@H+](C)C[C@@]3(C)C2)cc1[N+](=O)[O-] ZINC001134550745 1286902482 /nfs/dbraw/zinc/90/24/82/1286902482.db2.gz MFJHLSHVXSCIGP-KDOFPFPSSA-N 1 1 331.416 2.742 10 5 EFBEMO C[C@@H]1CC[N@@H+](CC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000816845586 1288301221 /nfs/dbraw/zinc/30/12/21/1288301221.db2.gz WETWGSODYYCHCK-LLVKDONJSA-N 1 1 325.796 2.548 10 5 EFBEMO Cc1ccc(NCCNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)[nH+]c1 ZINC001178603192 1288834277 /nfs/dbraw/zinc/83/42/77/1288834277.db2.gz LOLQWZKZMBIXSM-UHFFFAOYSA-N 1 1 339.355 2.621 10 5 EFBEMO Cc1ccc(NC(=O)c2sccc2C[NH+](C)C)c(N)c1[N+](=O)[O-] ZINC001179875189 1289301519 /nfs/dbraw/zinc/30/15/19/1289301519.db2.gz NKTFKYQAZCLSHI-UHFFFAOYSA-N 1 1 334.401 2.861 10 5 EFBEMO C[N@@H+](CCNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000823961573 1289491214 /nfs/dbraw/zinc/49/12/14/1289491214.db2.gz HEBRILOSKFLDAI-UHFFFAOYSA-N 1 1 335.408 2.563 10 5 EFBEMO CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000824634881 1289734243 /nfs/dbraw/zinc/73/42/43/1289734243.db2.gz CJUGNNJGESJZSQ-MFKMUULPSA-N 1 1 343.221 2.950 10 5 EFBEMO CCCC[N@@H+](C)C[C@H](C)Nc1ccc(CC(=O)OC)cc1[N+](=O)[O-] ZINC001186626171 1290987877 /nfs/dbraw/zinc/98/78/77/1290987877.db2.gz FITBTAPOWIWFND-ZDUSSCGKSA-N 1 1 337.420 2.843 10 5 EFBEMO CN(C[C@@H]1CCC[N@H+]1C)c1ccc([N+](=O)[O-])cc1Br ZINC001186764438 1291015683 /nfs/dbraw/zinc/01/56/83/1291015683.db2.gz RQDRWYVJZYGTBD-NSHDSACASA-N 1 1 328.210 2.888 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H]1CCC3(CCOCC3)CO1)C2 ZINC000878303062 1291613301 /nfs/dbraw/zinc/61/33/01/1291613301.db2.gz GDMBKOOVXZBKSU-MRXNPFEDSA-N 1 1 346.427 2.929 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H]1CCC3(CCOCC3)CO1)C2 ZINC000878303062 1291613311 /nfs/dbraw/zinc/61/33/11/1291613311.db2.gz GDMBKOOVXZBKSU-MRXNPFEDSA-N 1 1 346.427 2.929 10 5 EFBEMO COC(=O)[C@]12CCC[C@H]1[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)CC2 ZINC000880184227 1292409746 /nfs/dbraw/zinc/40/97/46/1292409746.db2.gz XVVLFECADLIONS-ZBFHGGJFSA-N 1 1 340.326 2.791 10 5 EFBEMO COC(=O)[C@]12CCC[C@H]1[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)CC2 ZINC000880184227 1292409752 /nfs/dbraw/zinc/40/97/52/1292409752.db2.gz XVVLFECADLIONS-ZBFHGGJFSA-N 1 1 340.326 2.791 10 5 EFBEMO CC(=O)c1c(NCCC[N@H+]2CCCO[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000882265088 1293145978 /nfs/dbraw/zinc/14/59/78/1293145978.db2.gz PPCKDVPRCRHDAT-ZDUSSCGKSA-N 1 1 335.404 2.710 10 5 EFBEMO C[N@@H+](CCc1ccc2c(c1)OCO2)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000887095416 1295275192 /nfs/dbraw/zinc/27/51/92/1295275192.db2.gz LFZUBYGVIYAXGK-MRXNPFEDSA-N 1 1 344.367 2.531 10 5 EFBEMO Cc1cc(Cl)c(C(=O)N2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)cc1[N+](=O)[O-] ZINC000887925891 1295625953 /nfs/dbraw/zinc/62/59/53/1295625953.db2.gz UDELARZZEWXIPQ-BZNIZROVSA-N 1 1 337.807 2.580 10 5 EFBEMO C[N@H+]1C[C@@H]2CN(C(=O)c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)C[C@]2(C)C1 ZINC000887936343 1295628924 /nfs/dbraw/zinc/62/89/24/1295628924.db2.gz GBOZOJCDTVEDAO-KUHUBIRLSA-N 1 1 345.443 2.916 10 5 EFBEMO CC1(C(=O)NC/C=C/C[NH2+]Cc2csc([N+](=O)[O-])c2)CC=CC1 ZINC001274333112 1296065638 /nfs/dbraw/zinc/06/56/38/1296065638.db2.gz XABFNFVYCMEHGB-SNAWJCMRSA-N 1 1 335.429 2.775 10 5 EFBEMO C[N@H+]1CCCC[C@@H]1CCC(=O)OCCOc1ccc([N+](=O)[O-])cc1 ZINC000803854925 1313256007 /nfs/dbraw/zinc/25/60/07/1313256007.db2.gz ATSHTLSFPUPKFY-CQSZACIVSA-N 1 1 336.388 2.781 10 5 EFBEMO C[N@H+]1CCCC[C@@H]1CCC(=O)OCCOc1ccccc1[N+](=O)[O-] ZINC000803859939 1313266932 /nfs/dbraw/zinc/26/69/32/1313266932.db2.gz YZEADTBLEYLDGT-CQSZACIVSA-N 1 1 336.388 2.781 10 5 EFBEMO C[C@@H]1[C@H](NC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC[N@H+]1C ZINC000925341610 1296832007 /nfs/dbraw/zinc/83/20/07/1296832007.db2.gz PHOCPZOFSMJEDX-UKPHBRMFSA-N 1 1 346.431 2.576 10 5 EFBEMO COc1cc(C[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc(OC)c1 ZINC000776274492 1297338920 /nfs/dbraw/zinc/33/89/20/1297338920.db2.gz DJZNMRHPOVYUDQ-GOSISDBHSA-N 1 1 346.383 2.777 10 5 EFBEMO CCn1cc(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000688456509 1298354210 /nfs/dbraw/zinc/35/42/10/1298354210.db2.gz NQBQGIHNGRNKJX-UHFFFAOYSA-N 1 1 339.193 2.864 10 5 EFBEMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585845 1299653214 /nfs/dbraw/zinc/65/32/14/1299653214.db2.gz ANCNKVZUMVKQRG-UGSOOPFHSA-N 1 1 330.384 2.897 10 5 EFBEMO C[C@@]12COC[C@H]1C[N@H+](Cc1cccc([N+](=O)[O-])c1Br)C2 ZINC000852535553 1299742897 /nfs/dbraw/zinc/74/28/97/1299742897.db2.gz FLCAHAMHTVJKAR-BXUZGUMPSA-N 1 1 341.205 2.826 10 5 EFBEMO C[C@@]12COC[C@H]1C[N@@H+](Cc1cccc([N+](=O)[O-])c1Br)C2 ZINC000852535553 1299742905 /nfs/dbraw/zinc/74/29/05/1299742905.db2.gz FLCAHAMHTVJKAR-BXUZGUMPSA-N 1 1 341.205 2.826 10 5 EFBEMO C[C@]12COC[C@H]1C[N@H+](Cc1cccc([N+](=O)[O-])c1Br)C2 ZINC000852535555 1299743368 /nfs/dbraw/zinc/74/33/68/1299743368.db2.gz FLCAHAMHTVJKAR-RISCZKNCSA-N 1 1 341.205 2.826 10 5 EFBEMO C[C@]12COC[C@H]1C[N@@H+](Cc1cccc([N+](=O)[O-])c1Br)C2 ZINC000852535555 1299743377 /nfs/dbraw/zinc/74/33/77/1299743377.db2.gz FLCAHAMHTVJKAR-RISCZKNCSA-N 1 1 341.205 2.826 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CC[C@@H]4COC[C@@H]4C3)c2c1 ZINC000853587443 1300180832 /nfs/dbraw/zinc/18/08/32/1300180832.db2.gz KKPOXMBIJLOLRC-MNOVXSKESA-N 1 1 335.385 2.798 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CC[C@@H]4COC[C@@H]4C3)c2c1 ZINC000853587443 1300180838 /nfs/dbraw/zinc/18/08/38/1300180838.db2.gz KKPOXMBIJLOLRC-MNOVXSKESA-N 1 1 335.385 2.798 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CC[C@@H]4COC[C@H]4C3)c2c1 ZINC000853587442 1300181153 /nfs/dbraw/zinc/18/11/53/1300181153.db2.gz KKPOXMBIJLOLRC-GHMZBOCLSA-N 1 1 335.385 2.798 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CC[C@@H]4COC[C@H]4C3)c2c1 ZINC000853587442 1300181155 /nfs/dbraw/zinc/18/11/55/1300181155.db2.gz KKPOXMBIJLOLRC-GHMZBOCLSA-N 1 1 335.385 2.798 10 5 EFBEMO Cn1c[nH+]cc1CCOc1cc(F)c(Br)cc1[N+](=O)[O-] ZINC000853693145 1300233796 /nfs/dbraw/zinc/23/37/96/1300233796.db2.gz OKUYRXVEESUTBD-UHFFFAOYSA-N 1 1 344.140 2.851 10 5 EFBEMO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000853964834 1300367479 /nfs/dbraw/zinc/36/74/79/1300367479.db2.gz BRGXFFODRJASGZ-CYBMUJFWSA-N 1 1 341.358 2.568 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC000854735833 1300682811 /nfs/dbraw/zinc/68/28/11/1300682811.db2.gz YBPRCHNHWKQFIA-LBKOFNPBSA-N 1 1 343.427 2.942 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CC[N@H+](C(C)(C)C)C1 ZINC000855286361 1300888253 /nfs/dbraw/zinc/88/82/53/1300888253.db2.gz PQCUGHOYIDNTJR-FQNOHDAGSA-N 1 1 331.416 2.987 10 5 EFBEMO CC(C)[N@@H+](C)C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1 ZINC000089869435 1300921237 /nfs/dbraw/zinc/92/12/37/1300921237.db2.gz JTMQZCBVIHNGBO-RMKNXTFCSA-N 1 1 331.416 2.939 10 5 EFBEMO CCN(C(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](CC)C1 ZINC000855489599 1300979471 /nfs/dbraw/zinc/97/94/71/1300979471.db2.gz AVMQIAMYJQAZPT-VSOYFRJCSA-N 1 1 331.416 2.941 10 5 EFBEMO C[C@@H]1[C@H](C)N(C(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC[N@@H+]1C ZINC000860564416 1301846394 /nfs/dbraw/zinc/84/63/94/1301846394.db2.gz SDZUSHYZVDOWOP-OLZOCXBDSA-N 1 1 327.384 2.913 10 5 EFBEMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)nc1-c1ccccn1 ZINC000863294646 1302578955 /nfs/dbraw/zinc/57/89/55/1302578955.db2.gz KYWLBPRMGPSPPZ-OLZOCXBDSA-N 1 1 345.428 2.781 10 5 EFBEMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)nc1-c1ccccn1 ZINC000863294646 1302578965 /nfs/dbraw/zinc/57/89/65/1302578965.db2.gz KYWLBPRMGPSPPZ-OLZOCXBDSA-N 1 1 345.428 2.781 10 5 EFBEMO COCC[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2C(F)F)CC1 ZINC000865445849 1303260042 /nfs/dbraw/zinc/26/00/42/1303260042.db2.gz KCSVRZCICAQPMR-UHFFFAOYSA-N 1 1 329.347 2.691 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CC(C[NH+]2CCOCC2)C1 ZINC000865824316 1303419816 /nfs/dbraw/zinc/41/98/16/1303419816.db2.gz KLIWRZHVROUMSB-UHFFFAOYSA-N 1 1 346.214 2.670 10 5 EFBEMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1c2ccccc2C[N@H+]1C ZINC000866195575 1303559412 /nfs/dbraw/zinc/55/94/12/1303559412.db2.gz XMNBNWSOBFPCKF-KRWDZBQOSA-N 1 1 340.383 2.553 10 5 EFBEMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1c2ccccc2C[N@@H+]1C ZINC000866195575 1303559416 /nfs/dbraw/zinc/55/94/16/1303559416.db2.gz XMNBNWSOBFPCKF-KRWDZBQOSA-N 1 1 340.383 2.553 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3cc(Br)ccc3[N+](=O)[O-])CC[C@H]21 ZINC000866204682 1303561925 /nfs/dbraw/zinc/56/19/25/1303561925.db2.gz FZRYMSIREMVJBR-CMPLNLGQSA-N 1 1 340.221 2.888 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(c3ncc([N+](=O)[O-])cc3C(F)(F)F)CC[C@@H]21 ZINC000866206989 1303562580 /nfs/dbraw/zinc/56/25/80/1303562580.db2.gz GYRYZWXDNLKYNF-SKDRFNHKSA-N 1 1 330.310 2.539 10 5 EFBEMO Cc1cc(N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000866206913 1303563062 /nfs/dbraw/zinc/56/30/62/1303563062.db2.gz GJYVHUAEVKSXQZ-DYVFJYSZSA-N 1 1 326.400 2.982 10 5 EFBEMO Cc1cc(N2CC[C@H]3[C@H](CC[N@@H+]3C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000866206913 1303563067 /nfs/dbraw/zinc/56/30/67/1303563067.db2.gz GJYVHUAEVKSXQZ-DYVFJYSZSA-N 1 1 326.400 2.982 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3ncc([N+](=O)[O-])cc3C(F)(F)F)CC[C@@H]21 ZINC000866206987 1303563129 /nfs/dbraw/zinc/56/31/29/1303563129.db2.gz GYRYZWXDNLKYNF-CABZTGNLSA-N 1 1 330.310 2.539 10 5 EFBEMO C[C@]([NH3+])(C(=O)N1CC2C[C@@H]3CC1C[C@H](C2)C3)c1cccc([N+](=O)[O-])c1 ZINC000867953555 1304041245 /nfs/dbraw/zinc/04/12/45/1304041245.db2.gz ZTRUFHQOYUWLGG-BMGKVLATSA-N 1 1 343.427 2.806 10 5 EFBEMO C[C@@]([NH3+])(C(=O)N(CCC1CC1)CC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000867987550 1304061484 /nfs/dbraw/zinc/06/14/84/1304061484.db2.gz NGUPPDXBBIFUKH-SFHVURJKSA-N 1 1 331.416 2.807 10 5 EFBEMO Cc1ccc(CNC(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000868758105 1304458385 /nfs/dbraw/zinc/45/83/85/1304458385.db2.gz LVNKCDRKTJDNQJ-AWEZNQCLSA-N 1 1 334.420 2.575 10 5 EFBEMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000869053149 1304591919 /nfs/dbraw/zinc/59/19/19/1304591919.db2.gz 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ZINC001502192866 1404075221 /nfs/dbraw/zinc/07/52/21/1404075221.db2.gz HREQSSVGFLOWCI-SJLPKXTDSA-N 1 1 347.459 2.557 10 5 EFBEMO Cc1cc(C)c(C[N@@H+](C)CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1 ZINC001502192866 1404075225 /nfs/dbraw/zinc/07/52/25/1404075225.db2.gz HREQSSVGFLOWCI-SJLPKXTDSA-N 1 1 347.459 2.557 10 5 EFBEMO Cc1cc(C)c(C[N@H+](C)CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1 ZINC001502192866 1404075233 /nfs/dbraw/zinc/07/52/33/1404075233.db2.gz HREQSSVGFLOWCI-SJLPKXTDSA-N 1 1 347.459 2.557 10 5 EFBEMO COCC[N@@H+](C)CCCNc1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC001559068339 1415222573 /nfs/dbraw/zinc/22/25/73/1415222573.db2.gz XWIAJWPBSCRIPK-UHFFFAOYSA-N 1 1 335.326 2.994 10 5 EFBEMO CCC[C@H]1CN(c2nn(C)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC001559150659 1415226363 /nfs/dbraw/zinc/22/63/63/1415226363.db2.gz FVGYRFXLSKGQHA-INIZCTEOSA-N 1 1 343.431 2.819 10 5 EFBEMO COC(=O)[C@@H]([NH2+]CCCNc1cc(Cl)ccc1[N+](=O)[O-])C(C)C ZINC001559198596 1415229403 /nfs/dbraw/zinc/22/94/03/1415229403.db2.gz SWIYOWQZNLAWLP-AWEZNQCLSA-N 1 1 343.811 2.837 10 5 EFBEMO CCC[N@H+]1CC[C@H](Nc2c(Cl)cc([N+](=O)[O-])cc2C(=O)OC)C1 ZINC001559244702 1415233444 /nfs/dbraw/zinc/23/34/44/1415233444.db2.gz ZDPQNXYICBAXQG-JTQLQIEISA-N 1 1 341.795 2.931 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)cc1C ZINC001559304242 1415238807 /nfs/dbraw/zinc/23/88/07/1415238807.db2.gz QGDNSXRTWSZBIH-NWANDNLSSA-N 1 1 347.415 2.832 10 5 EFBEMO CCOC(=O)CC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)CC1CC1 ZINC001559510801 1415249418 /nfs/dbraw/zinc/24/94/18/1415249418.db2.gz WSFHBEIBFINUBF-UHFFFAOYSA-N 1 1 336.388 2.769 10 5 EFBEMO CCC1(CO)CC[NH+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC001559658292 1415252817 /nfs/dbraw/zinc/25/28/17/1415252817.db2.gz FMSIWDVPILCWKS-UHFFFAOYSA-N 1 1 346.387 2.629 10 5 EFBEMO O=C(CC[N@@H+]1CCC[C@H]1c1ncccn1)Nc1ccc([N+](=O)[O-])cc1 ZINC001560014285 1415260736 /nfs/dbraw/zinc/26/07/36/1415260736.db2.gz OSSAIEYEPLGKAG-HNNXBMFYSA-N 1 1 341.371 2.551 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@H]1c1ncccn1)Nc1ccc([N+](=O)[O-])cc1 ZINC001560014285 1415260739 /nfs/dbraw/zinc/26/07/39/1415260739.db2.gz OSSAIEYEPLGKAG-HNNXBMFYSA-N 1 1 341.371 2.551 10 5 EFBEMO O=C(CC[N@@H+]1CCC[C@@H]1c1ncccn1)Nc1ccc([N+](=O)[O-])cc1 ZINC001560014286 1415260763 /nfs/dbraw/zinc/26/07/63/1415260763.db2.gz OSSAIEYEPLGKAG-OAHLLOKOSA-N 1 1 341.371 2.551 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@@H]1c1ncccn1)Nc1ccc([N+](=O)[O-])cc1 ZINC001560014286 1415260766 /nfs/dbraw/zinc/26/07/66/1415260766.db2.gz OSSAIEYEPLGKAG-OAHLLOKOSA-N 1 1 341.371 2.551 10 5 EFBEMO CC(C)(O)C1CC[NH+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC001560074728 1415262694 /nfs/dbraw/zinc/26/26/94/1415262694.db2.gz CMFNEUMMAJDBEV-UHFFFAOYSA-N 1 1 346.387 2.628 10 5 EFBEMO Cc1nccnc1[C@H](C)[NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC001560124253 1415264129 /nfs/dbraw/zinc/26/41/29/1415264129.db2.gz RFTLONQUAZZTBW-STQMWFEESA-N 1 1 343.387 2.679 10 5 EFBEMO COCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc(C)c(C)c1 ZINC001560149412 1415264988 /nfs/dbraw/zinc/26/49/88/1415264988.db2.gz JDLRIUKATLAOQH-UHFFFAOYSA-N 1 1 332.404 2.557 10 5 EFBEMO CC(C)C1(O)CC[NH+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC001560224284 1415268555 /nfs/dbraw/zinc/26/85/55/1415268555.db2.gz SSQGCUSHKAMUAJ-UHFFFAOYSA-N 1 1 346.387 2.628 10 5 EFBEMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC001565800018 1415416765 /nfs/dbraw/zinc/41/67/65/1415416765.db2.gz VJRDBSKGDTXUDK-LLVKDONJSA-N 1 1 325.796 2.662 10 5 EFBEMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC001567356447 1416087140 /nfs/dbraw/zinc/08/71/40/1416087140.db2.gz WFTFKKHRPCATRR-NSHDSACASA-N 1 1 325.796 2.851 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1cscn1)Cc1ccc([N+](=O)[O-])cc1 ZINC001567423162 1416131349 /nfs/dbraw/zinc/13/13/49/1416131349.db2.gz IUTMJIQMVABDMC-UHFFFAOYSA-N 1 1 348.428 2.693 10 5 EFBEMO O=C(Cc1ccco1)NCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001567451687 1416145415 /nfs/dbraw/zinc/14/54/15/1416145415.db2.gz ARVHKLDWNUELKA-UHFFFAOYSA-N 1 1 343.383 2.511 10 5 EFBEMO C=C/C(C)=C/CC(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001567838057 1416294565 /nfs/dbraw/zinc/29/45/65/1416294565.db2.gz SNEJAUBXIUVFFU-VGOFMYFVSA-N 1 1 329.400 2.665 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1ccsc1 ZINC001568473396 1416540896 /nfs/dbraw/zinc/54/08/96/1416540896.db2.gz YDLKJARGKKRFOF-UHFFFAOYSA-N 1 1 347.440 2.789 10 5 EFBEMO Cc1cc(C(=O)NCCC[N@@H+](C)Cc2csc([N+](=O)[O-])c2)co1 ZINC001712943480 1418288894 /nfs/dbraw/zinc/28/88/94/1418288894.db2.gz ADGBGVTYTJOWOI-UHFFFAOYSA-N 1 1 337.401 2.810 10 5 EFBEMO Cc1cc(C(=O)NCCC[N@H+](C)Cc2csc([N+](=O)[O-])c2)co1 ZINC001712943480 1418288899 /nfs/dbraw/zinc/28/88/99/1418288899.db2.gz ADGBGVTYTJOWOI-UHFFFAOYSA-N 1 1 337.401 2.810 10 5 EFBEMO CC/C=C(\C)C(=O)N1C[C@@H]2C[N@@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001717008652 1419144347 /nfs/dbraw/zinc/14/43/47/1419144347.db2.gz RZNVPVMFKPWIAG-COGRFCOTSA-N 1 1 349.456 2.903 10 5 EFBEMO CC/C=C(\C)C(=O)N1C[C@@H]2C[N@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001717008652 1419144350 /nfs/dbraw/zinc/14/43/50/1419144350.db2.gz RZNVPVMFKPWIAG-COGRFCOTSA-N 1 1 349.456 2.903 10 5 EFBEMO CC/C(C)=C\C(=O)N1C[C@@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001717010188 1419145768 /nfs/dbraw/zinc/14/57/68/1419145768.db2.gz UOOABYHTBKSMNV-SOAPFZLESA-N 1 1 343.427 2.841 10 5 EFBEMO CCc1cccc(C[N@@H+](C)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C(C)C)c1 ZINC001717946744 1419623569 /nfs/dbraw/zinc/62/35/69/1419623569.db2.gz DJMHGEAGPXOJBO-QZTJIDSGSA-N 1 1 347.459 2.583 10 5 EFBEMO CCc1cccc(C[N@H+](C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)c1 ZINC001717946744 1419623571 /nfs/dbraw/zinc/62/35/71/1419623571.db2.gz DJMHGEAGPXOJBO-QZTJIDSGSA-N 1 1 347.459 2.583 10 5 EFBEMO CCc1cccc(C[N@@H+](C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)c1 ZINC001717946744 1419623573 /nfs/dbraw/zinc/62/35/73/1419623573.db2.gz DJMHGEAGPXOJBO-QZTJIDSGSA-N 1 1 347.459 2.583 10 5 EFBEMO Cc1cc(C(=O)NCC2([NH2+]Cc3csc([N+](=O)[O-])c3)CC2)c(C)[nH]1 ZINC001723559440 1424523403 /nfs/dbraw/zinc/52/34/03/1424523403.db2.gz BINLHXPVRPKNAO-UHFFFAOYSA-N 1 1 348.428 2.653 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)CC(F)(F)F ZINC001724848900 1425068666 /nfs/dbraw/zinc/06/86/66/1425068666.db2.gz UWALASONFDFQED-UHFFFAOYSA-N 1 1 347.337 2.828 10 5 EFBEMO Cc1cc[nH]c1C(=O)N(C)CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001724851312 1425069901 /nfs/dbraw/zinc/06/99/01/1425069901.db2.gz FEFQUMPBPLORHW-UHFFFAOYSA-N 1 1 344.415 2.825 10 5 EFBEMO Cc1cccc(C)c1C[N@H+](C)CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(C)C ZINC001725729538 1425800849 /nfs/dbraw/zinc/80/08/49/1425800849.db2.gz YEOJWXZYURMEFJ-SJLPKXTDSA-N 1 1 347.459 2.637 10 5 EFBEMO Cc1cccc(C)c1C[N@@H+](C)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C(C)C ZINC001725729538 1425800854 /nfs/dbraw/zinc/80/08/54/1425800854.db2.gz YEOJWXZYURMEFJ-SJLPKXTDSA-N 1 1 347.459 2.637 10 5 EFBEMO Cc1cccc(C)c1C[N@H+](C)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C(C)C ZINC001725729538 1425800856 /nfs/dbraw/zinc/80/08/56/1425800856.db2.gz YEOJWXZYURMEFJ-SJLPKXTDSA-N 1 1 347.459 2.637 10 5 EFBEMO C[C@@H]1CN(Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1CC[NH3+] ZINC000723902258 715006783 /nfs/dbraw/zinc/00/67/83/715006783.db2.gz NVMGBNYISXBQOJ-ZYHUDNBSSA-N 1 1 342.237 2.774 10 5 EFBEMO CC[C@H](NC(=O)N(C)[C@@H]1CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000893449127 715519578 /nfs/dbraw/zinc/51/95/78/715519578.db2.gz FMWXASHASQZIMG-CVEARBPZSA-N 1 1 334.420 2.782 10 5 EFBEMO CC[C@H](NC(=O)N1CC[C@@H]2[C@@H]1CCC[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000893452677 715560621 /nfs/dbraw/zinc/56/06/21/715560621.db2.gz WRZWCLKIFYDPOC-BBWFWOEESA-N 1 1 346.431 2.924 10 5 EFBEMO C[C@@H](O)C1CC[NH+](Cc2cccc([N+](=O)[O-])c2Br)CC1 ZINC000235311796 717178619 /nfs/dbraw/zinc/17/86/19/717178619.db2.gz IESHYIHKQTVDFI-SNVBAGLBSA-N 1 1 343.221 2.950 10 5 EFBEMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](CCO)C2)c1Br ZINC000236492831 718262248 /nfs/dbraw/zinc/26/22/48/718262248.db2.gz PPNHSNMLCYNHBO-JTQLQIEISA-N 1 1 329.194 2.562 10 5 EFBEMO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@H](CCO)C2)c1Br ZINC000236492831 718262251 /nfs/dbraw/zinc/26/22/51/718262251.db2.gz PPNHSNMLCYNHBO-JTQLQIEISA-N 1 1 329.194 2.562 10 5 EFBEMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](CCO)C2)c1Br ZINC000236497902 718264452 /nfs/dbraw/zinc/26/44/52/718264452.db2.gz PPNHSNMLCYNHBO-SNVBAGLBSA-N 1 1 329.194 2.562 10 5 EFBEMO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@H](CCO)C2)c1Br ZINC000236497902 718264454 /nfs/dbraw/zinc/26/44/54/718264454.db2.gz PPNHSNMLCYNHBO-SNVBAGLBSA-N 1 1 329.194 2.562 10 5 EFBEMO COC(=O)[C@@H]1[C@H](C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1(F)F ZINC000893945935 720178160 /nfs/dbraw/zinc/17/81/60/720178160.db2.gz OPKIRJDGHYQUCW-KBPBESRZSA-N 1 1 340.326 2.614 10 5 EFBEMO COC(=O)[C@@H]1[C@H](C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1(F)F ZINC000893945935 720178161 /nfs/dbraw/zinc/17/81/61/720178161.db2.gz OPKIRJDGHYQUCW-KBPBESRZSA-N 1 1 340.326 2.614 10 5 EFBEMO C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C[C@H](C)[C@H]1O ZINC000930997060 720632971 /nfs/dbraw/zinc/63/29/71/720632971.db2.gz WJDKRKRDWBFQNW-MSRIBSCDSA-N 1 1 343.221 2.806 10 5 EFBEMO C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C[C@H](C)[C@H]1O ZINC000930997060 720632973 /nfs/dbraw/zinc/63/29/73/720632973.db2.gz WJDKRKRDWBFQNW-MSRIBSCDSA-N 1 1 343.221 2.806 10 5 EFBEMO Cc1n[nH]cc1C[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000162768253 721088726 /nfs/dbraw/zinc/08/87/26/721088726.db2.gz FSRVKVBIORWFMG-UHFFFAOYSA-N 1 1 325.166 2.679 10 5 EFBEMO C[C@H]1C[N@H+](CCCOC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CCO1 ZINC000893392403 721289530 /nfs/dbraw/zinc/28/95/30/721289530.db2.gz RRFFBLBCDVXZRS-LBPRGKRZSA-N 1 1 348.355 2.609 10 5 EFBEMO C[C@H]1C[N@@H+](CCCOC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CCO1 ZINC000893392403 721289535 /nfs/dbraw/zinc/28/95/35/721289535.db2.gz RRFFBLBCDVXZRS-LBPRGKRZSA-N 1 1 348.355 2.609 10 5 EFBEMO C[C@@H]1[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC[N@H+]1C ZINC000928435131 722862325 /nfs/dbraw/zinc/86/23/25/722862325.db2.gz RAKLCNAUDILTST-HQJQHLMTSA-N 1 1 332.187 2.724 10 5 EFBEMO CC(C)(O)[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000721824295 723464155 /nfs/dbraw/zinc/46/41/55/723464155.db2.gz RVOJYALAVGZMOW-NSHDSACASA-N 1 1 343.221 2.950 10 5 EFBEMO CC[C@H](C)[N@@H+](C)CCNc1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] ZINC000727112255 723819666 /nfs/dbraw/zinc/81/96/66/723819666.db2.gz FFBNTDAJSPPTQK-XOVSCCBYSA-N 1 1 335.404 2.923 10 5 EFBEMO C[N@H+]1C[C@@H]2CN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)C[C@]2(C)C1 ZINC000896914488 723870843 /nfs/dbraw/zinc/87/08/43/723870843.db2.gz IHQRWGIEQBWTLN-BMIGLBTASA-N 1 1 327.331 2.584 10 5 EFBEMO CC(=O)c1c(N[C@H]2CCC[N@@H+]3CCSC[C@H]23)cccc1[N+](=O)[O-] ZINC000895563909 724197690 /nfs/dbraw/zinc/19/76/90/724197690.db2.gz FNQJMWGYWJJHGH-SWLSCSKDSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1c(N[C@H]2CCC[N@H+]3CCSC[C@H]23)cccc1[N+](=O)[O-] ZINC000895563909 724197692 /nfs/dbraw/zinc/19/76/92/724197692.db2.gz FNQJMWGYWJJHGH-SWLSCSKDSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1ccc([N+](=O)[O-])cc1N[C@H]1CCC[N@@H+]2CCSC[C@H]12 ZINC000895570960 724198726 /nfs/dbraw/zinc/19/87/26/724198726.db2.gz XSQICZMYIDHWOE-GOEBONIOSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1ccc([N+](=O)[O-])cc1N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000895570960 724198728 /nfs/dbraw/zinc/19/87/28/724198728.db2.gz XSQICZMYIDHWOE-GOEBONIOSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1ccc(N[C@@H]2CCC[N@@H+]3CCSC[C@@H]23)c([N+](=O)[O-])c1 ZINC000895567593 724203944 /nfs/dbraw/zinc/20/39/44/724203944.db2.gz ROQMZHGWRROJCJ-CJNGLKHVSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1ccc(N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)c([N+](=O)[O-])c1 ZINC000895567593 724203947 /nfs/dbraw/zinc/20/39/47/724203947.db2.gz ROQMZHGWRROJCJ-CJNGLKHVSA-N 1 1 335.429 2.789 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@@H]([C@@H]3CCCO3)C2)c([N+](=O)[O-])cc1OC ZINC000895848559 724349500 /nfs/dbraw/zinc/34/95/00/724349500.db2.gz ZZGSQECGHDXDOL-DOMZBBRYSA-N 1 1 336.388 2.613 10 5 EFBEMO C[C@@H]1C[C@@H](NC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000906797367 726799989 /nfs/dbraw/zinc/79/99/89/726799989.db2.gz HWDZEVCGZYXJPU-YPMHNXCESA-N 1 1 339.823 2.780 10 5 EFBEMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000907204653 726884550 /nfs/dbraw/zinc/88/45/50/726884550.db2.gz FKWCVXCSCDAGBC-VXGBXAGGSA-N 1 1 339.823 2.732 10 5 EFBEMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC000908057131 727080677 /nfs/dbraw/zinc/08/06/77/727080677.db2.gz ZSPLXXKTJOBHNI-WBVHZDCISA-N 1 1 331.416 2.613 10 5 EFBEMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC000908057128 727080685 /nfs/dbraw/zinc/08/06/85/727080685.db2.gz ZSPLXXKTJOBHNI-DOTOQJQBSA-N 1 1 331.416 2.613 10 5 EFBEMO C[N@H+]1CCC[C@](O)(CC(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000908078201 727094633 /nfs/dbraw/zinc/09/46/33/727094633.db2.gz ZOCGYHMEGRLUPT-SFHVURJKSA-N 1 1 349.431 2.678 10 5 EFBEMO CC(C)(NC(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21)c1ccccc1[N+](=O)[O-] ZINC000908360150 727169362 /nfs/dbraw/zinc/16/93/62/727169362.db2.gz OQGSFUVYKFUSBE-CJNGLKHVSA-N 1 1 331.416 2.963 10 5 EFBEMO COC(=O)/C=C\c1ccc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000917082265 727764620 /nfs/dbraw/zinc/76/46/20/727764620.db2.gz NIZNFXTXGMEJOO-JFOCPDPESA-N 1 1 345.399 2.820 10 5 EFBEMO C[N@H+]1C[C@@]2(C)CN(C(=O)C(C)(C)c3ccccc3[N+](=O)[O-])C[C@@]2(C)C1 ZINC000913276308 727812832 /nfs/dbraw/zinc/81/28/32/727812832.db2.gz HUJRKRATIXEKPO-KDURUIRLSA-N 1 1 345.443 2.673 10 5 EFBEMO C[C@H]1C[C@@H](C(=O)NCc2cc(F)c(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000913385285 727830861 /nfs/dbraw/zinc/83/08/61/727830861.db2.gz WCSJSNJUXQWDOO-ONGXEEELSA-N 1 1 343.786 2.734 10 5 EFBEMO CC(C)N(CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)C(F)F ZINC001571609413 1086986282 /nfs/dbraw/zinc/98/62/82/1086986282.db2.gz FXDKHHXJZAJDET-UHFFFAOYSA-N 1 1 329.347 2.529 10 5 EFBEMO CC(C)N(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)C(F)F 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YTVPUBFEXQHDIG-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO C[N@@H+](CCNC(=O)c1cccc(F)c1F)Cc1cccc([N+](=O)[O-])c1 ZINC001480908652 1092242537 /nfs/dbraw/zinc/24/25/37/1092242537.db2.gz YTVPUBFEXQHDIG-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO C[N@H+](CCNC(=O)c1ccc(F)c(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC001267199894 1093170292 /nfs/dbraw/zinc/17/02/92/1093170292.db2.gz XYCNJVMNGBNCOK-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccc(F)c(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC001267199894 1093170298 /nfs/dbraw/zinc/17/02/98/1093170298.db2.gz XYCNJVMNGBNCOK-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1ccccn1)Cc1cccc([N+](=O)[O-])c1 ZINC001267309986 1093548806 /nfs/dbraw/zinc/54/88/06/1093548806.db2.gz XTLKAOAMSHFLAO-UHFFFAOYSA-N 1 1 342.399 2.632 10 5 EFBEMO Cc1ccoc1C(=O)NCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001267322218 1093573641 /nfs/dbraw/zinc/57/36/41/1093573641.db2.gz VYOYTAFGMQZNIP-UHFFFAOYSA-N 1 1 343.383 2.891 10 5 EFBEMO 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CCOC(=O)c1cc([N+](=O)[O-])c(NCC[N@@H+]2CC=CCC2)cc1C ZINC001612324750 1099051900 /nfs/dbraw/zinc/05/19/00/1099051900.db2.gz IMLPFJQMSNZCKT-UHFFFAOYSA-N 1 1 333.388 2.754 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCC[N@H+]1CCC(C)(C)C1 ZINC001613056970 1099088413 /nfs/dbraw/zinc/08/84/13/1099088413.db2.gz SNTSRCAAUFSFMH-UHFFFAOYSA-N 1 1 335.404 2.834 10 5 EFBEMO CCOC(=O)[C@@H]1C[C@H]1C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001616239794 1099170701 /nfs/dbraw/zinc/17/07/01/1099170701.db2.gz VZUFWTGQFJQRPA-GXFFZTMASA-N 1 1 326.780 2.879 10 5 EFBEMO CCOC(=O)[C@@H]1C[C@H]1C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001616239794 1099170707 /nfs/dbraw/zinc/17/07/07/1099170707.db2.gz VZUFWTGQFJQRPA-GXFFZTMASA-N 1 1 326.780 2.879 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCC[C@H]2c2ncccn2)cc1 ZINC001620549163 1099360401 /nfs/dbraw/zinc/36/04/01/1099360401.db2.gz SNVCMTZVOZQLMI-JKSUJKDBSA-N 1 1 328.372 2.645 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCC[C@H]2c2ncccn2)cc1 ZINC001620549163 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CCC(CC)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21 ZINC001662021160 1103567410 /nfs/dbraw/zinc/56/74/10/1103567410.db2.gz NPZYDBGHXPFBHX-FVQHAEBGSA-N 1 1 331.416 2.577 10 5 EFBEMO C[N@H+](CCNC(=O)C(F)=C1CCCC1)Cc1ccccc1[N+](=O)[O-] ZINC001663162614 1104012688 /nfs/dbraw/zinc/01/26/88/1104012688.db2.gz TVWZLFPJUAKLKO-UHFFFAOYSA-N 1 1 335.379 2.940 10 5 EFBEMO C[N@@H+](CCNC(=O)C(F)=C1CCCC1)Cc1ccccc1[N+](=O)[O-] ZINC001663162614 1104012696 /nfs/dbraw/zinc/01/26/96/1104012696.db2.gz TVWZLFPJUAKLKO-UHFFFAOYSA-N 1 1 335.379 2.940 10 5 EFBEMO C[N@H+](CCNC(=O)C12CCC(CC1)C2)Cc1ccccc1[N+](=O)[O-] ZINC001663213959 1104028714 /nfs/dbraw/zinc/02/87/14/1104028714.db2.gz LKLSMIBCADAPJX-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO C[N@@H+](CCNC(=O)C12CCC(CC1)C2)Cc1ccccc1[N+](=O)[O-] ZINC001663213959 1104028726 /nfs/dbraw/zinc/02/87/26/1104028726.db2.gz LKLSMIBCADAPJX-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1cc(C)[nH]c1C)Cc1cccc([N+](=O)[O-])c1 ZINC001663431194 1104092178 /nfs/dbraw/zinc/09/21/78/1104092178.db2.gz SMZQJXKITBSWKR-UHFFFAOYSA-N 1 1 344.415 2.792 10 5 EFBEMO C[N@H+]1CCC[C@@H](CNC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000906622032 1104357106 /nfs/dbraw/zinc/35/71/06/1104357106.db2.gz MTMFQKWDNGNSOO-LBPRGKRZSA-N 1 1 339.823 2.639 10 5 EFBEMO CC(C)(C(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1)C1CCC1 ZINC001665313645 1104666276 /nfs/dbraw/zinc/66/62/76/1104666276.db2.gz SDPPGLNLTUBHLD-UHFFFAOYSA-N 1 1 345.443 2.969 10 5 EFBEMO C=C/C(C)=C/CC(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001665320087 1104667660 /nfs/dbraw/zinc/66/76/60/1104667660.db2.gz AOOGMTXMMANPMA-RIYZIHGNSA-N 1 1 329.400 2.665 10 5 EFBEMO C=C/C(C)=C\CC(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001665320088 1104667876 /nfs/dbraw/zinc/66/78/76/1104667876.db2.gz AOOGMTXMMANPMA-ZSOIEALJSA-N 1 1 329.400 2.665 10 5 EFBEMO Cc1cc(C(=O)N(C)CC[N@H+](C)Cc2ccccc2[N+](=O)[O-])ccn1 ZINC001667638380 1105169543 /nfs/dbraw/zinc/16/95/43/1105169543.db2.gz LVBXRGYVWDSCIB-UHFFFAOYSA-N 1 1 342.399 2.502 10 5 EFBEMO Cc1cc(C(=O)N(C)CC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])ccn1 ZINC001667638380 1105169548 /nfs/dbraw/zinc/16/95/48/1105169548.db2.gz LVBXRGYVWDSCIB-UHFFFAOYSA-N 1 1 342.399 2.502 10 5 EFBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)C1(CF)CCC1 ZINC001272111113 1105273827 /nfs/dbraw/zinc/27/38/27/1105273827.db2.gz MROGAUQBAPRSBZ-UHFFFAOYSA-N 1 1 337.395 2.625 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)C1(CF)CCC1 ZINC001272111113 1105273831 /nfs/dbraw/zinc/27/38/31/1105273831.db2.gz MROGAUQBAPRSBZ-UHFFFAOYSA-N 1 1 337.395 2.625 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[N@H+](C(C)(C)C)CC1 ZINC001142531764 1106236230 /nfs/dbraw/zinc/23/62/30/1106236230.db2.gz JNHICRPWBLBDOP-UHFFFAOYSA-N 1 1 337.395 2.989 10 5 EFBEMO CC(C)(C)CCC[NH2+]CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CCCCC1 ZINC001675180506 1106313427 /nfs/dbraw/zinc/31/34/27/1106313427.db2.gz YUEBADNBUKHAGZ-HUUCEWRRSA-N 1 1 339.480 2.887 10 5 EFBEMO CC(C)N(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1cc[nH]c1 ZINC001677199040 1106674671 /nfs/dbraw/zinc/67/46/71/1106674671.db2.gz PMFHWMJXLDSTAX-UHFFFAOYSA-N 1 1 344.415 2.906 10 5 EFBEMO CC(C)N(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1cc[nH]c1 ZINC001677199040 1106674676 /nfs/dbraw/zinc/67/46/76/1106674676.db2.gz PMFHWMJXLDSTAX-UHFFFAOYSA-N 1 1 344.415 2.906 10 5 EFBEMO CCc1ccccc1C[N@@H+](C)CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(C)C ZINC001677199212 1106675143 /nfs/dbraw/zinc/67/51/43/1106675143.db2.gz XLVBJNDEFBDKQN-QZTJIDSGSA-N 1 1 347.459 2.583 10 5 EFBEMO CCc1ccccc1C[N@H+](C)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C(C)C ZINC001677199212 1106675145 /nfs/dbraw/zinc/67/51/45/1106675145.db2.gz XLVBJNDEFBDKQN-QZTJIDSGSA-N 1 1 347.459 2.583 10 5 EFBEMO CCc1ccccc1C[N@@H+](C)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C(C)C ZINC001677199212 1106675148 /nfs/dbraw/zinc/67/51/48/1106675148.db2.gz XLVBJNDEFBDKQN-QZTJIDSGSA-N 1 1 347.459 2.583 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccc(Cl)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC001266255142 1108696394 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343.383 2.535 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1CN1CCN(C[C@H]2CCCC[N@@H+]2C)CC1 ZINC000183331613 235012191 /nfs/dbraw/zinc/01/21/91/235012191.db2.gz KOXJYDXPOWAOCY-LJQANCHMSA-N 1 1 346.475 2.505 10 5 EFBEMO Cc1ccc(N2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3C)CC2)nn1 ZINC000183331808 235012649 /nfs/dbraw/zinc/01/26/49/235012649.db2.gz IZUHQZMPQRSWPR-UHFFFAOYSA-N 1 1 341.415 2.714 10 5 EFBEMO C[C@H]1CC[C@@](CO)([N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000188010248 236380451 /nfs/dbraw/zinc/38/04/51/236380451.db2.gz YHXSGOYWLMRIHR-YVEFUNNKSA-N 1 1 346.387 2.628 10 5 EFBEMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Cn3cccn3)CC2)c([N+](=O)[O-])c1 ZINC000193912745 240358371 /nfs/dbraw/zinc/35/83/71/240358371.db2.gz FQKSWNLFMXLPKR-UHFFFAOYSA-N 1 1 345.359 2.612 10 5 EFBEMO COc1cc(C[N@H+]2C[C@@H](O)C[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000411927344 243031262 /nfs/dbraw/zinc/03/12/62/243031262.db2.gz SBNUKHANVLMMHB-RDJZCZTQSA-N 1 1 328.368 2.911 10 5 EFBEMO C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000412136985 243162622 /nfs/dbraw/zinc/16/26/22/243162622.db2.gz VQZZLWYIUKZOAZ-VDNDLQMASA-N 1 1 331.416 2.639 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2CC(C)(C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000414519412 244208733 /nfs/dbraw/zinc/20/87/33/244208733.db2.gz BCBFDSCEJURGBI-GFCCVEGCSA-N 1 1 336.388 2.767 10 5 EFBEMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000419002663 245327089 /nfs/dbraw/zinc/32/70/89/245327089.db2.gz MMVLGXIESTVEPG-GHMZBOCLSA-N 1 1 347.337 2.505 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H](C)C1 ZINC000079461282 217227537 /nfs/dbraw/zinc/22/75/37/217227537.db2.gz JWHNRUZRJFNWGH-DYVFJYSZSA-N 1 1 349.431 2.623 10 5 EFBEMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000421711085 246076037 /nfs/dbraw/zinc/07/60/37/246076037.db2.gz NQTKTNXDTXTNFS-SNVBAGLBSA-N 1 1 345.321 2.780 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(=O)N(C)C)CC1 ZINC000264175596 246140791 /nfs/dbraw/zinc/14/07/91/246140791.db2.gz AKRMMKALFPUMHC-UHFFFAOYSA-N 1 1 349.431 2.682 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H](c3nnc[nH]3)C2)o1 ZINC000425355551 247055297 /nfs/dbraw/zinc/05/52/97/247055297.db2.gz MLFLFPMJFVTAMI-GFCCVEGCSA-N 1 1 339.355 2.962 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H](c4nnc[nH]4)C3)o2)c1 ZINC000425358746 247058993 /nfs/dbraw/zinc/05/89/93/247058993.db2.gz RJDGMIMZVCQBDF-CYBMUJFWSA-N 1 1 339.355 2.962 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]([C@@H]4CCOC4)C3)nc2c1 ZINC000441212576 250009548 /nfs/dbraw/zinc/00/95/48/250009548.db2.gz UIKDWWBAYLIPGV-QWHCGFSZSA-N 1 1 331.372 2.985 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]([C@H]4CCOC4)C3)nc2c1 ZINC000441212575 250009795 /nfs/dbraw/zinc/00/97/95/250009795.db2.gz UIKDWWBAYLIPGV-OLZOCXBDSA-N 1 1 331.372 2.985 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441209077 250009900 /nfs/dbraw/zinc/00/99/00/250009900.db2.gz RVLYZGVMYPDBAX-ILXRZTDVSA-N 1 1 347.415 2.670 10 5 EFBEMO COc1ccc(OCC[N@H+](C[C@@H](C)OC)C(C)C)c([N+](=O)[O-])c1 ZINC000441448028 250031808 /nfs/dbraw/zinc/03/18/08/250031808.db2.gz FVKVIFZCEUEOOP-CYBMUJFWSA-N 1 1 326.393 2.728 10 5 EFBEMO COc1cccc(C(=O)NCC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000444046821 250252958 /nfs/dbraw/zinc/25/29/58/250252958.db2.gz FFSFWEKGSWSODM-UHFFFAOYSA-N 1 1 335.404 2.598 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H]([C@H]4CCOC4)C3)nc2c1 ZINC000444658305 250322913 /nfs/dbraw/zinc/32/29/13/250322913.db2.gz AVDKDRURJMWHJI-STQMWFEESA-N 1 1 330.388 2.720 10 5 EFBEMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCCC12CCC2 ZINC000444783920 250347182 /nfs/dbraw/zinc/34/71/82/250347182.db2.gz LRSRYGXLYMENDQ-UHFFFAOYSA-N 1 1 331.372 2.911 10 5 EFBEMO Cc1ccsc1[C@H](CO)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444682181 250328588 /nfs/dbraw/zinc/32/85/88/250328588.db2.gz YXNRZIIAMWLJCH-ZDUSSCGKSA-N 1 1 332.385 2.664 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)cc1 ZINC000449418554 251018454 /nfs/dbraw/zinc/01/84/54/251018454.db2.gz DHGISENWFIERJP-ZWKOTPCHSA-N 1 1 330.359 2.895 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)cc1 ZINC000449418554 251018459 /nfs/dbraw/zinc/01/84/59/251018459.db2.gz DHGISENWFIERJP-ZWKOTPCHSA-N 1 1 330.359 2.895 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)cc1 ZINC000449418551 251019453 /nfs/dbraw/zinc/01/94/53/251019453.db2.gz DHGISENWFIERJP-MSOLQXFVSA-N 1 1 330.359 2.895 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)cc1 ZINC000449418551 251019457 /nfs/dbraw/zinc/01/94/57/251019457.db2.gz DHGISENWFIERJP-MSOLQXFVSA-N 1 1 330.359 2.895 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)c(Cl)c1 ZINC000449433466 251027354 /nfs/dbraw/zinc/02/73/54/251027354.db2.gz MMRDQTUJSUSZSN-XNRPHZJLSA-N 1 1 340.807 2.610 10 5 EFBEMO CCOC(=O)c1cc(N2CCC(c3[nH]cc[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC000267532797 251132211 /nfs/dbraw/zinc/13/22/11/251132211.db2.gz LLBHUHQMKNGVEZ-UHFFFAOYSA-N 1 1 344.371 2.879 10 5 EFBEMO Cc1nc(N[C@@H]2CCc3[nH+]c(C(C)(C)C)cn3C2)ncc1[N+](=O)[O-] ZINC000450296563 251335448 /nfs/dbraw/zinc/33/54/48/251335448.db2.gz FBSZHGJOONSHIV-LLVKDONJSA-N 1 1 330.392 2.614 10 5 EFBEMO Cc1nc(NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ncc1[N+](=O)[O-] ZINC000450347095 251354959 /nfs/dbraw/zinc/35/49/59/251354959.db2.gz GVMNLPBMUGPTGP-WFASDCNBSA-N 1 1 347.444 2.672 10 5 EFBEMO COC[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000181681266 533084773 /nfs/dbraw/zinc/08/47/73/533084773.db2.gz DUDKKIYEOHFTNL-KRWDZBQOSA-N 1 1 343.383 2.535 10 5 EFBEMO Cc1c(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000456998523 255670424 /nfs/dbraw/zinc/67/04/24/255670424.db2.gz RQQWERPLLYNSKN-MRXNPFEDSA-N 1 1 325.368 2.690 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000174122747 533223595 /nfs/dbraw/zinc/22/35/95/533223595.db2.gz UVYSJHDEOMVZKN-NEPJUHHUSA-N 1 1 336.392 2.550 10 5 EFBEMO Cc1sc(C(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000119747186 221391820 /nfs/dbraw/zinc/39/18/20/221391820.db2.gz RIVXZAOXMLEGRH-GFCCVEGCSA-N 1 1 325.434 2.672 10 5 EFBEMO C[C@@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1C ZINC000158423608 533588770 /nfs/dbraw/zinc/58/87/70/533588770.db2.gz CRFATLYMZVHSDA-PWSUYJOCSA-N 1 1 325.796 2.803 10 5 EFBEMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000344630628 142052036 /nfs/dbraw/zinc/05/20/36/142052036.db2.gz WQQBSIHZFCJOME-INIZCTEOSA-N 1 1 344.415 2.926 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@H]1C ZINC000345942979 142121954 /nfs/dbraw/zinc/12/19/54/142121954.db2.gz FKJYJXDCHYRNOF-NEPJUHHUSA-N 1 1 330.388 2.631 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](Cc1cnn(-c3ccccc3)c1)CC2 ZINC000347778104 142270854 /nfs/dbraw/zinc/27/08/54/142270854.db2.gz CEBVDHBGNDHSQJ-UHFFFAOYSA-N 1 1 335.367 2.734 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](Cc1cnn(-c3ccccc3)c1)CC2 ZINC000347778104 142270856 /nfs/dbraw/zinc/27/08/56/142270856.db2.gz CEBVDHBGNDHSQJ-UHFFFAOYSA-N 1 1 335.367 2.734 10 5 EFBEMO O=C([C@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1)N1CCCC1 ZINC000349350183 142323362 /nfs/dbraw/zinc/32/33/62/142323362.db2.gz SWWHABNSPVZMKE-ZDUSSCGKSA-N 1 1 335.379 2.568 10 5 EFBEMO O=C([C@H]1CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1)N1CCCC1 ZINC000349350183 142323363 /nfs/dbraw/zinc/32/33/63/142323363.db2.gz SWWHABNSPVZMKE-ZDUSSCGKSA-N 1 1 335.379 2.568 10 5 EFBEMO Cc1ccnc(N2CC[NH+](Cc3ccc([N+](=O)[O-])cc3C)CC2)c1 ZINC000349966450 142384249 /nfs/dbraw/zinc/38/42/49/142384249.db2.gz MQGXMJJTGQEHFX-UHFFFAOYSA-N 1 1 326.400 2.929 10 5 EFBEMO COCC[C@@H]1CCCC[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000342708498 145176714 /nfs/dbraw/zinc/17/67/14/145176714.db2.gz YGBVMBVORUJFMJ-HNNXBMFYSA-N 1 1 349.431 2.980 10 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COc1ccc(F)c(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000351642737 146167195 /nfs/dbraw/zinc/16/71/95/146167195.db2.gz XPGLDFWFPYUPKK-CYBMUJFWSA-N 1 1 346.362 2.824 10 5 EFBEMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[N@@H+]1CC=C(C)CC1 ZINC000355604236 147009929 /nfs/dbraw/zinc/00/99/29/147009929.db2.gz ZGVZAOHNOBCECH-UHFFFAOYSA-N 1 1 332.404 2.985 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@@H](C)[C@@H]1C ZINC000355780554 147061414 /nfs/dbraw/zinc/06/14/14/147061414.db2.gz ANHUHAJMJYKTFG-UPJWGTAASA-N 1 1 335.404 2.908 10 5 EFBEMO Cc1c(CNC(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000359545300 148117859 /nfs/dbraw/zinc/11/78/59/148117859.db2.gz RWWPAOYXOTXHMF-WFASDCNBSA-N 1 1 334.420 2.527 10 5 EFBEMO Cc1c(CNC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000359545297 148118223 /nfs/dbraw/zinc/11/82/23/148118223.db2.gz RWWPAOYXOTXHMF-IUODEOHRSA-N 1 1 334.420 2.527 10 5 EFBEMO CCOc1ccc(C(=O)NCCNc2cccc(C)[nH+]2)cc1[N+](=O)[O-] ZINC000359751227 148179972 /nfs/dbraw/zinc/17/99/72/148179972.db2.gz JVRCRBSITRNHFJ-UHFFFAOYSA-N 1 1 344.371 2.539 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@@H+](C)Cc2ccccc2)c1 ZINC000360142900 148282951 /nfs/dbraw/zinc/28/29/51/148282951.db2.gz GOQCUPHYKODCKM-UHFFFAOYSA-N 1 1 343.383 2.925 10 5 EFBEMO O=[N+]([O-])c1cnn(CC[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)c1 ZINC000364306079 149121032 /nfs/dbraw/zinc/12/10/32/149121032.db2.gz QZPLWDRHZSDEEG-UHFFFAOYSA-N 1 1 333.779 2.629 10 5 EFBEMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@@H](Cc3ccncc3)C2)c1 ZINC000368151211 150051173 /nfs/dbraw/zinc/05/11/73/150051173.db2.gz ZHHFHCKZOPOUJL-YJBOKZPZSA-N 1 1 327.384 2.588 10 5 EFBEMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H](Cc3ccncc3)C2)cc1 ZINC000368484833 150129582 /nfs/dbraw/zinc/12/95/82/150129582.db2.gz CKQGJBFYHGKOLQ-INIZCTEOSA-N 1 1 327.384 2.933 10 5 EFBEMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H](c3ccncn3)C2)cc1 ZINC000374028016 151270230 /nfs/dbraw/zinc/27/02/30/151270230.db2.gz VKSNPHPTVLILLC-CQSZACIVSA-N 1 1 328.372 2.643 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(c2c[nH]cn2)CC1 ZINC000374213795 151302388 /nfs/dbraw/zinc/30/23/88/151302388.db2.gz WCDDHKDQZVIPQR-GFCCVEGCSA-N 1 1 343.387 2.525 10 5 EFBEMO Cc1ccc([C@@H]2CC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)cc1 ZINC000374595400 151377611 /nfs/dbraw/zinc/37/76/11/151377611.db2.gz PAUMXTNNCIUCHY-MRXNPFEDSA-N 1 1 339.395 2.992 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H](C)[C@@H](N2CCOCC2)C1 ZINC000245524389 292296603 /nfs/dbraw/zinc/29/66/03/292296603.db2.gz NMVKYIIXOKHCQF-VKJFTORMSA-N 1 1 333.432 2.617 10 5 EFBEMO C[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@@H]1CCCO1 ZINC000122999102 222197173 /nfs/dbraw/zinc/19/71/73/222197173.db2.gz VXURRWMPYBXZJT-NSHDSACASA-N 1 1 329.194 2.968 10 5 EFBEMO CSc1ccc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000123115618 222218471 /nfs/dbraw/zinc/21/84/71/222218471.db2.gz GHLJXRPZVJUPOA-AAEUAGOBSA-N 1 1 337.445 2.871 10 5 EFBEMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000124234496 222396260 /nfs/dbraw/zinc/39/62/60/222396260.db2.gz AKOGSLIZMIAQOT-PWSUYJOCSA-N 1 1 325.796 2.803 10 5 EFBEMO C[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000119685523 544581239 /nfs/dbraw/zinc/58/12/39/544581239.db2.gz GSJRTZJLXYNBGZ-SECBINFHSA-N 1 1 335.310 2.823 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21 ZINC000185024776 265032690 /nfs/dbraw/zinc/03/26/90/265032690.db2.gz XZQYDSGGFOGGMU-DIOBLVDRSA-N 1 1 343.427 2.941 10 5 EFBEMO C[C@H]1C(=O)NCCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000189088716 265174345 /nfs/dbraw/zinc/17/43/45/265174345.db2.gz FCPBAUFMZHCZOU-LBPRGKRZSA-N 1 1 329.356 2.565 10 5 EFBEMO C[C@H]1C(=O)NCCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000189088716 265174348 /nfs/dbraw/zinc/17/43/48/265174348.db2.gz FCPBAUFMZHCZOU-LBPRGKRZSA-N 1 1 329.356 2.565 10 5 EFBEMO C[C@@H](Nc1ccc2c(c1)C[N@H+](C)C2)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000194519276 265375355 /nfs/dbraw/zinc/37/53/55/265375355.db2.gz ZXBJWXOKJLPMSO-GFCCVEGCSA-N 1 1 340.383 2.979 10 5 EFBEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000276511363 267003378 /nfs/dbraw/zinc/00/33/78/267003378.db2.gz BGUVILNTNVDTOD-LBPRGKRZSA-N 1 1 339.823 2.970 10 5 EFBEMO CCOc1cc(C[N@@H+]2CCc3cc[nH]c(=O)c3C2)ccc1[N+](=O)[O-] ZINC000276932473 267079262 /nfs/dbraw/zinc/07/92/62/267079262.db2.gz MNASCWCMHTXANZ-UHFFFAOYSA-N 1 1 329.356 2.652 10 5 EFBEMO CCOc1cc(C[N@H+]2CCc3cc[nH]c(=O)c3C2)ccc1[N+](=O)[O-] ZINC000276932473 267079265 /nfs/dbraw/zinc/07/92/65/267079265.db2.gz MNASCWCMHTXANZ-UHFFFAOYSA-N 1 1 329.356 2.652 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCc2cc[nH]c(=O)c2C1 ZINC000276997495 267095328 /nfs/dbraw/zinc/09/53/28/267095328.db2.gz VRIJXRDGFAKSQD-UHFFFAOYSA-N 1 1 329.356 2.652 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCc2cc[nH]c(=O)c2C1 ZINC000276997495 267095332 /nfs/dbraw/zinc/09/53/32/267095332.db2.gz VRIJXRDGFAKSQD-UHFFFAOYSA-N 1 1 329.356 2.652 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cc(C)c2F)[C@@H](C)C1 ZINC000277727528 267246208 /nfs/dbraw/zinc/24/62/08/267246208.db2.gz PWQFDYQVGSMZHV-SWLSCSKDSA-N 1 1 337.395 2.845 10 5 EFBEMO COc1cc(NCCC[N@H+]2CCCO[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000277745947 267251439 /nfs/dbraw/zinc/25/14/39/267251439.db2.gz UQJTYIIDMDDZRB-GFCCVEGCSA-N 1 1 341.383 2.655 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)c1 ZINC000247355615 273074520 /nfs/dbraw/zinc/07/45/20/273074520.db2.gz OGNYNRNUALONIR-BXUZGUMPSA-N 1 1 337.445 2.775 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000271094110 273096621 /nfs/dbraw/zinc/09/66/21/273096621.db2.gz LYEZFGWFTQRPRR-GFCCVEGCSA-N 1 1 347.396 2.713 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000271094110 273096622 /nfs/dbraw/zinc/09/66/22/273096622.db2.gz LYEZFGWFTQRPRR-GFCCVEGCSA-N 1 1 347.396 2.713 10 5 EFBEMO O=C1C[C@@]2(CC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)CN1 ZINC000279384515 273209513 /nfs/dbraw/zinc/20/95/13/273209513.db2.gz JNDZWGGZKZNDRC-SFHVURJKSA-N 1 1 341.367 2.567 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000280280993 273310808 /nfs/dbraw/zinc/31/08/08/273310808.db2.gz DOOBRRSRHLHYGK-STQMWFEESA-N 1 1 335.404 2.548 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000280280977 273310862 /nfs/dbraw/zinc/31/08/62/273310862.db2.gz DOOBRRSRHLHYGK-CHWSQXEVSA-N 1 1 335.404 2.548 10 5 EFBEMO COc1ccc(C[N@H+]2CC=C(c3ccnn3C)CC2)cc1[N+](=O)[O-] ZINC000285657222 274047135 /nfs/dbraw/zinc/04/71/35/274047135.db2.gz PMNGXVIFIRFTLT-UHFFFAOYSA-N 1 1 328.372 2.626 10 5 EFBEMO COc1ccc(C[N@@H+]2CC=C(c3ccnn3C)CC2)cc1[N+](=O)[O-] ZINC000285657222 274047136 /nfs/dbraw/zinc/04/71/36/274047136.db2.gz PMNGXVIFIRFTLT-UHFFFAOYSA-N 1 1 328.372 2.626 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCCNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000286024910 274119433 /nfs/dbraw/zinc/11/94/33/274119433.db2.gz GAOHEQIYKOBDDY-LBPRGKRZSA-N 1 1 345.403 2.920 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000286123999 274138386 /nfs/dbraw/zinc/13/83/86/274138386.db2.gz MOLZRCIRPZGOKR-LLVKDONJSA-N 1 1 331.376 2.530 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)c2ncnc3sc([N+](=O)[O-])cc32)[C@@H](C)C1 ZINC000286650092 274243497 /nfs/dbraw/zinc/24/34/97/274243497.db2.gz CGXXFMSVMXTVDX-JQWIXIFHSA-N 1 1 335.433 2.766 10 5 EFBEMO C[C@@H]1CCCCC[N@@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000343549686 274284575 /nfs/dbraw/zinc/28/45/75/274284575.db2.gz KMIYJSRAYJRIFL-CYBMUJFWSA-N 1 1 326.418 2.633 10 5 EFBEMO C[C@@H]1CCCCC[N@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000343549686 274284576 /nfs/dbraw/zinc/28/45/76/274284576.db2.gz KMIYJSRAYJRIFL-CYBMUJFWSA-N 1 1 326.418 2.633 10 5 EFBEMO C[C@@H]1CCCCC[N@@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000358378940 274284617 /nfs/dbraw/zinc/28/46/17/274284617.db2.gz CWSZHSAESISYEW-LLVKDONJSA-N 1 1 335.360 2.527 10 5 EFBEMO C[C@@H]1CCCCC[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000358378940 274284618 /nfs/dbraw/zinc/28/46/18/274284618.db2.gz CWSZHSAESISYEW-LLVKDONJSA-N 1 1 335.360 2.527 10 5 EFBEMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000355791790 274399520 /nfs/dbraw/zinc/39/95/20/274399520.db2.gz ZVLZQLCXCWDRRO-HZSPNIEDSA-N 1 1 331.416 2.850 10 5 EFBEMO CC(C)(C)c1ccc(C(=O)N2CC[NH2+]C[C@H]2C(F)F)cc1[N+](=O)[O-] ZINC000367391766 275535030 /nfs/dbraw/zinc/53/50/30/275535030.db2.gz HQZWPZJMWVPSCZ-ZDUSSCGKSA-N 1 1 341.358 2.571 10 5 EFBEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)/C(C)=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000182908018 276072168 /nfs/dbraw/zinc/07/21/68/276072168.db2.gz KDXOSOFWGTVISX-UKYUDJEDSA-N 1 1 331.416 2.798 10 5 EFBEMO CC[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CC(C)(C)C1 ZINC000412036418 276085723 /nfs/dbraw/zinc/08/57/23/276085723.db2.gz MDGHZETUEQTWKX-UHFFFAOYSA-N 1 1 349.387 2.773 10 5 EFBEMO CC[N@H+]1CC[C@H](CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000266277893 276221417 /nfs/dbraw/zinc/22/14/17/276221417.db2.gz QJYKZGKRGSSRHW-SNVBAGLBSA-N 1 1 345.321 2.685 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000247976434 277136300 /nfs/dbraw/zinc/13/63/00/277136300.db2.gz GMGGGULPMSXVNC-IEBWSBKVSA-N 1 1 339.395 2.699 10 5 EFBEMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179252488 278706369 /nfs/dbraw/zinc/70/63/69/278706369.db2.gz PFBXEYDMLNYCEJ-GHMZBOCLSA-N 1 1 333.413 2.974 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000174924491 288313919 /nfs/dbraw/zinc/31/39/19/288313919.db2.gz LKRFVFIWLPOCRH-UONOGXRCSA-N 1 1 344.415 2.543 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@](C)(F)C1 ZINC000295504856 295332014 /nfs/dbraw/zinc/33/20/14/295332014.db2.gz SSZPCBQWBYVKPD-MRXNPFEDSA-N 1 1 339.367 2.756 10 5 EFBEMO CCc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cn3)CC2)s1 ZINC000301345784 311132732 /nfs/dbraw/zinc/13/27/32/311132732.db2.gz GULTXVPRSFOSBQ-UHFFFAOYSA-N 1 1 332.429 2.936 10 5 EFBEMO CCc1[nH+]ccn1[C@@H]1CCCN(c2cc(CO)ccc2[N+](=O)[O-])C1 ZINC000302039881 311174159 /nfs/dbraw/zinc/17/41/59/311174159.db2.gz NGOFLVLPFJHKMF-CQSZACIVSA-N 1 1 330.388 2.688 10 5 EFBEMO O=[N+]([O-])c1ccc(CO)cc1N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000302065814 311175884 /nfs/dbraw/zinc/17/58/84/311175884.db2.gz UIJPVKFFHUPWCN-ZBFHGGJFSA-N 1 1 331.416 2.540 10 5 EFBEMO O=[N+]([O-])c1ccc(F)cc1NC[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000302823480 311203026 /nfs/dbraw/zinc/20/30/26/311203026.db2.gz UXMAGQOKIAVVEY-INIZCTEOSA-N 1 1 345.374 2.565 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H](O)COCc1cccs1)C2 ZINC000305445419 311223185 /nfs/dbraw/zinc/22/31/85/311223185.db2.gz PBACWKOYHVSMPB-AWEZNQCLSA-N 1 1 348.424 2.592 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)COCc1cccs1)C2 ZINC000305445419 311223187 /nfs/dbraw/zinc/22/31/87/311223187.db2.gz PBACWKOYHVSMPB-AWEZNQCLSA-N 1 1 348.424 2.592 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H](O)COc1ccc(F)cc1)C2 ZINC000305473288 311223465 /nfs/dbraw/zinc/22/34/65/311223465.db2.gz YSKKWFOYBUSADP-OAHLLOKOSA-N 1 1 346.358 2.532 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)COc1ccc(F)cc1)C2 ZINC000305473288 311223466 /nfs/dbraw/zinc/22/34/66/311223466.db2.gz YSKKWFOYBUSADP-OAHLLOKOSA-N 1 1 346.358 2.532 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000330719076 311330930 /nfs/dbraw/zinc/33/09/30/311330930.db2.gz WBBCKNPSMXDVLS-KCXAZCMYSA-N 1 1 349.431 2.651 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000330719076 311330931 /nfs/dbraw/zinc/33/09/31/311330931.db2.gz WBBCKNPSMXDVLS-KCXAZCMYSA-N 1 1 349.431 2.651 10 5 EFBEMO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@@H]([NH3+])c1ccccc1 ZINC000414826326 312054817 /nfs/dbraw/zinc/05/48/17/312054817.db2.gz FMMOPTYJCXUMDA-CXAGYDPISA-N 1 1 342.399 2.602 10 5 EFBEMO CCN1C[C@@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1=O ZINC000453375609 312894969 /nfs/dbraw/zinc/89/49/69/312894969.db2.gz XHDAVPJREZUBJO-QFBILLFUSA-N 1 1 339.395 2.895 10 5 EFBEMO CC[C@@H]([NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(=O)NC ZINC000453421330 312902218 /nfs/dbraw/zinc/90/22/18/312902218.db2.gz WMWPHNKLQMXGGX-SJORKVTESA-N 1 1 327.384 2.798 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@](O)(C(F)(F)F)C1 ZINC000470178690 313130405 /nfs/dbraw/zinc/13/04/05/313130405.db2.gz MIALOUVREKXTID-JOHMGYAOSA-N 1 1 330.306 2.997 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@](O)(C(F)(F)F)C1 ZINC000470178690 313130407 /nfs/dbraw/zinc/13/04/07/313130407.db2.gz MIALOUVREKXTID-JOHMGYAOSA-N 1 1 330.306 2.997 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2CC[C@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000475714851 313225083 /nfs/dbraw/zinc/22/50/83/313225083.db2.gz JUZNCAAYHRFYMF-AWEZNQCLSA-N 1 1 336.388 2.625 10 5 EFBEMO O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)c1ccc([N+](=O)[O-])cn1 ZINC000531633609 317294052 /nfs/dbraw/zinc/29/40/52/317294052.db2.gz IRZNMKBDNRGSSA-OAHLLOKOSA-N 1 1 344.371 2.540 10 5 EFBEMO C[C@@H](NC(=O)Cn1c[nH+]c2c1CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000541775629 317789763 /nfs/dbraw/zinc/78/97/63/317789763.db2.gz ZSYHZPUAFIHTBS-GFCCVEGCSA-N 1 1 328.372 2.548 10 5 EFBEMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000577090517 320077301 /nfs/dbraw/zinc/07/73/01/320077301.db2.gz GJEIZXQTZZUTEC-CYBMUJFWSA-N 1 1 335.404 2.550 10 5 EFBEMO CC[C@@H]1CN(c2ccc3ncccc3c2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000112080423 473241467 /nfs/dbraw/zinc/24/14/67/473241467.db2.gz ZDBHZTWVYSGBRM-CQSZACIVSA-N 1 1 344.415 2.690 10 5 EFBEMO O=C(Nc1ccccn1)C1CC[NH+](Cc2ccc([N+](=O)[O-])s2)CC1 ZINC000096008767 473254310 /nfs/dbraw/zinc/25/43/10/473254310.db2.gz AJWCTPJTLWGRDV-UHFFFAOYSA-N 1 1 346.412 2.902 10 5 EFBEMO C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000124572868 473265220 /nfs/dbraw/zinc/26/52/20/473265220.db2.gz YNDLMYCBWJDULQ-PWSUYJOCSA-N 1 1 325.796 2.803 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000177033086 473289968 /nfs/dbraw/zinc/28/99/68/473289968.db2.gz ISBYVYPSUARMDB-ZDUSSCGKSA-N 1 1 330.388 2.632 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000177036935 473291476 /nfs/dbraw/zinc/29/14/76/473291476.db2.gz CJKDDEIBKCKGRK-LBPRGKRZSA-N 1 1 337.445 2.873 10 5 EFBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000177160222 473319750 /nfs/dbraw/zinc/31/97/50/473319750.db2.gz PNEUZMFWLDKIBG-HNNXBMFYSA-N 1 1 328.372 2.713 10 5 EFBEMO CCc1ccc(C(=O)N2CCC[C@H]2Cn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000177148145 473318679 /nfs/dbraw/zinc/31/86/79/473318679.db2.gz XNBODKBPNNQUMC-INIZCTEOSA-N 1 1 342.399 2.967 10 5 EFBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177212075 473331706 /nfs/dbraw/zinc/33/17/06/473331706.db2.gz VJAYGSCAMWULOK-OAHLLOKOSA-N 1 1 328.372 2.713 10 5 EFBEMO CCc1n[nH]c(C2CC[NH+](Cc3cccc([N+](=O)[O-])c3C)CC2)n1 ZINC000190654091 473347136 /nfs/dbraw/zinc/34/71/36/473347136.db2.gz SVBUVTABBWPHGI-UHFFFAOYSA-N 1 1 329.404 2.963 10 5 EFBEMO CCc1nc(C2CC[NH+](Cc3cccc([N+](=O)[O-])c3C)CC2)n[nH]1 ZINC000190654091 473347143 /nfs/dbraw/zinc/34/71/43/473347143.db2.gz SVBUVTABBWPHGI-UHFFFAOYSA-N 1 1 329.404 2.963 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000162581221 473358875 /nfs/dbraw/zinc/35/88/75/473358875.db2.gz NGXHJTBKJFFFOA-DZGCQCFKSA-N 1 1 332.404 2.994 10 5 EFBEMO CC1(C)CCC[C@H]1[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000592153589 478800813 /nfs/dbraw/zinc/80/08/13/478800813.db2.gz HCPIGNRPOBOKPI-HOCLYGCPSA-N 1 1 333.432 2.905 10 5 EFBEMO COC[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000593673078 479418372 /nfs/dbraw/zinc/41/83/72/479418372.db2.gz VAQYSMLAWANMGP-LSDHHAIUSA-N 1 1 348.424 2.905 10 5 EFBEMO Cc1ccc(OCC[N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000027373626 472175139 /nfs/dbraw/zinc/17/51/39/472175139.db2.gz DAYHQGLUROXDAB-UHFFFAOYSA-N 1 1 343.383 2.513 10 5 EFBEMO Cc1ccc(OCC[N@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000027373626 472175144 /nfs/dbraw/zinc/17/51/44/472175144.db2.gz DAYHQGLUROXDAB-UHFFFAOYSA-N 1 1 343.383 2.513 10 5 EFBEMO COc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+](C)C2CCCCC2)c1 ZINC000068898767 472261476 /nfs/dbraw/zinc/26/14/76/472261476.db2.gz LTHLANZCCWLXSH-UHFFFAOYSA-N 1 1 335.404 2.598 10 5 EFBEMO Cc1ccc([C@H]2CCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1C ZINC000076082590 472263509 /nfs/dbraw/zinc/26/35/09/472263509.db2.gz QTGDPSDIACEXHL-ZWKOTPCHSA-N 1 1 344.415 2.606 10 5 EFBEMO COCC[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000068911199 472264142 /nfs/dbraw/zinc/26/41/42/472264142.db2.gz YZVKZBKNHVJWFM-CYBMUJFWSA-N 1 1 330.388 2.666 10 5 EFBEMO C[NH+](C)[C@H](CNC(=S)Nc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000057011198 472373423 /nfs/dbraw/zinc/37/34/23/472373423.db2.gz XTBCPXFNDIHXHE-OAHLLOKOSA-N 1 1 345.428 2.579 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000155477937 472554892 /nfs/dbraw/zinc/55/48/92/472554892.db2.gz DIAILHNCTWESFS-MFKMUULPSA-N 1 1 325.796 2.707 10 5 EFBEMO CC(C)[N@@H+]1C[C@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000155486755 472555940 /nfs/dbraw/zinc/55/59/40/472555940.db2.gz WJNYBVKVXMYILK-JQWIXIFHSA-N 1 1 325.796 2.707 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@@H]2C)c1 ZINC000155525213 472562915 /nfs/dbraw/zinc/56/29/15/472562915.db2.gz RXUXPRRYEHLRSW-LSDHHAIUSA-N 1 1 349.431 2.517 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000155632039 472584455 /nfs/dbraw/zinc/58/44/55/472584455.db2.gz FDHLZTJTCKRDQY-DOMZBBRYSA-N 1 1 337.445 2.532 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000155701609 472598211 /nfs/dbraw/zinc/59/82/11/472598211.db2.gz OSESNFCTVOMORX-YGRLFVJLSA-N 1 1 325.796 2.707 10 5 EFBEMO CC[C@H](NC(=O)NC[C@H]1CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000090563041 472637334 /nfs/dbraw/zinc/63/73/34/472637334.db2.gz CYICFDIPQFUSAT-CJNGLKHVSA-N 1 1 334.420 2.687 10 5 EFBEMO CCOCCC[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000072286178 472649380 /nfs/dbraw/zinc/64/93/80/472649380.db2.gz AYFLDVMVFUWDAK-ZBFHGGJFSA-N 1 1 336.436 2.847 10 5 EFBEMO CCOCC[N@H+]1CCN(CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1CC ZINC000105838331 472786440 /nfs/dbraw/zinc/78/64/40/472786440.db2.gz RHCTWHGJZGOPFO-KRWDZBQOSA-N 1 1 335.448 2.570 10 5 EFBEMO CCOCCN1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1CC ZINC000105838331 472786447 /nfs/dbraw/zinc/78/64/47/472786447.db2.gz RHCTWHGJZGOPFO-KRWDZBQOSA-N 1 1 335.448 2.570 10 5 EFBEMO CCOCCN1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1CC ZINC000105838331 472786455 /nfs/dbraw/zinc/78/64/55/472786455.db2.gz RHCTWHGJZGOPFO-KRWDZBQOSA-N 1 1 335.448 2.570 10 5 EFBEMO CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])cnc2C)C1 ZINC000105851851 472789904 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473566862 /nfs/dbraw/zinc/56/68/62/473566862.db2.gz DMUNWESMBRIYQB-UHFFFAOYSA-N 1 1 329.356 2.519 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](c3nncn3C3CC3)C2)cs1 ZINC000152474661 473567352 /nfs/dbraw/zinc/56/73/52/473567352.db2.gz ZJKXNBIWJDDSLX-GFCCVEGCSA-N 1 1 333.417 2.962 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](c3nncn3C3CC3)C2)cs1 ZINC000152474661 473567354 /nfs/dbraw/zinc/56/73/54/473567354.db2.gz ZJKXNBIWJDDSLX-GFCCVEGCSA-N 1 1 333.417 2.962 10 5 EFBEMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H](c3cc(F)ccc3F)C2)c1 ZINC000191678764 473567697 /nfs/dbraw/zinc/56/76/97/473567697.db2.gz LDGJJOAWUPYIGR-LBPRGKRZSA-N 1 1 336.342 2.949 10 5 EFBEMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](c3cc(F)ccc3F)C2)c1 ZINC000191678764 473567700 /nfs/dbraw/zinc/56/77/00/473567700.db2.gz LDGJJOAWUPYIGR-LBPRGKRZSA-N 1 1 336.342 2.949 10 5 EFBEMO O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@H](c3cc(F)ccc3F)C2)n1 ZINC000191687133 473568778 /nfs/dbraw/zinc/56/87/78/473568778.db2.gz OUWOLLXIRNHXLW-GFCCVEGCSA-N 1 1 336.342 2.949 10 5 EFBEMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](c3cc(F)ccc3F)C2)n1 ZINC000191687133 473568785 /nfs/dbraw/zinc/56/87/85/473568785.db2.gz OUWOLLXIRNHXLW-GFCCVEGCSA-N 1 1 336.342 2.949 10 5 EFBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@@H]1CCCO1 ZINC000170687998 473586718 /nfs/dbraw/zinc/58/67/18/473586718.db2.gz OXEOIULBVYCFPY-FZMZJTMJSA-N 1 1 332.360 2.817 10 5 EFBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@@H]1CCCO1 ZINC000170687998 473586722 /nfs/dbraw/zinc/58/67/22/473586722.db2.gz OXEOIULBVYCFPY-FZMZJTMJSA-N 1 1 332.360 2.817 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172415725 473604055 /nfs/dbraw/zinc/60/40/55/473604055.db2.gz WDJOZDHXKDAMJK-UHFFFAOYSA-N 1 1 331.416 2.994 10 5 EFBEMO CC[C@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000116278082 473645220 /nfs/dbraw/zinc/64/52/20/473645220.db2.gz WWERNLTZYKLXAE-HNNXBMFYSA-N 1 1 341.839 2.791 10 5 EFBEMO Cc1sc(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000172833191 473690540 /nfs/dbraw/zinc/69/05/40/473690540.db2.gz RPYTWUFTJZRCIN-LBPRGKRZSA-N 1 1 325.434 2.911 10 5 EFBEMO Cc1sc(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000172833198 473690896 /nfs/dbraw/zinc/69/08/96/473690896.db2.gz RPYTWUFTJZRCIN-GFCCVEGCSA-N 1 1 325.434 2.911 10 5 EFBEMO Cn1nccc1[C@@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000281391794 473704067 /nfs/dbraw/zinc/70/40/67/473704067.db2.gz MYFLTIJUWNGXLN-KRWDZBQOSA-N 1 1 330.388 2.934 10 5 EFBEMO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000281495152 473739905 /nfs/dbraw/zinc/73/99/05/473739905.db2.gz UBPZKKHIEYDGRP-RUZYHRDJSA-N 1 1 348.443 2.890 10 5 EFBEMO Cn1nccc1[C@@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000281532128 473755612 /nfs/dbraw/zinc/75/56/12/473755612.db2.gz WHEJBVCTYWLBDH-KRWDZBQOSA-N 1 1 330.388 2.934 10 5 EFBEMO CSc1cccc(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-] ZINC000186795235 473758643 /nfs/dbraw/zinc/75/86/43/473758643.db2.gz BULLGCQQHRQPKM-AAEUAGOBSA-N 1 1 337.445 2.775 10 5 EFBEMO Cc1ccc([C@H](C)[NH2+]CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)o1 ZINC000193283882 473778890 /nfs/dbraw/zinc/77/88/90/473778890.db2.gz PKVXEMVWNGVADV-LBPRGKRZSA-N 1 1 329.356 2.736 10 5 EFBEMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000246232102 473801144 /nfs/dbraw/zinc/80/11/44/473801144.db2.gz HZIHBVUPYCMUJN-XHDPSFHLSA-N 1 1 337.807 2.805 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@@H]1c1ccccc1 ZINC000180110007 473801974 /nfs/dbraw/zinc/80/19/74/473801974.db2.gz DRXKWPPWBDCTAN-DOMZBBRYSA-N 1 1 331.397 2.832 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@@H]1c1ccccc1 ZINC000180110007 473801980 /nfs/dbraw/zinc/80/19/80/473801980.db2.gz DRXKWPPWBDCTAN-DOMZBBRYSA-N 1 1 331.397 2.832 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000180125921 473805730 /nfs/dbraw/zinc/80/57/30/473805730.db2.gz 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CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000246557273 473901688 /nfs/dbraw/zinc/90/16/88/473901688.db2.gz WJNYBVKVXMYILK-CMPLNLGQSA-N 1 1 325.796 2.707 10 5 EFBEMO CCOCC[N@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@H]1C ZINC000246579881 473905778 /nfs/dbraw/zinc/90/57/78/473905778.db2.gz HPFUXEMKSOZSIK-CQSZACIVSA-N 1 1 344.415 2.690 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@H+]1C[C@@H](c2ccsc2)[C@H](CO)C1 ZINC000188088971 473978841 /nfs/dbraw/zinc/97/88/41/473978841.db2.gz QVQQVPYCDVIRRB-GJZGRUSLSA-N 1 1 348.424 2.743 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000246945567 474012432 /nfs/dbraw/zinc/01/24/32/474012432.db2.gz LEUXXGGPDVAYEI-KBPBESRZSA-N 1 1 337.807 2.947 10 5 EFBEMO CCOc1ccc(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2CC)cc1[N+](=O)[O-] ZINC000246955487 474015903 /nfs/dbraw/zinc/01/59/03/474015903.db2.gz MHEASXCMXGIACK-CABCVRRESA-N 1 1 347.415 2.692 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(=O)NCC(F)(F)F)C1 ZINC000275109622 474073241 /nfs/dbraw/zinc/07/32/41/474073241.db2.gz MVISZJIAZXXUPW-CMPLNLGQSA-N 1 1 345.321 2.656 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000175436688 474219199 /nfs/dbraw/zinc/21/91/99/474219199.db2.gz GTZBFYKVRRLKSY-QWHCGFSZSA-N 1 1 337.807 2.947 10 5 EFBEMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@]3(O)CCCC[C@H]3C2)cc1 ZINC000247994791 474241559 /nfs/dbraw/zinc/24/15/59/474241559.db2.gz JURNTKDXBWKOMS-YJBOKZPZSA-N 1 1 334.416 2.991 10 5 EFBEMO C[C@H](NC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000175736491 474294845 /nfs/dbraw/zinc/29/48/45/474294845.db2.gz WQHPDHLESMXZFC-WWTUQBGBSA-N 1 1 346.431 2.970 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)[C@H]1CC[N@H+](C)C[C@@H]1C ZINC000275745323 474303132 /nfs/dbraw/zinc/30/31/32/474303132.db2.gz COQNXZXVYVYWCS-AAEUAGOBSA-N 1 1 339.823 2.969 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000248387998 474303104 /nfs/dbraw/zinc/30/31/04/474303104.db2.gz CPMRYXDGXUZTRU-WMZOPIPTSA-N 1 1 345.443 2.860 10 5 EFBEMO CC[C@@H](NC(=O)NC[C@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000175846191 474323349 /nfs/dbraw/zinc/32/33/49/474323349.db2.gz HEKYHIJCLCFZMP-CXAGYDPISA-N 1 1 346.431 2.829 10 5 EFBEMO COc1ccc([C@@H]2C[C@H](C)[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)cc1 ZINC000176250225 474421362 /nfs/dbraw/zinc/42/13/62/474421362.db2.gz VMLAPKGGPZZRSJ-DZGCQCFKSA-N 1 1 330.388 2.678 10 5 EFBEMO COc1ccc([C@@H]2C[C@@H](C)[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)cc1 ZINC000176250209 474421588 /nfs/dbraw/zinc/42/15/88/474421588.db2.gz VMLAPKGGPZZRSJ-UKRRQHHQSA-N 1 1 330.388 2.678 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000184262777 474492496 /nfs/dbraw/zinc/49/24/96/474492496.db2.gz MVIVXIBHTRUGFP-IUODEOHRSA-N 1 1 339.411 2.905 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000248974946 474494982 /nfs/dbraw/zinc/49/49/82/474494982.db2.gz DJAFGDYCWBXIOO-ZWNOBZJWSA-N 1 1 326.780 2.879 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000248974946 474494989 /nfs/dbraw/zinc/49/49/89/474494989.db2.gz DJAFGDYCWBXIOO-ZWNOBZJWSA-N 1 1 326.780 2.879 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC[N@@H+](CC)C1 ZINC000184703182 474589063 /nfs/dbraw/zinc/58/90/63/474589063.db2.gz ZSEXJELWLUHSCV-HZPDHXFCSA-N 1 1 333.432 2.622 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC[N@@H+](CC)C1 ZINC000184703130 474589854 /nfs/dbraw/zinc/58/98/54/474589854.db2.gz ZSEXJELWLUHSCV-HOTGVXAUSA-N 1 1 333.432 2.622 10 5 EFBEMO COc1ccc(C[N@H+]2C[C@H](CO)[C@@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000249557023 474592034 /nfs/dbraw/zinc/59/20/34/474592034.db2.gz KEHKAMLYVUJTIL-HUUCEWRRSA-N 1 1 348.424 2.873 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@]1(CO)CC[C@@H](C)C1 ZINC000249589520 474597173 /nfs/dbraw/zinc/59/71/73/474597173.db2.gz UZYUJSDCKFANQA-ACJLOTCBSA-N 1 1 349.431 2.715 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCC[N@@H+](CC)C1 ZINC000184763948 474602925 /nfs/dbraw/zinc/60/29/25/474602925.db2.gz RAMCVHHZOMEUCF-JKSUJKDBSA-N 1 1 333.432 2.764 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2CCC[N@H+]2C[C@@H]1C ZINC000184790465 474608575 /nfs/dbraw/zinc/60/85/75/474608575.db2.gz NWHZSQCRJQTYFP-LESCRADOSA-N 1 1 345.443 2.859 10 5 EFBEMO O=[N+]([O-])c1c(F)cccc1NC[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000267248792 474627767 /nfs/dbraw/zinc/62/77/67/474627767.db2.gz UETMNWPYDGDGAM-HNNXBMFYSA-N 1 1 345.374 2.565 10 5 EFBEMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000291676915 474646712 /nfs/dbraw/zinc/64/67/12/474646712.db2.gz GSIANZBUSPWDIA-OLZOCXBDSA-N 1 1 347.337 2.809 10 5 EFBEMO C[C@@H]1C[N@H+](Cc2cccc(CNc3ccc([N+](=O)[O-])nc3)c2)CCO1 ZINC000344414880 474732701 /nfs/dbraw/zinc/73/27/01/474732701.db2.gz GYQXZVZVDGJBTP-CQSZACIVSA-N 1 1 342.399 2.823 10 5 EFBEMO C[C@@H]1C[N@@H+](Cc2cccc(CNc3ccc([N+](=O)[O-])nc3)c2)CCO1 ZINC000344414880 474732709 /nfs/dbraw/zinc/73/27/09/474732709.db2.gz GYQXZVZVDGJBTP-CQSZACIVSA-N 1 1 342.399 2.823 10 5 EFBEMO CC(C)[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCOC1 ZINC000291898627 474741892 /nfs/dbraw/zinc/74/18/92/474741892.db2.gz RAMKOEWDTQBUAD-GFCCVEGCSA-N 1 1 341.795 2.686 10 5 EFBEMO CC(C)[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCOC1 ZINC000291898627 474741903 /nfs/dbraw/zinc/74/19/03/474741903.db2.gz RAMKOEWDTQBUAD-GFCCVEGCSA-N 1 1 341.795 2.686 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCCN(c2cccnn2)CC1 ZINC000255028085 474788847 /nfs/dbraw/zinc/78/88/47/474788847.db2.gz NFUDLLMOLAGTNZ-DAXSKMNVSA-N 1 1 339.399 2.610 10 5 EFBEMO CC(C)(C)[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H]1O ZINC000273231376 474790663 /nfs/dbraw/zinc/79/06/63/474790663.db2.gz DIMYYDZDGYPUIJ-TZMCWYRMSA-N 1 1 333.388 2.965 10 5 EFBEMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H]1O ZINC000273231376 474790672 /nfs/dbraw/zinc/79/06/72/474790672.db2.gz DIMYYDZDGYPUIJ-TZMCWYRMSA-N 1 1 333.388 2.965 10 5 EFBEMO CC(C)[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCOC1 ZINC000292002996 474797571 /nfs/dbraw/zinc/79/75/71/474797571.db2.gz XKHSWZHPHQVSJK-CQSZACIVSA-N 1 1 332.360 2.644 10 5 EFBEMO CC(C)[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCOC1 ZINC000292002996 474797580 /nfs/dbraw/zinc/79/75/80/474797580.db2.gz XKHSWZHPHQVSJK-CQSZACIVSA-N 1 1 332.360 2.644 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@@]2(CCCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000337259011 474835224 /nfs/dbraw/zinc/83/52/24/474835224.db2.gz VQQXLAACACZGLZ-GOSISDBHSA-N 1 1 347.415 2.816 10 5 EFBEMO CC[C@H](NC(=O)N1CC[C@]2(CC[N@@H+](C)C2)C1)c1cccc([N+](=O)[O-])c1 ZINC000293229838 474878802 /nfs/dbraw/zinc/87/88/02/474878802.db2.gz FVSRFDNKSDOPDE-WMZOPIPTSA-N 1 1 346.431 2.783 10 5 EFBEMO CC[C@@H](NC(=O)N1CC[C@@]2(CC[N@@H+](C)C2)C1)c1cccc([N+](=O)[O-])c1 ZINC000293229826 474878843 /nfs/dbraw/zinc/87/88/43/474878843.db2.gz FVSRFDNKSDOPDE-SJLPKXTDSA-N 1 1 346.431 2.783 10 5 EFBEMO C[C@@H](NCc1cc([O-])ccc1[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000339073962 474901349 /nfs/dbraw/zinc/90/13/49/474901349.db2.gz CTWVBRZCPROWOW-GFCCVEGCSA-N 1 1 339.355 2.732 10 5 EFBEMO C[C@H]([NH2+]Cc1cc([O-])ccc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000339074075 474902038 /nfs/dbraw/zinc/90/20/38/474902038.db2.gz ILOBVGHQNDDWBM-RULNZOCKSA-N 1 1 334.397 2.889 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2F)[C@H](C)C1 ZINC000273474137 474918267 /nfs/dbraw/zinc/91/82/67/474918267.db2.gz PAZUTYSOGSPSIG-ABAIWWIYSA-N 1 1 338.383 2.928 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000293459419 474991238 /nfs/dbraw/zinc/99/12/38/474991238.db2.gz LBSHCNICFVNMIB-SECBINFHSA-N 1 1 332.278 2.609 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000293459419 474991246 /nfs/dbraw/zinc/99/12/46/474991246.db2.gz LBSHCNICFVNMIB-SECBINFHSA-N 1 1 332.278 2.609 10 5 EFBEMO C[C@H]([NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(=O)NCCF ZINC000337556746 475124241 /nfs/dbraw/zinc/12/42/41/475124241.db2.gz RUGWIJFGCXVRTI-SUMWQHHRSA-N 1 1 345.374 2.748 10 5 EFBEMO CC[N@H+]1CC[C@H]2OCCN(c3ccc([N+](=O)[O-])cc3Cl)[C@H]2C1 ZINC000292632771 475125939 /nfs/dbraw/zinc/12/59/39/475125939.db2.gz AFCHYZFOELHQMN-LSDHHAIUSA-N 1 1 325.796 2.548 10 5 EFBEMO C[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cn2)[C@H]1c1ccc(F)c(F)c1 ZINC000273936948 475127178 /nfs/dbraw/zinc/12/71/78/475127178.db2.gz LFRRUMHYLMCHLY-UONOGXRCSA-N 1 1 335.314 2.520 10 5 EFBEMO C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cn2)[C@H]1c1ccc(F)c(F)c1 ZINC000273936948 475127188 /nfs/dbraw/zinc/12/71/88/475127188.db2.gz LFRRUMHYLMCHLY-UONOGXRCSA-N 1 1 335.314 2.520 10 5 EFBEMO COC(=O)c1cc(N2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc(C)c1[N+](=O)[O-] ZINC000292699887 475159055 /nfs/dbraw/zinc/15/90/55/475159055.db2.gz GAHRUNNXHCMNOY-SFHVURJKSA-N 1 1 347.415 2.612 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H]1CN1CCOCC1 ZINC000347354072 475258926 /nfs/dbraw/zinc/25/89/26/475258926.db2.gz GECHJGJEGCRUBI-KVVHSQDJSA-N 1 1 345.443 2.795 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@@H](n3cc(Cl)cn3)C2)ccc1[N+](=O)[O-] ZINC000352415669 475271951 /nfs/dbraw/zinc/27/19/51/475271951.db2.gz OYRZFBYBTVQWOT-CYBMUJFWSA-N 1 1 336.779 2.900 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@@H](n3cc(Cl)cn3)C2)ccc1[N+](=O)[O-] ZINC000352415669 475271958 /nfs/dbraw/zinc/27/19/58/475271958.db2.gz OYRZFBYBTVQWOT-CYBMUJFWSA-N 1 1 336.779 2.900 10 5 EFBEMO CNc1c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)cccc1[N+](=O)[O-] ZINC000361211309 475272438 /nfs/dbraw/zinc/27/24/38/475272438.db2.gz OSJRYVLPRGCLRD-KGLIPLIRSA-N 1 1 346.431 2.724 10 5 EFBEMO CCCC(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000352424106 475280695 /nfs/dbraw/zinc/28/06/95/475280695.db2.gz DJLAKPYQGZAYDA-HNNXBMFYSA-N 1 1 349.431 2.732 10 5 EFBEMO COc1ccccc1C[N@H+](CCO)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000352425801 475283146 /nfs/dbraw/zinc/28/31/46/475283146.db2.gz NPMAFQPQXKZHGW-UHFFFAOYSA-N 1 1 346.383 2.607 10 5 EFBEMO COc1ccccc1C[N@@H+](CCO)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000352425801 475283154 /nfs/dbraw/zinc/28/31/54/475283154.db2.gz NPMAFQPQXKZHGW-UHFFFAOYSA-N 1 1 346.383 2.607 10 5 EFBEMO CC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[C@H]1CCOC1 ZINC000361230452 475288767 /nfs/dbraw/zinc/28/87/67/475288767.db2.gz UITZOPRHRVVEHI-INIZCTEOSA-N 1 1 330.388 2.606 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCc3nc[nH]c3C2)cc1[N+](=O)[O-] ZINC000357954879 475289279 /nfs/dbraw/zinc/28/92/79/475289279.db2.gz HYBUPJGHCLQDRA-WCQYABFASA-N 1 1 343.387 2.544 10 5 EFBEMO COc1cc(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000352541315 475394960 /nfs/dbraw/zinc/39/49/60/475394960.db2.gz WIWIQBDQCQFUCC-MRXNPFEDSA-N 1 1 333.432 2.767 10 5 EFBEMO CC[N@H+]1CCC[C@H](Nc2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000339679694 475404964 /nfs/dbraw/zinc/40/49/64/475404964.db2.gz RZMOFJKAMPWEEY-HNNXBMFYSA-N 1 1 341.415 2.678 10 5 EFBEMO 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COC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000452096280 476820551 /nfs/dbraw/zinc/82/05/51/476820551.db2.gz YBKOCKIWUYBLFQ-UONOGXRCSA-N 1 1 335.404 2.670 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)O[C@@H](C)[C@@H]1C ZINC000446075454 476823152 /nfs/dbraw/zinc/82/31/52/476823152.db2.gz YQQXGEDGTIAKQH-IHRRRGAJSA-N 1 1 335.404 2.730 10 5 EFBEMO COC[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000452110131 476829703 /nfs/dbraw/zinc/82/97/03/476829703.db2.gz YCVHPFOXYYTMMD-CQSZACIVSA-N 1 1 335.404 2.672 10 5 EFBEMO COC[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000452109696 476829793 /nfs/dbraw/zinc/82/97/93/476829793.db2.gz WXSOBGDJSUAZNP-HNNXBMFYSA-N 1 1 349.431 2.980 10 5 EFBEMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)cc1 ZINC000375428756 476832994 /nfs/dbraw/zinc/83/29/94/476832994.db2.gz WJCQRZSPUGDPFM-CQSZACIVSA-N 1 1 328.372 2.887 10 5 EFBEMO CCc1ccc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000457030154 476837546 /nfs/dbraw/zinc/83/75/46/476837546.db2.gz RTDJEHBHESUQMN-QGZVFWFLSA-N 1 1 339.395 2.944 10 5 EFBEMO Cc1c(CC(=O)N2CC[NH2+][C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000457030138 476837605 /nfs/dbraw/zinc/83/76/05/476837605.db2.gz RSRZLPIWCGRBOL-KRWDZBQOSA-N 1 1 339.395 2.619 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000446315383 476859635 /nfs/dbraw/zinc/85/96/35/476859635.db2.gz IZVYEMGTWLMREY-CMPLNLGQSA-N 1 1 325.796 2.769 10 5 EFBEMO COc1cc(C)c(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(C)n1 ZINC000446834905 476925026 /nfs/dbraw/zinc/92/50/26/476925026.db2.gz MIZRTRDXNKVHIQ-UHFFFAOYSA-N 1 1 341.371 2.781 10 5 EFBEMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NCC1([NH3+])CCCCCC1 ZINC000423206418 476963339 /nfs/dbraw/zinc/96/33/39/476963339.db2.gz WULIGCHARMMEHN-CQSZACIVSA-N 1 1 348.447 2.953 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000366403756 476991959 /nfs/dbraw/zinc/99/19/59/476991959.db2.gz LBRYTRQWCMYKGL-UHFFFAOYSA-N 1 1 342.399 2.814 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[N@H+](C3CC3)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000452569354 477003712 /nfs/dbraw/zinc/00/37/12/477003712.db2.gz IZCHRJCRJFCEGT-CYBMUJFWSA-N 1 1 347.415 2.550 10 5 EFBEMO C[C@@H]1CCC[N@@H+](CCCCN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)C1 ZINC000447678607 477033442 /nfs/dbraw/zinc/03/34/42/477033442.db2.gz LALVAUUPFCSCSP-CYBMUJFWSA-N 1 1 331.420 2.817 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CC[N@H+](C(C)C)C1 ZINC000447802245 477060633 /nfs/dbraw/zinc/06/06/33/477060633.db2.gz ITGYKKNDQJOKPE-JTQLQIEISA-N 1 1 341.795 2.929 10 5 EFBEMO C[NH+](C)CCN1CCC(Nc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432317146 477192817 /nfs/dbraw/zinc/19/28/17/477192817.db2.gz FSVFWZFSSSQQFO-UHFFFAOYSA-N 1 1 343.431 2.581 10 5 EFBEMO CC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])c3c2CCCN3)no1)C1CC1 ZINC000453243341 477195073 /nfs/dbraw/zinc/19/50/73/477195073.db2.gz XFYYHBINGXTOJZ-UHFFFAOYSA-N 1 1 343.387 2.987 10 5 EFBEMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])c3c2CCCN3)no1)C1CC1 ZINC000453243341 477195081 /nfs/dbraw/zinc/19/50/81/477195081.db2.gz XFYYHBINGXTOJZ-UHFFFAOYSA-N 1 1 343.387 2.987 10 5 EFBEMO CCC[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])c3c2CCCN3)no1 ZINC000453237503 477196328 /nfs/dbraw/zinc/19/63/28/477196328.db2.gz MRSHQCKJUZRUGB-UHFFFAOYSA-N 1 1 331.376 2.845 10 5 EFBEMO CCC[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])c3c2CCCN3)no1 ZINC000453237503 477196340 /nfs/dbraw/zinc/19/63/40/477196340.db2.gz MRSHQCKJUZRUGB-UHFFFAOYSA-N 1 1 331.376 2.845 10 5 EFBEMO C[N@H+]1CCC[C@@H](CCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000458167256 477298375 /nfs/dbraw/zinc/29/83/75/477298375.db2.gz MKJLSFAWUIBKAX-LBPRGKRZSA-N 1 1 330.388 2.538 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2CC3(CCC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000433024967 477299179 /nfs/dbraw/zinc/29/91/79/477299179.db2.gz GCQPSVIGNHCUFS-ZDUSSCGKSA-N 1 1 348.399 2.911 10 5 EFBEMO O=C(CC[N@H+]1CCOC[C@@H]1CC1CCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411775195 477363256 /nfs/dbraw/zinc/36/32/56/477363256.db2.gz XGKCBRWLXZJVGU-KRWDZBQOSA-N 1 1 347.415 2.814 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@](C(N)=O)(c2ccccc2)C1 ZINC000411969020 477400250 /nfs/dbraw/zinc/40/02/50/477400250.db2.gz PKZBSKBXLRWSRB-AUUYWEPGSA-N 1 1 339.395 2.785 10 5 EFBEMO C[C@H](NC(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000458886788 477642982 /nfs/dbraw/zinc/64/29/82/477642982.db2.gz IRFLRLNSIJAGLS-BLLLJJGKSA-N 1 1 332.404 2.534 10 5 EFBEMO COC(=O)COc1ccc(C[N@@H+](C)C2(C)CCCC2)cc1[N+](=O)[O-] ZINC000426530973 477715474 /nfs/dbraw/zinc/71/54/74/477715474.db2.gz QQDNXACDNFCFOW-UHFFFAOYSA-N 1 1 336.388 2.911 10 5 EFBEMO CC[N@H+]1CCCC[C@H]1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000558576591 477890171 /nfs/dbraw/zinc/89/01/71/477890171.db2.gz JMLAJXQKWKRZMY-KRWDZBQOSA-N 1 1 344.415 2.609 10 5 EFBEMO COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000532476937 477932659 /nfs/dbraw/zinc/93/26/59/477932659.db2.gz UDRVOTCOEKQZKR-JQFCIGGWSA-N 1 1 348.399 2.780 10 5 EFBEMO COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000532476937 477932667 /nfs/dbraw/zinc/93/26/67/477932667.db2.gz UDRVOTCOEKQZKR-JQFCIGGWSA-N 1 1 348.399 2.780 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@H](O)C[C@@H]1[C@H]1CCCOC1 ZINC000451299929 477938777 /nfs/dbraw/zinc/93/87/77/477938777.db2.gz KVKIXXHQMCLRGM-NWANDNLSSA-N 1 1 340.807 2.610 10 5 EFBEMO C[NH+](C)Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cn2)ccc1Cl ZINC000532615905 477957613 /nfs/dbraw/zinc/95/76/13/477957613.db2.gz LPLSILSHFSVFKE-UHFFFAOYSA-N 1 1 334.763 2.957 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451344126 477964998 /nfs/dbraw/zinc/96/49/98/477964998.db2.gz PETXMVBOGHUZNN-BFYDXBDKSA-N 1 1 334.416 2.989 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H]2[C@@H]3C=C[C@@H](C3)[C@]2(C)C1 ZINC000451360658 477973688 /nfs/dbraw/zinc/97/36/88/477973688.db2.gz FOEGNPDSXUIJGO-DFHZNHDVSA-N 1 1 341.411 2.986 10 5 EFBEMO C[C@@]12C[N@@H+](CC(=O)Nc3ccccc3[N+](=O)[O-])C[C@@H]1[C@@H]1C=C[C@H]2C1 ZINC000451368207 477977531 /nfs/dbraw/zinc/97/75/31/477977531.db2.gz LBHOPAMDMFHVNS-NPSOMJIGSA-N 1 1 327.384 2.677 10 5 EFBEMO CNC(=O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000421377729 478063210 /nfs/dbraw/zinc/06/32/10/478063210.db2.gz HZWPYLQWSQCVMT-GFCCVEGCSA-N 1 1 345.424 2.891 10 5 EFBEMO CC(C)C[N@H+]1CC[C@H](CNc2c3ccccc3ncc2[N+](=O)[O-])C1 ZINC000488084669 478116623 /nfs/dbraw/zinc/11/66/23/478116623.db2.gz RRCNDPJTNMHSCR-CQSZACIVSA-N 1 1 328.416 2.955 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H](O)COc1ccccc1F)C2 ZINC000535244777 478203023 /nfs/dbraw/zinc/20/30/23/478203023.db2.gz AXRNEBDHZQKDSG-AWEZNQCLSA-N 1 1 346.358 2.532 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)COc1ccccc1F)C2 ZINC000535244777 478203027 /nfs/dbraw/zinc/20/30/27/478203027.db2.gz AXRNEBDHZQKDSG-AWEZNQCLSA-N 1 1 346.358 2.532 10 5 EFBEMO Cc1ccc(C[NH+]2CCC(C)(N3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000600201469 478279512 /nfs/dbraw/zinc/27/95/12/478279512.db2.gz MZHUITNMYVPTDY-UHFFFAOYSA-N 1 1 333.432 2.590 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H]2CC[C@@H](C1)[S@]2=O ZINC000600202377 478279569 /nfs/dbraw/zinc/27/95/69/478279569.db2.gz GYBJNOYSKTYFRO-BBKUJAPLSA-N 1 1 334.441 2.984 10 5 EFBEMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000600229353 478299263 /nfs/dbraw/zinc/29/92/63/478299263.db2.gz JSWAGCDJCONFRI-INIZCTEOSA-N 1 1 349.406 2.800 10 5 EFBEMO C[N@H+]1CCC[C@@H](NC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000590808391 478348783 /nfs/dbraw/zinc/34/87/83/478348783.db2.gz OFLCPFWSEZOVRT-JKSUJKDBSA-N 1 1 346.431 2.578 10 5 EFBEMO C[N@H+]1CCC[C@H](NC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000590808389 478349403 /nfs/dbraw/zinc/34/94/03/478349403.db2.gz OFLCPFWSEZOVRT-HOTGVXAUSA-N 1 1 346.431 2.578 10 5 EFBEMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000600472186 478382603 /nfs/dbraw/zinc/38/26/03/478382603.db2.gz MZPDGXPCISQKMF-GFCCVEGCSA-N 1 1 337.807 2.995 10 5 EFBEMO COc1cc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cc([N+](=O)[O-])c1C ZINC000600469869 478383616 /nfs/dbraw/zinc/38/36/16/478383616.db2.gz LTRBFSBREAUZAS-HNNXBMFYSA-N 1 1 347.415 2.659 10 5 EFBEMO CC(C)(C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1)c1ccccc1[N+](=O)[O-] ZINC000597581839 478420318 /nfs/dbraw/zinc/42/03/18/478420318.db2.gz RMXIMCZJUCXFRV-ZBFHGGJFSA-N 1 1 349.406 2.517 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c1 ZINC000594596552 478455613 /nfs/dbraw/zinc/45/56/13/478455613.db2.gz AOCVVFYDKBPKJJ-ZFWWWQNUSA-N 1 1 333.388 2.810 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)Cn1c[nH+]c2c1CCCC2 ZINC000597666672 478455801 /nfs/dbraw/zinc/45/58/01/478455801.db2.gz KRDFSIULHZUFNR-UHFFFAOYSA-N 1 1 328.372 2.926 10 5 EFBEMO C[NH2+]CCOCCN(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000600778275 478516585 /nfs/dbraw/zinc/51/65/85/478516585.db2.gz XNYJEMQLCGDYMP-UHFFFAOYSA-N 1 1 333.388 2.523 10 5 EFBEMO C[C@@H](C(=O)NC[C@H]1CC[N@H+]1C(C)(C)C)c1ccc([N+](=O)[O-])cc1F ZINC000597856845 478542251 /nfs/dbraw/zinc/54/22/51/478542251.db2.gz BFUINLXGWMESLG-DGCLKSJQSA-N 1 1 337.395 2.826 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(CC)[C@@H]1CC[N@@H+](C)C1 ZINC000597946311 478590767 /nfs/dbraw/zinc/59/07/67/478590767.db2.gz OCJLWWSFPROMLT-DOTOQJQBSA-N 1 1 333.432 2.716 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(CC)[C@@H]1CC[N@@H+](C)C1 ZINC000597946312 478591026 /nfs/dbraw/zinc/59/10/26/478591026.db2.gz OCJLWWSFPROMLT-NVXWUHKLSA-N 1 1 333.432 2.716 10 5 EFBEMO C[C@@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)S(C)(=O)=O ZINC000541847492 478595411 /nfs/dbraw/zinc/59/54/11/478595411.db2.gz LKZCVGJXSVFUER-SUMWQHHRSA-N 1 1 348.424 2.707 10 5 EFBEMO CCN(C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)[C@H]1CC[N@@H+](CC)C1 ZINC000598038479 478626576 /nfs/dbraw/zinc/62/65/76/478626576.db2.gz DLZPVIIQQBEGTA-LBPRGKRZSA-N 1 1 330.388 2.632 10 5 EFBEMO CCN(C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CC[N@@H+](CC)C1 ZINC000598039450 478626732 /nfs/dbraw/zinc/62/67/32/478626732.db2.gz KDILLHOATUVEST-GXTWGEPZSA-N 1 1 337.395 2.780 10 5 EFBEMO CCN(C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)[C@H]1CC[N@@H+](CC)C1 ZINC000598039452 478627215 /nfs/dbraw/zinc/62/72/15/478627215.db2.gz KDILLHOATUVEST-JSGCOSHPSA-N 1 1 337.395 2.780 10 5 EFBEMO COC1CC(CC[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000595050592 478642121 /nfs/dbraw/zinc/64/21/21/478642121.db2.gz SKBGBBWTQGWGOK-IMRCBTMISA-N 1 1 344.415 2.822 10 5 EFBEMO Cc1nn(C)c(C)c1C[C@@H](C)Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000601121634 478668901 /nfs/dbraw/zinc/66/89/01/478668901.db2.gz OVYHRTBWISKYRD-LLVKDONJSA-N 1 1 339.399 2.958 10 5 EFBEMO Cc1ccc2ncc(C[NH2+][C@@](C)(CO)c3cccc([N+](=O)[O-])c3)n2c1 ZINC000601149109 478689890 /nfs/dbraw/zinc/68/98/90/478689890.db2.gz IQBUKMYTQAXTQN-SFHVURJKSA-N 1 1 340.383 2.548 10 5 EFBEMO Cc1ccc2ncc(C[NH2+][C@](C)(CO)c3cccc([N+](=O)[O-])c3)n2c1 ZINC000601149108 478689925 /nfs/dbraw/zinc/68/99/25/478689925.db2.gz IQBUKMYTQAXTQN-GOSISDBHSA-N 1 1 340.383 2.548 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CCOC[C@H]2C)CC1 ZINC000564156507 478699609 /nfs/dbraw/zinc/69/96/09/478699609.db2.gz WWLVPAKABJYGOV-CABCVRRESA-N 1 1 333.432 2.841 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(N2CCOC[C@H]2C)CC1 ZINC000564156507 478699620 /nfs/dbraw/zinc/69/96/20/478699620.db2.gz WWLVPAKABJYGOV-CABCVRRESA-N 1 1 333.432 2.841 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CCOC[C@@H]2C)CC1 ZINC000564156511 478700036 /nfs/dbraw/zinc/70/00/36/478700036.db2.gz WWLVPAKABJYGOV-GJZGRUSLSA-N 1 1 333.432 2.841 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(N2CCOC[C@@H]2C)CC1 ZINC000564156511 478700044 /nfs/dbraw/zinc/70/00/44/478700044.db2.gz WWLVPAKABJYGOV-GJZGRUSLSA-N 1 1 333.432 2.841 10 5 EFBEMO C[N@H+]1CCC[C@@H]2CN(c3nc4c(cc3[N+](=O)[O-])CCCC4)CC[C@@H]21 ZINC000591923335 478709550 /nfs/dbraw/zinc/70/95/50/478709550.db2.gz LORWMJHRBJNPHO-ZBFHGGJFSA-N 1 1 330.432 2.789 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000601190465 478715059 /nfs/dbraw/zinc/71/50/59/478715059.db2.gz ZGLSPESHTJSUOD-ZJUUUORDSA-N 1 1 347.341 2.776 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@H]2CNc2ncc(F)cc2[N+](=O)[O-])cc1 ZINC000601200766 478719709 /nfs/dbraw/zinc/71/97/09/478719709.db2.gz HDAGYVLVMFLKLC-AWEZNQCLSA-N 1 1 346.362 2.824 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@H]2CNc2ncc(F)cc2[N+](=O)[O-])cc1 ZINC000601200766 478719716 /nfs/dbraw/zinc/71/97/16/478719716.db2.gz HDAGYVLVMFLKLC-AWEZNQCLSA-N 1 1 346.362 2.824 10 5 EFBEMO Cc1noc(CN2CC[N@H+](Cc3ccccc3)CC[C@H]2C)c1[N+](=O)[O-] ZINC000595339660 478738510 /nfs/dbraw/zinc/73/85/10/478738510.db2.gz ZPKBRNMNXSFVAO-CQSZACIVSA-N 1 1 344.415 2.988 10 5 EFBEMO Cc1noc(CN(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595385415 478756609 /nfs/dbraw/zinc/75/66/09/478756609.db2.gz VYRQLMYFIBYWLY-HNNXBMFYSA-N 1 1 330.388 2.598 10 5 EFBEMO C[C@@H]1C[C@@H](NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C[N@H+]1C1CC1 ZINC000601300027 478772646 /nfs/dbraw/zinc/77/26/46/478772646.db2.gz ULVKXJNTOKWUCE-UKRRQHHQSA-N 1 1 343.427 2.758 10 5 EFBEMO C[C@@H]1C[C@H](NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C[N@H+]1C1CC1 ZINC000601300026 478772954 /nfs/dbraw/zinc/77/29/54/478772954.db2.gz ULVKXJNTOKWUCE-HIFRSBDPSA-N 1 1 343.427 2.758 10 5 EFBEMO CCC[C@H](O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592132955 478790588 /nfs/dbraw/zinc/79/05/88/478790588.db2.gz QCNGGXJDSCXNNA-ULQDDVLXSA-N 1 1 336.432 2.861 10 5 EFBEMO CCO[C@@H]1C[C@@H]([NH2+]Cc2c(F)cc([N+](=O)[O-])cc2F)[C@@H]1SC ZINC000592172798 478814412 /nfs/dbraw/zinc/81/44/12/478814412.db2.gz BKSRKLXDEYQDBY-MCIONIFRSA-N 1 1 332.372 2.872 10 5 EFBEMO CNC(=O)[C@]1(C(F)(F)F)CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000592185582 478816594 /nfs/dbraw/zinc/81/65/94/478816594.db2.gz ZXOLEDZEWLDKTE-YGRLFVJLSA-N 1 1 345.321 2.656 10 5 EFBEMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601400337 478820234 /nfs/dbraw/zinc/82/02/34/478820234.db2.gz YLPGDCCGLWCKOY-ZIAGYGMSSA-N 1 1 331.416 2.568 10 5 EFBEMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601400337 478820241 /nfs/dbraw/zinc/82/02/41/478820241.db2.gz YLPGDCCGLWCKOY-ZIAGYGMSSA-N 1 1 331.416 2.568 10 5 EFBEMO CCCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCc2ncsc2C1 ZINC000592189872 478820858 /nfs/dbraw/zinc/82/08/58/478820858.db2.gz YMHVNBDVAIFDGK-CYBMUJFWSA-N 1 1 349.460 2.907 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)CCc1ccccc1)C2 ZINC000544402452 478833099 /nfs/dbraw/zinc/83/30/99/478833099.db2.gz MPWQGWMVSDOQFZ-QGZVFWFLSA-N 1 1 326.396 2.947 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000598464754 478836239 /nfs/dbraw/zinc/83/62/39/478836239.db2.gz GNEZBONJCYXWOT-UHFFFAOYSA-N 1 1 349.431 2.794 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000598466583 478837842 /nfs/dbraw/zinc/83/78/42/478837842.db2.gz QBLUONGOENMJMC-UHFFFAOYSA-N 1 1 337.420 2.600 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000598465144 478838254 /nfs/dbraw/zinc/83/82/54/478838254.db2.gz FCUDGJWCUMDGHQ-UHFFFAOYSA-N 1 1 332.404 2.926 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000598466790 478838318 /nfs/dbraw/zinc/83/83/18/478838318.db2.gz VICVLFIXEPDHHK-UHFFFAOYSA-N 1 1 332.404 2.926 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000598466127 478838389 /nfs/dbraw/zinc/83/83/89/478838389.db2.gz KKVNXVGUXOYAPO-UHFFFAOYSA-N 1 1 336.436 2.633 10 5 EFBEMO Cc1noc(C[N@H+]2CC[C@H](C)[C@@H](C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000595562379 478858114 /nfs/dbraw/zinc/85/81/14/478858114.db2.gz JOQXKJSNKWXBMF-JQWIXIFHSA-N 1 1 339.392 2.691 10 5 EFBEMO Cc1noc(C[N@@H+]2CC[C@H](C)[C@@H](C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000595562379 478858121 /nfs/dbraw/zinc/85/81/21/478858121.db2.gz JOQXKJSNKWXBMF-JQWIXIFHSA-N 1 1 339.392 2.691 10 5 EFBEMO Cc1c(CNC(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000595588061 478871423 /nfs/dbraw/zinc/87/14/23/478871423.db2.gz ONVMDOYXQPOSQR-CQSZACIVSA-N 1 1 334.420 2.575 10 5 EFBEMO C[C@@]12COC[C@]1(C)C[N@@H+](Cc1nnc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000595689580 478936857 /nfs/dbraw/zinc/93/68/57/478936857.db2.gz SIHORFONJSHAKH-CALCHBBNSA-N 1 1 344.371 2.503 10 5 EFBEMO C[C@@]12COC[C@]1(C)C[N@H+](Cc1nnc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000595689580 478936864 /nfs/dbraw/zinc/93/68/64/478936864.db2.gz SIHORFONJSHAKH-CALCHBBNSA-N 1 1 344.371 2.503 10 5 EFBEMO O=C(C[N@@H+]1CCC[C@H](CCF)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595756656 478978049 /nfs/dbraw/zinc/97/80/49/478978049.db2.gz VKTFMIFKKUKOEG-CYBMUJFWSA-N 1 1 335.379 2.556 10 5 EFBEMO O=C(C[N@H+]1CCC[C@H](CCF)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595756656 478978055 /nfs/dbraw/zinc/97/80/55/478978055.db2.gz VKTFMIFKKUKOEG-CYBMUJFWSA-N 1 1 335.379 2.556 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+](Cc1ccccc1F)CC1CC1 ZINC000595766430 478984493 /nfs/dbraw/zinc/98/44/93/478984493.db2.gz HGFWXLVRIRPXCF-UHFFFAOYSA-N 1 1 345.374 2.808 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](C)O[C@@H](C)C1 ZINC000595781390 478993381 /nfs/dbraw/zinc/99/33/81/478993381.db2.gz RRYRKVJXWRBQNK-KGLIPLIRSA-N 1 1 335.404 2.731 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](N(C)C(=O)N(C)C)C1 ZINC000595823782 479016150 /nfs/dbraw/zinc/01/61/50/479016150.db2.gz QYEOHHVYDLKTEF-HIFRSBDPSA-N 1 1 334.420 2.652 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@H]4COC[C@@H]4C3)co2)cc1 ZINC000595826588 479018532 /nfs/dbraw/zinc/01/85/32/479018532.db2.gz AUNOEIHQSRNRLC-KBPBESRZSA-N 1 1 329.356 2.718 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@H]4COC[C@H]4C3)co2)cc1 ZINC000595826590 479018691 /nfs/dbraw/zinc/01/86/91/479018691.db2.gz AUNOEIHQSRNRLC-UONOGXRCSA-N 1 1 329.356 2.718 10 5 EFBEMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CC[C@@H]2COC[C@@H]2C1 ZINC000595827101 479021318 /nfs/dbraw/zinc/02/13/18/479021318.db2.gz LNEBVTBQIHKVTA-NEPJUHHUSA-N 1 1 341.205 2.826 10 5 EFBEMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CC[C@@H]2COC[C@@H]2C1 ZINC000595827101 479021325 /nfs/dbraw/zinc/02/13/25/479021325.db2.gz LNEBVTBQIHKVTA-NEPJUHHUSA-N 1 1 341.205 2.826 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@H](C2CCC2)C1 ZINC000595832069 479023229 /nfs/dbraw/zinc/02/32/29/479023229.db2.gz HJVQPYGEVWCUGG-CVEARBPZSA-N 1 1 334.416 2.847 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000592780973 479040913 /nfs/dbraw/zinc/04/09/13/479040913.db2.gz SPALPFHMYAPKNG-JTQLQIEISA-N 1 1 342.359 2.820 10 5 EFBEMO CCN1CC[C@@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)[C@@H](C)C1 ZINC000573360053 479048053 /nfs/dbraw/zinc/04/80/53/479048053.db2.gz BQUTYVKPTHYZEO-SUMWQHHRSA-N 1 1 330.432 2.939 10 5 EFBEMO C[N@H+]1C[C@@H](CNC(=O)c2ccc([N+](=O)[O-])s2)[C@H](c2ccccc2)C1 ZINC000592879801 479087292 /nfs/dbraw/zinc/08/72/92/479087292.db2.gz DDMHINSZXALTGW-KGLIPLIRSA-N 1 1 345.424 2.732 10 5 EFBEMO CC[C@@H](O)[C@H]1CCCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000593014360 479126039 /nfs/dbraw/zinc/12/60/39/479126039.db2.gz JBWXRNWLESBRBF-HZPDHXFCSA-N 1 1 336.388 2.507 10 5 EFBEMO CCN1CC[NH+](CCCNc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599022928 479130092 /nfs/dbraw/zinc/13/00/92/479130092.db2.gz VQWUCKXQEOBOOS-UHFFFAOYSA-N 1 1 343.431 2.583 10 5 EFBEMO C[C@@H](Nc1ccc2cnccc2c1[N+](=O)[O-])[C@H](C)[NH+]1CCOCC1 ZINC000599038559 479133704 /nfs/dbraw/zinc/13/37/04/479133704.db2.gz LSACORFHNAUZJZ-OLZOCXBDSA-N 1 1 330.388 2.664 10 5 EFBEMO Cn1ccnc1[C@@H]([NH2+]CC[C@@H]1CCCOC1)c1cccc([N+](=O)[O-])c1 ZINC000599057419 479142826 /nfs/dbraw/zinc/14/28/26/479142826.db2.gz OXCDXRUXHHAAAM-YOEHRIQHSA-N 1 1 344.415 2.824 10 5 EFBEMO COC(=O)c1c(Cl)c(NC[C@@H](C)[N@@H+](C)C2CC2)ccc1[N+](=O)[O-] ZINC000596109517 479143165 /nfs/dbraw/zinc/14/31/65/479143165.db2.gz BXIHCNNAJMUQRL-SECBINFHSA-N 1 1 341.795 2.929 10 5 EFBEMO CC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCCOC1 ZINC000593066292 479155584 /nfs/dbraw/zinc/15/55/84/479155584.db2.gz AYEKVYMAUGYNDS-CQSZACIVSA-N 1 1 332.360 2.646 10 5 EFBEMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCCOC1 ZINC000593066292 479155593 /nfs/dbraw/zinc/15/55/93/479155593.db2.gz AYEKVYMAUGYNDS-CQSZACIVSA-N 1 1 332.360 2.646 10 5 EFBEMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCCOC1 ZINC000593069519 479155940 /nfs/dbraw/zinc/15/59/40/479155940.db2.gz TWBKLBRFRPUHMS-OAHLLOKOSA-N 1 1 335.404 2.733 10 5 EFBEMO CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)[C@@H]1CCCOC1 ZINC000593068754 479156965 /nfs/dbraw/zinc/15/69/65/479156965.db2.gz OFYZXYLLUKBAEZ-CQSZACIVSA-N 1 1 335.404 2.733 10 5 EFBEMO C[N@H+]1CCC[C@]2(CCN(c3nc4c(cc3[N+](=O)[O-])CCCC4)C2)C1 ZINC000569689657 479157107 /nfs/dbraw/zinc/15/71/07/479157107.db2.gz RTOSVQGYLJVBBF-SFHVURJKSA-N 1 1 330.432 2.791 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@H]2CNc2ccc([N+](=O)[O-])nc2)cc1 ZINC000599141098 479179113 /nfs/dbraw/zinc/17/91/13/479179113.db2.gz WSEGSYQHDYWGLM-HNNXBMFYSA-N 1 1 328.372 2.685 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593116868 479183128 /nfs/dbraw/zinc/18/31/28/479183128.db2.gz JKDNGBQWCVJCKB-QMTHXVAHSA-N 1 1 325.315 2.653 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593116868 479183135 /nfs/dbraw/zinc/18/31/35/479183135.db2.gz JKDNGBQWCVJCKB-QMTHXVAHSA-N 1 1 325.315 2.653 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c1 ZINC000593115278 479183168 /nfs/dbraw/zinc/18/31/68/479183168.db2.gz CDGRJEKZXLOFDC-AWEZNQCLSA-N 1 1 326.299 2.613 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@]3(CC3(F)F)C2)c1 ZINC000593115278 479183177 /nfs/dbraw/zinc/18/31/77/479183177.db2.gz CDGRJEKZXLOFDC-AWEZNQCLSA-N 1 1 326.299 2.613 10 5 EFBEMO COC(=O)c1c(Cl)c(N2C[C@H](C)[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000596180039 479184544 /nfs/dbraw/zinc/18/45/44/479184544.db2.gz WSAPUXZSDLQIQH-VHSXEESVSA-N 1 1 341.795 2.564 10 5 EFBEMO COC(=O)c1c(Cl)c(N2C[C@H](C)[N@@H+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000596180039 479184546 /nfs/dbraw/zinc/18/45/46/479184546.db2.gz WSAPUXZSDLQIQH-VHSXEESVSA-N 1 1 341.795 2.564 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000596187133 479187480 /nfs/dbraw/zinc/18/74/80/479187480.db2.gz OCPQFOJVJMJGPX-UHFFFAOYSA-N 1 1 336.436 2.557 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[N@@H+](C)CC(C)C ZINC000593128684 479195086 /nfs/dbraw/zinc/19/50/86/479195086.db2.gz LVTZAWHWCNMIPT-UHFFFAOYSA-N 1 1 338.408 2.703 10 5 EFBEMO CC[N@@H+]1CCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)[C@H](C)C1 ZINC000596229735 479213301 /nfs/dbraw/zinc/21/33/01/479213301.db2.gz FDFQBYMLTVHNPX-SNVBAGLBSA-N 1 1 341.795 2.565 10 5 EFBEMO CC[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)[C@H](C)C1 ZINC000596229735 479213308 /nfs/dbraw/zinc/21/33/08/479213308.db2.gz FDFQBYMLTVHNPX-SNVBAGLBSA-N 1 1 341.795 2.565 10 5 EFBEMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC000596275378 479233468 /nfs/dbraw/zinc/23/34/68/479233468.db2.gz RBTRXVFGBNTHCQ-GHMZBOCLSA-N 1 1 347.337 2.505 10 5 EFBEMO CC(C)c1n[nH]c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1[N+](=O)[O-] ZINC000610924038 479234247 /nfs/dbraw/zinc/23/42/47/479234247.db2.gz XQFYKLRERFGLLD-OLZOCXBDSA-N 1 1 349.435 2.529 10 5 EFBEMO CC(C)c1[nH]nc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C(C)C)c1[N+](=O)[O-] ZINC000610924038 479234252 /nfs/dbraw/zinc/23/42/52/479234252.db2.gz XQFYKLRERFGLLD-OLZOCXBDSA-N 1 1 349.435 2.529 10 5 EFBEMO CC(C)c1[nH]nc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1[N+](=O)[O-] ZINC000610924038 479234258 /nfs/dbraw/zinc/23/42/58/479234258.db2.gz XQFYKLRERFGLLD-OLZOCXBDSA-N 1 1 349.435 2.529 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000593203882 479238510 /nfs/dbraw/zinc/23/85/10/479238510.db2.gz JUIAYAAISCKMCD-UHFFFAOYSA-N 1 1 335.448 2.967 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000596307891 479248060 /nfs/dbraw/zinc/24/80/60/479248060.db2.gz QGIPZGQANCEGMQ-GFCCVEGCSA-N 1 1 332.404 2.764 10 5 EFBEMO CCN(C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](C)C1 ZINC000596358243 479265811 /nfs/dbraw/zinc/26/58/11/479265811.db2.gz ZDSWZTWFSTXUNL-KRWDZBQOSA-N 1 1 348.447 2.653 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](Cc1cccnc1C(F)(F)F)CC2 ZINC000599354523 479266008 /nfs/dbraw/zinc/26/60/08/479266008.db2.gz XBFSGTBSBKVHLO-UHFFFAOYSA-N 1 1 338.289 2.962 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](Cc1cccnc1C(F)(F)F)CC2 ZINC000599354523 479266017 /nfs/dbraw/zinc/26/60/17/479266017.db2.gz XBFSGTBSBKVHLO-UHFFFAOYSA-N 1 1 338.289 2.962 10 5 EFBEMO C[C@@H]1C[C@H]1C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000599370495 479273461 /nfs/dbraw/zinc/27/34/61/479273461.db2.gz IXZRMFFUJLBFKK-OLZOCXBDSA-N 1 1 329.404 2.639 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(C(=O)c2cc(SC)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000603146426 479274593 /nfs/dbraw/zinc/27/45/93/479274593.db2.gz UFFNAUWKFPYZBI-TXEJJXNPSA-N 1 1 337.445 2.871 10 5 EFBEMO O=[N+]([O-])c1sccc1NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000596424988 479288570 /nfs/dbraw/zinc/28/85/70/479288570.db2.gz VYJOBRLKRHYGQA-AWEZNQCLSA-N 1 1 333.413 2.835 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1OC[C@H](O)C[N@H+](C)Cc1ccccc1 ZINC000611150040 479294893 /nfs/dbraw/zinc/29/48/93/479294893.db2.gz WBTRUSKXDXQNJY-MRXNPFEDSA-N 1 1 330.384 2.775 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1OC[C@@H](O)C[N@H+](C)Cc1ccccc1 ZINC000611150039 479294909 /nfs/dbraw/zinc/29/49/09/479294909.db2.gz WBTRUSKXDXQNJY-INIZCTEOSA-N 1 1 330.384 2.775 10 5 EFBEMO CCN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@@H+](C)C1 ZINC000596451730 479300461 /nfs/dbraw/zinc/30/04/61/479300461.db2.gz FNFBMUBZGLNEOG-NSHDSACASA-N 1 1 326.784 2.806 10 5 EFBEMO CCN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@@H+](C)C1 ZINC000596451729 479300992 /nfs/dbraw/zinc/30/09/92/479300992.db2.gz FNFBMUBZGLNEOG-LLVKDONJSA-N 1 1 326.784 2.806 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)cccc1[N+](=O)[O-] ZINC000611179874 479304299 /nfs/dbraw/zinc/30/42/99/479304299.db2.gz MLIMBMOXPYHPMM-GHMZBOCLSA-N 1 1 327.331 2.817 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](C(F)F)C2)cccc1[N+](=O)[O-] ZINC000611179874 479304305 /nfs/dbraw/zinc/30/43/05/479304305.db2.gz MLIMBMOXPYHPMM-GHMZBOCLSA-N 1 1 327.331 2.817 10 5 EFBEMO CCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)C1 ZINC000596516006 479324633 /nfs/dbraw/zinc/32/46/33/479324633.db2.gz BQFGZCIMRJMEHZ-SNVBAGLBSA-N 1 1 341.795 2.931 10 5 EFBEMO C[N@H+]1CCO[C@H]2CCN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)C[C@H]21 ZINC000585781966 479325639 /nfs/dbraw/zinc/32/56/39/479325639.db2.gz GYPISXYTXYITOH-CVEARBPZSA-N 1 1 349.431 2.681 10 5 EFBEMO O=C(CC[N@H+]1CC[C@H]2CC[C@@H](C1)S2)Nc1ccc([N+](=O)[O-])cc1 ZINC000599553401 479330939 /nfs/dbraw/zinc/33/09/39/479330939.db2.gz SNWMFSQRZAEFAC-CABCVRRESA-N 1 1 335.429 2.893 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553431 479330966 /nfs/dbraw/zinc/33/09/66/479330966.db2.gz UMSCWGPFSKOUFP-OLZOCXBDSA-N 1 1 335.429 2.812 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553431 479330971 /nfs/dbraw/zinc/33/09/71/479330971.db2.gz UMSCWGPFSKOUFP-OLZOCXBDSA-N 1 1 335.429 2.812 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@@]3(CCCOC3)C1)OCCO2 ZINC000611273868 479333059 /nfs/dbraw/zinc/33/30/59/479333059.db2.gz UUIJWQHEFDNWFI-GOSISDBHSA-N 1 1 348.399 2.759 10 5 EFBEMO CC[N@@H+](CCc1nccs1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000611274657 479333554 /nfs/dbraw/zinc/33/35/54/479333554.db2.gz VOZUFTXREUIQMJ-UHFFFAOYSA-N 1 1 349.412 2.887 10 5 EFBEMO O=C1C[C@H]([C@@H]2CCCC[N@@H+]2C/C=C\c2ccccc2[N+](=O)[O-])CN1 ZINC000611287514 479338846 /nfs/dbraw/zinc/33/88/46/479338846.db2.gz DQHDFBZDCOHPRR-BNOHMRNQSA-N 1 1 329.400 2.599 10 5 EFBEMO COC(=O)c1ccc(C[N@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)nc1 ZINC000586760136 479345446 /nfs/dbraw/zinc/34/54/46/479345446.db2.gz SILMQLJTQYHFDP-LBPRGKRZSA-N 1 1 329.356 2.969 10 5 EFBEMO COC(=O)c1ccc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)nc1 ZINC000586760136 479345449 /nfs/dbraw/zinc/34/54/49/479345449.db2.gz SILMQLJTQYHFDP-LBPRGKRZSA-N 1 1 329.356 2.969 10 5 EFBEMO C[N@@H+](CCCNc1cc(N)c([N+](=O)[O-])c(CO)c1)C1CCCCC1 ZINC000587121371 479369886 /nfs/dbraw/zinc/36/98/86/479369886.db2.gz ZUCXXUQKAJHCDX-UHFFFAOYSA-N 1 1 336.436 2.736 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)[C@H]2CCC[C@@H]21 ZINC000599651438 479370008 /nfs/dbraw/zinc/37/00/08/479370008.db2.gz BKNXLGJUUAAHMC-OAGGEKHMSA-N 1 1 348.399 2.767 10 5 EFBEMO CCC1(N2CCOCC2)CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000599668474 479379477 /nfs/dbraw/zinc/37/94/77/479379477.db2.gz FVDSGHXVHUYENM-UHFFFAOYSA-N 1 1 333.432 2.672 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@@H](OC(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000611579286 479423000 /nfs/dbraw/zinc/42/30/00/479423000.db2.gz UZTVBWVEIRIUDI-LLVKDONJSA-N 1 1 343.330 2.627 10 5 EFBEMO CC(C)C[N@@H+](C)CCC[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000593717013 479432879 /nfs/dbraw/zinc/43/28/79/479432879.db2.gz XARUPGCEULQOOT-JKSUJKDBSA-N 1 1 337.468 2.843 10 5 EFBEMO C[C@H]1C[C@H](NC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)CC[N@H+]1C ZINC000599832240 479443473 /nfs/dbraw/zinc/44/34/73/479443473.db2.gz TYGBZTVHQACPKJ-NWDGAFQWSA-N 1 1 343.387 2.747 10 5 EFBEMO CC(C)c1ccc(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000588816541 479444250 /nfs/dbraw/zinc/44/42/50/479444250.db2.gz WQALVOZAHPNLMF-JKSUJKDBSA-N 1 1 349.406 2.977 10 5 EFBEMO CC[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C[C@@H]1C ZINC000599833386 479444673 /nfs/dbraw/zinc/44/46/73/479444673.db2.gz RAJPPYUYWOOKQU-LBPRGKRZSA-N 1 1 343.387 2.701 10 5 EFBEMO CCN(C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000596831880 479445491 /nfs/dbraw/zinc/44/54/91/479445491.db2.gz MDMLUCXXQYLROE-CYBMUJFWSA-N 1 1 336.392 2.551 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000593756220 479448478 /nfs/dbraw/zinc/44/84/78/479448478.db2.gz MZJJKMIHAUFWEV-UHFFFAOYSA-N 1 1 332.404 2.784 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[N@H+](C3CCCC3)CC2)c1 ZINC000611753433 479467420 /nfs/dbraw/zinc/46/74/20/479467420.db2.gz RUYQJPZDHZEWJX-UHFFFAOYSA-N 1 1 347.415 2.836 10 5 EFBEMO Nc1nccc([C@@H]2CCC[N@@H+](CC=Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC000589178370 479493018 /nfs/dbraw/zinc/49/30/18/479493018.db2.gz XJKKPNNUIXAKHQ-OMVNSRBRSA-N 1 1 339.399 2.690 10 5 EFBEMO Cc1c(C[N@H+]2C[C@@H](O)[C@H](Oc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000602728770 479509251 /nfs/dbraw/zinc/50/92/51/479509251.db2.gz NSKZTDSCGQFERA-QZTJIDSGSA-N 1 1 328.368 2.527 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H](C)CCSC)c1 ZINC000589502415 479534432 /nfs/dbraw/zinc/53/44/32/479534432.db2.gz SKYSFCKYGFAEEZ-NSHDSACASA-N 1 1 326.418 2.955 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](c3ccncc3)C2)c1 ZINC000593987887 479534650 /nfs/dbraw/zinc/53/46/50/479534650.db2.gz XNLGTRFBJHOKPT-HNNXBMFYSA-N 1 1 341.367 2.766 10 5 EFBEMO C[N@H+]1C[C@H]2CCN(C(=O)c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)[C@H]2C1 ZINC000590044640 479595557 /nfs/dbraw/zinc/59/55/57/479595557.db2.gz KALJCNQOMFSRFG-CJNGLKHVSA-N 1 1 331.416 2.668 10 5 EFBEMO C[N@@H+]1C[C@H]2[C@@H](CCN2Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000590052428 479597494 /nfs/dbraw/zinc/59/74/94/479597494.db2.gz BXPBQPVXVIYPNB-GUYCJALGSA-N 1 1 327.384 2.991 10 5 EFBEMO CN1C[C@H]2[C@@H](CC[N@@H+]2Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000590052428 479597498 /nfs/dbraw/zinc/59/74/98/479597498.db2.gz BXPBQPVXVIYPNB-GUYCJALGSA-N 1 1 327.384 2.991 10 5 EFBEMO CN1C[C@H]2[C@@H](CC[N@H+]2Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000590052428 479597502 /nfs/dbraw/zinc/59/75/02/479597502.db2.gz BXPBQPVXVIYPNB-GUYCJALGSA-N 1 1 327.384 2.991 10 5 EFBEMO C[C@@]12COC[C@H]1C[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C2 ZINC000597211833 479622495 /nfs/dbraw/zinc/62/24/95/479622495.db2.gz PKBGKIHBXIHWMR-IAQYHMDHSA-N 1 1 328.315 2.665 10 5 EFBEMO C[C@@]12COC[C@H]1C[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C2 ZINC000597211833 479622499 /nfs/dbraw/zinc/62/24/99/479622499.db2.gz PKBGKIHBXIHWMR-IAQYHMDHSA-N 1 1 328.315 2.665 10 5 EFBEMO C[N@H+]1CCC[C@@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000612286222 479633043 /nfs/dbraw/zinc/63/30/43/479633043.db2.gz KKIHWHMIZVOTRZ-LLVKDONJSA-N 1 1 343.836 2.551 10 5 EFBEMO CC(C)c1ccc(CN2CCC([N@H+]3CC[C@@H](O)C3)CC2)cc1[N+](=O)[O-] ZINC000597235832 479635492 /nfs/dbraw/zinc/63/54/92/479635492.db2.gz LFRXXUTVOBSUFT-QGZVFWFLSA-N 1 1 347.459 2.749 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCCO[C@@H](C(C)C)C2)c1 ZINC000590384874 479637402 /nfs/dbraw/zinc/63/74/02/479637402.db2.gz GSOYYRIRBKBVTM-MRXNPFEDSA-N 1 1 336.388 2.628 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCO[C@@H](C(C)C)C2)c1 ZINC000590384874 479637406 /nfs/dbraw/zinc/63/74/06/479637406.db2.gz GSOYYRIRBKBVTM-MRXNPFEDSA-N 1 1 336.388 2.628 10 5 EFBEMO C[C@@H]([NH2+][C@@H](c1cnn(C)c1)C1(CO)CCC1)c1ccccc1[N+](=O)[O-] ZINC000590599286 479666746 /nfs/dbraw/zinc/66/67/46/479666746.db2.gz GCIKBYNDGZDQBW-DYVFJYSZSA-N 1 1 344.415 2.883 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](Cc1cnn(Cc3ccccc3)c1)CC2 ZINC000612469098 479677865 /nfs/dbraw/zinc/67/78/65/479677865.db2.gz NHPAOFPWCSFJFB-UHFFFAOYSA-N 1 1 349.394 2.793 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](Cc1cnn(Cc3ccccc3)c1)CC2 ZINC000612469098 479677870 /nfs/dbraw/zinc/67/78/70/479677870.db2.gz NHPAOFPWCSFJFB-UHFFFAOYSA-N 1 1 349.394 2.793 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000619252189 479732809 /nfs/dbraw/zinc/73/28/09/479732809.db2.gz GNKLGIMCEVZZSX-GJZGRUSLSA-N 1 1 349.406 2.778 10 5 EFBEMO C[C@H](Nc1ccc([N+](=O)[O-])nc1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000610160283 480245270 /nfs/dbraw/zinc/24/52/70/480245270.db2.gz IYDHTHJUBXSMQV-YOEHRIQHSA-N 1 1 342.399 2.691 10 5 EFBEMO C[C@H](Nc1ccc([N+](=O)[O-])nc1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000610160283 480245273 /nfs/dbraw/zinc/24/52/73/480245273.db2.gz IYDHTHJUBXSMQV-YOEHRIQHSA-N 1 1 342.399 2.691 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)n1 ZINC000614517863 480329751 /nfs/dbraw/zinc/32/97/51/480329751.db2.gz CZNSKXNLKCPOLN-OWCLPIDISA-N 1 1 348.447 2.685 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)n1 ZINC000614517863 480329754 /nfs/dbraw/zinc/32/97/54/480329754.db2.gz CZNSKXNLKCPOLN-OWCLPIDISA-N 1 1 348.447 2.685 10 5 EFBEMO C[C@@H]1[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCC12CCOCC2 ZINC000618305605 480613750 /nfs/dbraw/zinc/61/37/50/480613750.db2.gz MOZITFXKWXJOPZ-LBPRGKRZSA-N 1 1 330.388 2.862 10 5 EFBEMO C[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000179707911 533745011 /nfs/dbraw/zinc/74/50/11/533745011.db2.gz YWOJTTZNICAKFS-ZDUSSCGKSA-N 1 1 345.374 2.984 10 5 EFBEMO C[C@@H]1CC[C@](CO)([N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000188010271 534264402 /nfs/dbraw/zinc/26/44/02/534264402.db2.gz YHXSGOYWLMRIHR-PXAZEXFGSA-N 1 1 346.387 2.628 10 5 EFBEMO CCOc1ccc(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)cc1[N+](=O)[O-] ZINC000119102922 520895748 /nfs/dbraw/zinc/89/57/48/520895748.db2.gz DZURBCUNOFRJTL-CABCVRRESA-N 1 1 347.415 2.550 10 5 EFBEMO CC[N@H+](CCc1nccs1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000121079794 521181451 /nfs/dbraw/zinc/18/14/51/521181451.db2.gz QHCUJDVFAWZZQK-LBPRGKRZSA-N 1 1 348.428 2.943 10 5 EFBEMO CC[N@@H+](CCc1nccs1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000121079794 521181458 /nfs/dbraw/zinc/18/14/58/521181458.db2.gz QHCUJDVFAWZZQK-LBPRGKRZSA-N 1 1 348.428 2.943 10 5 EFBEMO CC[N@H+]1CCC[C@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000119610337 521644283 /nfs/dbraw/zinc/64/42/83/521644283.db2.gz IBVSAUZHNMZLNY-INIZCTEOSA-N 1 1 348.447 2.701 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)s2)[C@H](C)C1 ZINC000076484890 521718853 /nfs/dbraw/zinc/71/88/53/521718853.db2.gz XVBCXFBVPKDCOD-PWSUYJOCSA-N 1 1 325.434 2.767 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000245443629 521720029 /nfs/dbraw/zinc/72/00/29/521720029.db2.gz XIYVBEZFRQNJGL-YOEHRIQHSA-N 1 1 348.447 2.504 10 5 EFBEMO COc1cc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)ccc1[N+](=O)[O-] ZINC000245444691 522093687 /nfs/dbraw/zinc/09/36/87/522093687.db2.gz JUIPIMXFOQRQMM-CABCVRRESA-N 1 1 347.415 2.691 10 5 EFBEMO CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000177330276 522588989 /nfs/dbraw/zinc/58/89/89/522588989.db2.gz YCQSDQCSVAEDEM-CYBMUJFWSA-N 1 1 346.362 2.970 10 5 EFBEMO COc1cc(N2CCN(c3cc(C)cc[nH+]3)CC2)c([N+](=O)[O-])cc1F ZINC000153030682 522635659 /nfs/dbraw/zinc/63/56/59/522635659.db2.gz DDHQZXLIQWXTRD-UHFFFAOYSA-N 1 1 346.362 2.773 10 5 EFBEMO CC(C)(C)OC(=O)CCCC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000347787328 534734692 /nfs/dbraw/zinc/73/46/92/534734692.db2.gz BBXIMSFNSQCFED-UHFFFAOYSA-N 1 1 335.404 2.860 10 5 EFBEMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000246178426 523972064 /nfs/dbraw/zinc/97/20/64/523972064.db2.gz BVYPDPJRWMZDRQ-GXTWGEPZSA-N 1 1 337.807 2.805 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000180124969 523983557 /nfs/dbraw/zinc/98/35/57/523983557.db2.gz NFXFFHXFAODNOV-LPHOPBHVSA-N 1 1 339.395 2.699 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(Cc2[nH+]ccn2C)CC1 ZINC000194932716 524901664 /nfs/dbraw/zinc/90/16/64/524901664.db2.gz YEAQSRHRBGHXKQ-UHFFFAOYSA-N 1 1 342.399 2.732 10 5 EFBEMO COc1ccc([C@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1F ZINC000119757583 525323540 /nfs/dbraw/zinc/32/35/40/525323540.db2.gz MEJCVLJRTDUZAW-JTQLQIEISA-N 1 1 347.346 2.692 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C(C)C)C1CCOCC1 ZINC000077323047 526078005 /nfs/dbraw/zinc/07/80/05/526078005.db2.gz TXGDDLXMSDURKJ-UHFFFAOYSA-N 1 1 335.404 2.731 10 5 EFBEMO Cc1nc(C[C@H]2CCC[N@@H+](CCOc3ccccc3[N+](=O)[O-])C2)no1 ZINC000195518294 526923610 /nfs/dbraw/zinc/92/36/10/526923610.db2.gz CXMCMLBEFXEIJV-CQSZACIVSA-N 1 1 346.387 2.620 10 5 EFBEMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCOc3ccc(F)cc3)C2)nc1 ZINC000118867171 527368096 /nfs/dbraw/zinc/36/80/96/527368096.db2.gz TXGQDGIEHRXVFL-AWEZNQCLSA-N 1 1 346.362 2.694 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@@]4(CCOC4)C3)o2)c1 ZINC000153967528 527381018 /nfs/dbraw/zinc/38/10/18/527381018.db2.gz QOXLOFPYTGAXGM-GOSISDBHSA-N 1 1 343.383 2.905 10 5 EFBEMO CC[N@H+](CCc1nccs1)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000159407043 528608001 /nfs/dbraw/zinc/60/80/01/528608001.db2.gz IPOQHIHAIRJPJF-UHFFFAOYSA-N 1 1 348.428 2.863 10 5 EFBEMO CC[N@@H+](CCc1nccs1)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000159407043 528608007 /nfs/dbraw/zinc/60/80/07/528608007.db2.gz IPOQHIHAIRJPJF-UHFFFAOYSA-N 1 1 348.428 2.863 10 5 EFBEMO CC[N@H+](CCc1nccs1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000159253688 528608719 /nfs/dbraw/zinc/60/87/19/528608719.db2.gz UZMBTNBPOHBMJU-UHFFFAOYSA-N 1 1 334.401 2.554 10 5 EFBEMO CC[N@@H+](CCc1nccs1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000159253688 528608722 /nfs/dbraw/zinc/60/87/22/528608722.db2.gz UZMBTNBPOHBMJU-UHFFFAOYSA-N 1 1 334.401 2.554 10 5 EFBEMO CC(C)[N@@H+]1C[C@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)[C@@H](C)C1 ZINC000129734811 529106739 /nfs/dbraw/zinc/10/67/39/529106739.db2.gz GIDBOTILOIMKEC-NHYWBVRUSA-N 1 1 332.404 2.620 10 5 EFBEMO C[N@@H+](Cc1ccccc1)[C@@H](CNc1ccncc1[N+](=O)[O-])C1CC1 ZINC000361006170 536481655 /nfs/dbraw/zinc/48/16/55/536481655.db2.gz AWTQNEWBFNFMCH-KRWDZBQOSA-N 1 1 326.400 2.734 10 5 EFBEMO COc1cc(C[N@H+](C)C[C@H]2COc3ccccc3O2)ccc1[N+](=O)[O-] ZINC000351977185 536747167 /nfs/dbraw/zinc/74/71/67/536747167.db2.gz FWHNHMXBKCZJGW-AWEZNQCLSA-N 1 1 344.367 2.875 10 5 EFBEMO COc1cc(C[N@@H+](C)C[C@H]2COc3ccccc3O2)ccc1[N+](=O)[O-] ZINC000351977185 536747169 /nfs/dbraw/zinc/74/71/69/536747169.db2.gz FWHNHMXBKCZJGW-AWEZNQCLSA-N 1 1 344.367 2.875 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@H](c3nc(C)no3)C2)ccc1[N+](=O)[O-] ZINC000351977727 536756758 /nfs/dbraw/zinc/75/67/58/536756758.db2.gz JZQWUMHPWVIXRV-ZDUSSCGKSA-N 1 1 332.360 2.674 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(-c2cc[nH]n2)o1 ZINC000433310848 536955568 /nfs/dbraw/zinc/95/55/68/536955568.db2.gz JVWOHYQXBJKNMC-UHFFFAOYSA-N 1 1 328.328 2.876 10 5 EFBEMO COC(=O)/C=C\c1ccc(N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000754025064 575376923 /nfs/dbraw/zinc/37/69/23/575376923.db2.gz OJVWFEQSXABDOP-BFDHXNPWSA-N 1 1 345.399 2.818 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC[N@H+](C(C)C)C1 ZINC000755188027 575558361 /nfs/dbraw/zinc/55/83/61/575558361.db2.gz FCZSQHUOXSHDSI-HFQYIWAZSA-N 1 1 331.416 2.845 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCO[C@@H](C3CCCCC3)C2)cc1 ZINC000755306913 575572841 /nfs/dbraw/zinc/57/28/41/575572841.db2.gz KKPMUFXZYULXBM-ZWKOTPCHSA-N 1 1 334.416 2.909 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCO[C@@H](C3CCCCC3)C2)cc1 ZINC000755306913 575572843 /nfs/dbraw/zinc/57/28/43/575572843.db2.gz KKPMUFXZYULXBM-ZWKOTPCHSA-N 1 1 334.416 2.909 10 5 EFBEMO COc1cc(F)c([N+](=O)[O-])c(NC2CCN(c3[nH+]ccn3C)CC2)c1 ZINC000758119593 575860240 /nfs/dbraw/zinc/86/02/40/575860240.db2.gz RJVGHVHFFBQFQU-UHFFFAOYSA-N 1 1 349.366 2.557 10 5 EFBEMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c3nonc32)[C@@H]1c1ccccc1 ZINC000758251268 575864888 /nfs/dbraw/zinc/86/48/88/575864888.db2.gz IPOOSSZYAIVCDG-GUYCJALGSA-N 1 1 339.355 2.988 10 5 EFBEMO Cc1[nH+]ccn1-c1ccc(-c2noc(-c3ccc([N+](=O)[O-])cn3)n2)cn1 ZINC000761918136 576228819 /nfs/dbraw/zinc/22/88/19/576228819.db2.gz JQFRKUOICNWACF-UHFFFAOYSA-N 1 1 349.310 2.596 10 5 EFBEMO C/C(=C\C(=O)NCC[N@@H+]1CC=C(C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000762706009 576326186 /nfs/dbraw/zinc/32/61/86/576326186.db2.gz JKSPDFQCOMEXHO-FYWRMAATSA-N 1 1 329.400 2.766 10 5 EFBEMO CC(=O)c1c(NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000763206415 576366957 /nfs/dbraw/zinc/36/69/57/576366957.db2.gz IASLLUUMPWYCKO-BETUJISGSA-N 1 1 335.404 2.709 10 5 EFBEMO CC(=O)c1c(NCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000763206415 576366959 /nfs/dbraw/zinc/36/69/59/576366959.db2.gz IASLLUUMPWYCKO-BETUJISGSA-N 1 1 335.404 2.709 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@H]3COCC[C@H]32)c2ccc([N+](=O)[O-])cc12 ZINC000765081872 577004820 /nfs/dbraw/zinc/00/48/20/577004820.db2.gz RDPKSMJUAXHQLV-XJKSGUPXSA-N 1 1 330.388 2.711 10 5 EFBEMO CCOC(=O)[C@H]1CCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000768532264 577281000 /nfs/dbraw/zinc/28/10/00/577281000.db2.gz CSEFTIRTTXBLJI-QGZVFWFLSA-N 1 1 347.415 2.591 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])c1 ZINC000774910508 581503957 /nfs/dbraw/zinc/50/39/57/581503957.db2.gz CFIMNSORQZUTMM-GXTWGEPZSA-N 1 1 335.360 2.752 10 5 EFBEMO CC[N@@H+](CCNC(=O)Cc1ccc(C)o1)Cc1cccc([N+](=O)[O-])c1 ZINC001691014989 1247924177 /nfs/dbraw/zinc/92/41/77/1247924177.db2.gz OTUOGEJBSQFQNY-UHFFFAOYSA-N 1 1 345.399 2.677 10 5 EFBEMO CC[N@@H+](CCNC(=O)C(C)(C)C1CC1)Cc1cccc([N+](=O)[O-])c1 ZINC001691035678 1248031498 /nfs/dbraw/zinc/03/14/98/1248031498.db2.gz JXYZHHKBPAPZRS-UHFFFAOYSA-N 1 1 333.432 2.969 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(C(=O)NCc2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC001687333881 1248259991 /nfs/dbraw/zinc/25/99/91/1248259991.db2.gz NNENIKSJKDYKMW-KBPBESRZSA-N 1 1 334.420 2.527 10 5 EFBEMO O=C(NCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)C1(F)CCCC1 ZINC001691215007 1248544439 /nfs/dbraw/zinc/54/44/39/1248544439.db2.gz BRXGZPZEDKUBMA-UHFFFAOYSA-N 1 1 349.406 2.958 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[NH2+][C@@H]1C[C@@H](O)c3ccccc31)OCCO2 ZINC000850371563 1250452224 /nfs/dbraw/zinc/45/22/24/1250452224.db2.gz KUHCRTBVKGPSDA-GDBMZVCRSA-N 1 1 342.351 2.634 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2C[C@H](O)C[C@H]2[C@H]2CCCOC2)c1 ZINC000824655697 1278221744 /nfs/dbraw/zinc/22/17/44/1278221744.db2.gz ZASKKDIEARTERB-PEYYIBSZSA-N 1 1 340.807 2.610 10 5 EFBEMO CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@@]12CC[N@@H+](C1)CCC2 ZINC000823621337 1265403018 /nfs/dbraw/zinc/40/30/18/1265403018.db2.gz OBXGZDBWIYRGGH-INIZCTEOSA-N 1 1 337.807 2.693 10 5 EFBEMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CN(C2CC2)C(=O)O1 ZINC000844282973 1278861448 /nfs/dbraw/zinc/86/14/48/1278861448.db2.gz YDBZQFLAZCSPAP-INIZCTEOSA-N 1 1 333.388 2.788 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CC(C)(C)S(C)(=O)=O ZINC000787405172 1275777618 /nfs/dbraw/zinc/77/76/18/1275777618.db2.gz BCTVSISGMHVTHA-LCYFTJDESA-N 1 1 340.445 2.753 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC(C)(C)S(C)(=O)=O ZINC000787405172 1275777624 /nfs/dbraw/zinc/77/76/24/1275777624.db2.gz BCTVSISGMHVTHA-LCYFTJDESA-N 1 1 340.445 2.753 10 5 EFBEMO CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CC[N@H+]1CC[C@@H](F)C1 ZINC001136153816 1276543935 /nfs/dbraw/zinc/54/39/35/1276543935.db2.gz VTAMHNRNIIMZLI-GFCCVEGCSA-N 1 1 343.786 2.641 10 5 EFBEMO CN(C)Cc1cc(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1F ZINC000819073851 1276619748 /nfs/dbraw/zinc/61/97/48/1276619748.db2.gz QGMNYZJZJYCZKJ-GOSISDBHSA-N 1 1 347.390 2.619 10 5 EFBEMO O=[N+]([O-])c1c(Br)cccc1N1CC[NH+](C2CC2)CC1 ZINC000820645374 1277278999 /nfs/dbraw/zinc/27/89/99/1277278999.db2.gz RPZMJXMZAXKQQK-UHFFFAOYSA-N 1 1 326.194 2.642 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1COC(=O)[C@@H]1CCCC[N@@H+]1CC ZINC000746985245 1277975848 /nfs/dbraw/zinc/97/58/48/1277975848.db2.gz QDTAHPRGFMRGSC-HNNXBMFYSA-N 1 1 336.388 2.911 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1COC(=O)[C@@H]1CCCC[N@H+]1CC ZINC000746985245 1277975852 /nfs/dbraw/zinc/97/58/52/1277975852.db2.gz QDTAHPRGFMRGSC-HNNXBMFYSA-N 1 1 336.388 2.911 10 5 EFBEMO O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000791258162 1278005002 /nfs/dbraw/zinc/00/50/02/1278005002.db2.gz KTPHJDPJOQGZGC-JSGCOSHPSA-N 1 1 341.770 2.507 10 5 EFBEMO Cc1cc(F)cc(C(=O)NCCC[N@H+](C)CC(C)C)c1[N+](=O)[O-] ZINC000844654267 1279139957 /nfs/dbraw/zinc/13/99/57/1279139957.db2.gz CZDXSOVXTZFPQD-UHFFFAOYSA-N 1 1 325.384 2.750 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@]3(CC3(F)F)C1)OCCO2 ZINC000846108201 1280019668 /nfs/dbraw/zinc/01/96/68/1280019668.db2.gz NCTWGOISHVGSCW-HNNXBMFYSA-N 1 1 340.326 2.987 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@]3(CC3(F)F)C1)OCCO2 ZINC000846108201 1280019679 /nfs/dbraw/zinc/01/96/79/1280019679.db2.gz NCTWGOISHVGSCW-HNNXBMFYSA-N 1 1 340.326 2.987 10 5 EFBEMO C[C@H]([NH2+][C@H]1COc2ccccc2[C@@H]1O)c1c(F)cccc1[N+](=O)[O-] ZINC000872074273 1287420777 /nfs/dbraw/zinc/42/07/77/1287420777.db2.gz ZTCAJOLVGNYGKP-SVKFGRERSA-N 1 1 332.331 2.879 10 5 EFBEMO C[C@@H]([NH2+]C1CCN([C@@H]2CCOC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872088408 1287425204 /nfs/dbraw/zinc/42/52/04/1287425204.db2.gz NYAWAZARDQZODC-TZMCWYRMSA-N 1 1 337.395 2.638 10 5 EFBEMO CC(C)(O)C1CC[NH+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC001175427650 1287425121 /nfs/dbraw/zinc/42/51/21/1287425121.db2.gz PYLOWHMGMVPBTN-UHFFFAOYSA-N 1 1 346.387 2.628 10 5 EFBEMO C[C@@H]([NH2+]CCOCC(=O)OC(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872090682 1287426062 /nfs/dbraw/zinc/42/60/62/1287426062.db2.gz DTDKZITVSBREIF-LLVKDONJSA-N 1 1 342.367 2.743 10 5 EFBEMO CCN1C[C@@H](C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)OC1=O ZINC000846957484 1280658824 /nfs/dbraw/zinc/65/88/24/1280658824.db2.gz LIUZGKAEUGTHTH-GOEBONIOSA-N 1 1 333.388 2.615 10 5 EFBEMO CCN1C[C@H](C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)OC1=O ZINC000846957501 1280658926 /nfs/dbraw/zinc/65/89/26/1280658926.db2.gz LIUZGKAEUGTHTH-ZBFHGGJFSA-N 1 1 333.388 2.615 10 5 EFBEMO CCOc1cc(C[N@H+]2CCC[C@H]3[C@@H]2C(C)(C)[C@H]3O)ccc1[N+](=O)[O-] ZINC000872259905 1287507129 /nfs/dbraw/zinc/50/71/29/1287507129.db2.gz DETIZOHEGMBPNR-XKQJLSEDSA-N 1 1 334.416 2.975 10 5 EFBEMO O=C(C[N@H+]1CC[C@@H](C2CCCC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001171332915 1281632628 /nfs/dbraw/zinc/63/26/28/1281632628.db2.gz UWAVKBVHQRCUQW-MRXNPFEDSA-N 1 1 343.427 2.996 10 5 EFBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](C(C)(C)O)C1 ZINC001175890538 1287578309 /nfs/dbraw/zinc/57/83/09/1287578309.db2.gz BENLQHOPRANWTH-AAEUAGOBSA-N 1 1 346.387 2.799 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C(C)(C)O)C1 ZINC001175890539 1287578942 /nfs/dbraw/zinc/57/89/42/1287578942.db2.gz BENLQHOPRANWTH-DGCLKSJQSA-N 1 1 346.387 2.799 10 5 EFBEMO COC(=O)/C=C\c1ccc(N[C@H](C)C[N@@H+](C)C(C)C)c([N+](=O)[O-])c1 ZINC000811859119 1284700624 /nfs/dbraw/zinc/70/06/24/1284700624.db2.gz NUCPTBXYNPOOSH-FNOHHLHBSA-N 1 1 335.404 2.922 10 5 EFBEMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)c1 ZINC000747833149 1285588241 /nfs/dbraw/zinc/58/82/41/1285588241.db2.gz VEOCGIKXNUINLZ-KBPBESRZSA-N 1 1 330.388 2.651 10 5 EFBEMO O=C(CC[C@H]1CCOC1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813170693 1285702145 /nfs/dbraw/zinc/70/21/45/1285702145.db2.gz UOMPPOWTLAZKEG-YOEHRIQHSA-N 1 1 348.399 2.529 10 5 EFBEMO O=C(CC[C@H]1CCOC1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813170693 1285702155 /nfs/dbraw/zinc/70/21/55/1285702155.db2.gz UOMPPOWTLAZKEG-YOEHRIQHSA-N 1 1 348.399 2.529 10 5 EFBEMO COC(C)(C)CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171361 1285703118 /nfs/dbraw/zinc/70/31/18/1285703118.db2.gz IXRXEVCWDOAZMR-HNNXBMFYSA-N 1 1 336.388 2.527 10 5 EFBEMO COC(C)(C)CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171361 1285703120 /nfs/dbraw/zinc/70/31/20/1285703120.db2.gz IXRXEVCWDOAZMR-HNNXBMFYSA-N 1 1 336.388 2.527 10 5 EFBEMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1C[C@@H]1C(F)F ZINC000813171341 1285703885 /nfs/dbraw/zinc/70/38/85/1285703885.db2.gz UPEXBKUHWXCBEH-IHRRRGAJSA-N 1 1 340.326 2.614 10 5 EFBEMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1C[C@@H]1C(F)F ZINC000813171341 1285703888 /nfs/dbraw/zinc/70/38/88/1285703888.db2.gz UPEXBKUHWXCBEH-IHRRRGAJSA-N 1 1 340.326 2.614 10 5 EFBEMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1 ZINC001134332170 1286579148 /nfs/dbraw/zinc/57/91/48/1286579148.db2.gz FFXZGRPODAXVAP-PXAZEXFGSA-N 1 1 349.456 2.731 10 5 EFBEMO NC(=O)c1ccc(C[NH2+][C@@H]2CCc3c2cccc3F)c([N+](=O)[O-])c1 ZINC001176243994 1287913242 /nfs/dbraw/zinc/91/32/42/1287913242.db2.gz UFJUXUQSNHZJJW-OAHLLOKOSA-N 1 1 329.331 2.610 10 5 EFBEMO CC(C)[C@@H]1C[C@H](N2CCCC2)C[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001176887187 1288162094 /nfs/dbraw/zinc/16/20/94/1288162094.db2.gz PGFOPJIELKVBKW-GBESFXJTSA-N 1 1 347.459 2.823 10 5 EFBEMO CC(C)[C@@H]1C[C@H](N2CCCC2)C[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001176887187 1288162097 /nfs/dbraw/zinc/16/20/97/1288162097.db2.gz PGFOPJIELKVBKW-GBESFXJTSA-N 1 1 347.459 2.823 10 5 EFBEMO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000824634878 1289733995 /nfs/dbraw/zinc/73/39/95/1289733995.db2.gz CJUGNNJGESJZSQ-GWCFXTLKSA-N 1 1 343.221 2.950 10 5 EFBEMO O=[N+]([O-])c1c(N[C@@H]2CC[N@@H+](CC3CCCC3)C2)nc2ccccn21 ZINC001185555722 1290707761 /nfs/dbraw/zinc/70/77/61/1290707761.db2.gz XGCHTPVHXNPICN-CQSZACIVSA-N 1 1 329.404 2.919 10 5 EFBEMO CCC[C@@H]1CN(c2cc(C)sc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC001185848636 1290778889 /nfs/dbraw/zinc/77/88/89/1290778889.db2.gz PHNPIGSEBOWOOX-CYBMUJFWSA-N 1 1 327.450 2.902 10 5 EFBEMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cn1ccc(Br)n1 ZINC000795645803 1290800065 /nfs/dbraw/zinc/80/00/65/1290800065.db2.gz YVIRROXYKBMBSD-UHFFFAOYSA-N 1 1 339.193 2.686 10 5 EFBEMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cn1ccc(Br)n1 ZINC000795645803 1290800073 /nfs/dbraw/zinc/80/00/73/1290800073.db2.gz YVIRROXYKBMBSD-UHFFFAOYSA-N 1 1 339.193 2.686 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H]1CCC3(CCOCC3)CO1)C2 ZINC000878303061 1291613916 /nfs/dbraw/zinc/61/39/16/1291613916.db2.gz GDMBKOOVXZBKSU-INIZCTEOSA-N 1 1 346.427 2.929 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1CCC3(CCOCC3)CO1)C2 ZINC000878303061 1291613923 /nfs/dbraw/zinc/61/39/23/1291613923.db2.gz GDMBKOOVXZBKSU-INIZCTEOSA-N 1 1 346.427 2.929 10 5 EFBEMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000882271455 1293148182 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NOYDXSHQIVWBEN-QMTHXVAHSA-N 1 1 338.795 2.724 10 5 EFBEMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC000931627307 1297359223 /nfs/dbraw/zinc/35/92/23/1297359223.db2.gz ZMIYUBZZHAYHGL-MWLCHTKSSA-N 1 1 326.784 2.771 10 5 EFBEMO CC[N@H+]1CCN(c2cccc(Br)c2[N+](=O)[O-])C[C@H]1C ZINC001307073857 1324739490 /nfs/dbraw/zinc/73/94/90/1324739490.db2.gz XZYWQANDPXMJEM-SNVBAGLBSA-N 1 1 328.210 2.888 10 5 EFBEMO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CNCCC1(F)F ZINC000903956057 1313484021 /nfs/dbraw/zinc/48/40/21/1313484021.db2.gz GITUMEUVBHAIDF-TZMCWYRMSA-N 1 1 327.375 2.750 10 5 EFBEMO C[C@@H](CCc1ccccc1[N+](=O)[O-])N[C@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903975303 1313522520 /nfs/dbraw/zinc/52/25/20/1313522520.db2.gz ZOASMQWRWKISJL-DOTOQJQBSA-N 1 1 347.459 2.664 10 5 EFBEMO O=C(NCCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccoc1 ZINC001490364280 1298857679 /nfs/dbraw/zinc/85/76/79/1298857679.db2.gz QJUDIQXTWMVDKA-UHFFFAOYSA-N 1 1 343.383 2.972 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H](c3ccccn3)C2)cc1 ZINC000852084094 1299540219 /nfs/dbraw/zinc/54/02/19/1299540219.db2.gz PYAVKUNSPAZCHX-QAPCUYQASA-N 1 1 327.384 2.903 10 5 EFBEMO O=[N+]([O-])c1c(F)cccc1NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000853796587 1300281785 /nfs/dbraw/zinc/28/17/85/1300281785.db2.gz YXPRAJLTVCMVGQ-OAHLLOKOSA-N 1 1 345.374 2.913 10 5 EFBEMO C[C@@H]([NH2+][C@@H]1CNCC[C@@H]1c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000854222983 1300476182 /nfs/dbraw/zinc/47/61/82/1300476182.db2.gz PZYIUNGRPMFAOF-MZMPZRCHSA-N 1 1 340.427 2.973 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[N@H+](C(C)(C)C)C1 ZINC000855286360 1300888837 /nfs/dbraw/zinc/88/88/37/1300888837.db2.gz PQCUGHOYIDNTJR-BMOGTNHUSA-N 1 1 331.416 2.987 10 5 EFBEMO C/C(=C\C(=O)N[C@H]1CC[N@H+](C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000855286253 1300891137 /nfs/dbraw/zinc/89/11/37/1300891137.db2.gz NPENUJJIOGUECD-FQNOHDAGSA-N 1 1 331.416 2.987 10 5 EFBEMO 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O=C(NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1)c1cccs1 ZINC001268506273 1097045799 /nfs/dbraw/zinc/04/57/99/1097045799.db2.gz FMKVLQKJTRAPRZ-OWOJBTEDSA-N 1 1 337.426 2.794 10 5 EFBEMO O=C(NCC[N@@H+](CC1CCC1)C1CCCCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001269604430 1098285277 /nfs/dbraw/zinc/28/52/77/1098285277.db2.gz BZWRVRRYJDBPIE-IAGOWNOFSA-N 1 1 337.464 2.593 10 5 EFBEMO O=C(NCC[N@H+](CC1CCC1)C1CCCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001269604430 1098285282 /nfs/dbraw/zinc/28/52/82/1098285282.db2.gz BZWRVRRYJDBPIE-IAGOWNOFSA-N 1 1 337.464 2.593 10 5 EFBEMO O=C(NCC[N@@H+](CC1CCC1)C1CCCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001269604430 1098285288 /nfs/dbraw/zinc/28/52/88/1098285288.db2.gz BZWRVRRYJDBPIE-IAGOWNOFSA-N 1 1 337.464 2.593 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC001611391392 1099007122 /nfs/dbraw/zinc/00/71/22/1099007122.db2.gz OBZQVWCCELHXKA-CABCVRRESA-N 1 1 335.379 2.789 10 5 EFBEMO CC(C)[C@@H]1CN(c2nn(C)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC001612611736 1099071187 /nfs/dbraw/zinc/07/11/87/1099071187.db2.gz XVYPPLIHXYETNS-INIZCTEOSA-N 1 1 343.431 2.675 10 5 EFBEMO Nc1[nH+]ccc2c1CN(c1ncc([N+](=O)[O-])cc1C(F)(F)F)CC2 ZINC001613060081 1099089240 /nfs/dbraw/zinc/08/92/40/1099089240.db2.gz FRGCDVVQFKFJOO-UHFFFAOYSA-N 1 1 339.277 2.549 10 5 EFBEMO C/C(=C\C(=O)NCC[N@@H+]1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785266176 1099238129 /nfs/dbraw/zinc/23/81/29/1099238129.db2.gz KMQUUVSKTFRXGA-FQZGENGWSA-N 1 1 331.416 2.846 10 5 EFBEMO CC(C)[N@H+]1CCC[C@@H](C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1 ZINC001617468918 1099241032 /nfs/dbraw/zinc/24/10/32/1099241032.db2.gz ZVIZUHXRYZRCDF-MRXNPFEDSA-N 1 1 333.432 2.716 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc([C@@H]2CCC[N@H+]2C)[nH]n1 ZINC001618150611 1099281517 /nfs/dbraw/zinc/28/15/17/1099281517.db2.gz VBRJXMGSUCSGPU-HNNXBMFYSA-N 1 1 343.387 2.954 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc([C@@H]2CCC[N@@H+]2C)[nH]n1 ZINC001618150611 1099281521 /nfs/dbraw/zinc/28/15/21/1099281521.db2.gz VBRJXMGSUCSGPU-HNNXBMFYSA-N 1 1 343.387 2.954 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCC[C@@H]2c2ncccn2)cc1 ZINC001620549162 1099361533 /nfs/dbraw/zinc/36/15/33/1099361533.db2.gz SNVCMTZVOZQLMI-HZPDHXFCSA-N 1 1 328.372 2.645 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCC[C@@H]2c2ncccn2)cc1 ZINC001620549162 1099361545 /nfs/dbraw/zinc/36/15/45/1099361545.db2.gz SNVCMTZVOZQLMI-HZPDHXFCSA-N 1 1 328.372 2.645 10 5 EFBEMO C[C@H]1CN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C1CCCC1 ZINC001620583483 1099362581 /nfs/dbraw/zinc/36/25/81/1099362581.db2.gz MHLAQIOYBLVARL-KSSFIOAISA-N 1 1 333.432 2.577 10 5 EFBEMO C[C@@]12CSC[C@@H]1C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC001620647045 1099365225 /nfs/dbraw/zinc/36/52/25/1099365225.db2.gz AYUUADHSTLJOIE-BLLLJJGKSA-N 1 1 335.429 2.608 10 5 EFBEMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@]2(CO)CCCC[C@@]2(CO)C1 ZINC001620641401 1099366495 /nfs/dbraw/zinc/36/64/95/1099366495.db2.gz MXIHUWBMCYBNNR-OLMNPRSZSA-N 1 1 334.416 2.503 10 5 EFBEMO Cn1cc([C@@H]2CCC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)nn1 ZINC001620661596 1099368518 /nfs/dbraw/zinc/36/85/18/1099368518.db2.gz HVOYSZUQXKDAKB-GFCCVEGCSA-N 1 1 335.795 2.756 10 5 EFBEMO Cn1cc([C@@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)nn1 ZINC001620661596 1099368531 /nfs/dbraw/zinc/36/85/31/1099368531.db2.gz HVOYSZUQXKDAKB-GFCCVEGCSA-N 1 1 335.795 2.756 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC001625594691 1099830623 /nfs/dbraw/zinc/83/06/23/1099830623.db2.gz PFKZDOXVMCCTHH-YPMHNXCESA-N 1 1 337.395 2.893 10 5 EFBEMO CC(C)[N@@H+](C)CCCNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001629767512 1100244975 /nfs/dbraw/zinc/24/49/75/1100244975.db2.gz BVIAYFZAQHDXFR-UHFFFAOYSA-N 1 1 327.812 2.637 10 5 EFBEMO C[C@H]1CCC[N@@H+](CCNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC001629984066 1100266077 /nfs/dbraw/zinc/26/60/77/1100266077.db2.gz OCVOSXWGRBHEOS-JTQLQIEISA-N 1 1 343.786 2.849 10 5 EFBEMO CC[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 ZINC001630080829 1100273802 /nfs/dbraw/zinc/27/38/02/1100273802.db2.gz HRXPBHFZCIJHFN-MRXNPFEDSA-N 1 1 342.399 2.832 10 5 EFBEMO Cc1cccc(C[N@@H+]2CCCC[C@H]2C(=O)Nc2cc([N+](=O)[O-])n[nH]2)c1 ZINC001634603975 1100618246 /nfs/dbraw/zinc/61/82/46/1100618246.db2.gz IABNSGMAALZRNR-AWEZNQCLSA-N 1 1 343.387 2.620 10 5 EFBEMO Cc1cccc(C[N@H+]2CCCC[C@H]2C(=O)Nc2cc([N+](=O)[O-])n[nH]2)c1 ZINC001634603975 1100618248 /nfs/dbraw/zinc/61/82/48/1100618248.db2.gz IABNSGMAALZRNR-AWEZNQCLSA-N 1 1 343.387 2.620 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cc([C@H]2CCC[N@H+]2C)[nH]n1 ZINC001637069432 1100755621 /nfs/dbraw/zinc/75/56/21/1100755621.db2.gz WCCXQPHXOSSKPQ-OAHLLOKOSA-N 1 1 343.387 2.954 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cc([C@H]2CCC[N@@H+]2C)[nH]n1 ZINC001637069432 1100755628 /nfs/dbraw/zinc/75/56/28/1100755628.db2.gz WCCXQPHXOSSKPQ-OAHLLOKOSA-N 1 1 343.387 2.954 10 5 EFBEMO CC[N@@H+](C)[C@@H]1CCN(C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001637913091 1100817071 /nfs/dbraw/zinc/81/70/71/1100817071.db2.gz UTXYOTBJTLSVGQ-CQSZACIVSA-N 1 1 339.823 2.733 10 5 EFBEMO Cc1[nH]c(C2CCN(C(=O)c3cc([N+](=O)[O-])cnc3C)CC2)[nH+]c1C ZINC001638493037 1100863105 /nfs/dbraw/zinc/86/31/05/1100863105.db2.gz IWNAEZHDXWIPLT-UHFFFAOYSA-N 1 1 343.387 2.658 10 5 EFBEMO Cc1cc(N[C@@H](C)C[N@H+](C)CCC[NH+](C)C)c(F)cc1[N+](=O)[O-] ZINC001640146255 1101017628 /nfs/dbraw/zinc/01/76/28/1101017628.db2.gz LDIXYFGHZCYNJE-ZDUSSCGKSA-N 1 1 326.416 2.726 10 5 EFBEMO Cc1cc(N[C@@H](C)C[N@@H+](C)CCC[NH+](C)C)c(F)cc1[N+](=O)[O-] ZINC001640146255 1101017635 /nfs/dbraw/zinc/01/76/35/1101017635.db2.gz LDIXYFGHZCYNJE-ZDUSSCGKSA-N 1 1 326.416 2.726 10 5 EFBEMO Cc1cc(N[C@@H](C)C[N@H+](C)CCCN(C)C)c(F)cc1[N+](=O)[O-] ZINC001640146255 1101017646 /nfs/dbraw/zinc/01/76/46/1101017646.db2.gz LDIXYFGHZCYNJE-ZDUSSCGKSA-N 1 1 326.416 2.726 10 5 EFBEMO Cc1cc(N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(F)cc1[N+](=O)[O-] ZINC001640146255 1101017652 /nfs/dbraw/zinc/01/76/52/1101017652.db2.gz LDIXYFGHZCYNJE-ZDUSSCGKSA-N 1 1 326.416 2.726 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+](C(C)(C)C)C1 ZINC001640387761 1101040673 /nfs/dbraw/zinc/04/06/73/1101040673.db2.gz VWEXXIBRJKQYQN-GFCCVEGCSA-N 1 1 337.395 2.893 10 5 EFBEMO CCOc1cc(N[C@@H]2CCC[N@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-] ZINC001640396538 1101042106 /nfs/dbraw/zinc/04/21/06/1101042106.db2.gz NOVKITSFLKKNBC-UKRRQHHQSA-N 1 1 337.445 2.985 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCc1cc(N(C)C)cc[nH+]1 ZINC001640416123 1101045061 /nfs/dbraw/zinc/04/50/61/1101045061.db2.gz ZCQHFXOUIPUYON-UHFFFAOYSA-N 1 1 344.371 2.763 10 5 EFBEMO CC(C)[N@@H+](C)CCCNc1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-] ZINC001642053213 1101186115 /nfs/dbraw/zinc/18/61/15/1101186115.db2.gz YVLXATJYRKUCKO-UHFFFAOYSA-N 1 1 347.375 2.615 10 5 EFBEMO COC(=O)c1cc(C(=O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)[nH]1 ZINC001642462433 1101214857 /nfs/dbraw/zinc/21/48/57/1101214857.db2.gz YFBIPNMWLSJMIJ-JTQLQIEISA-N 1 1 345.355 2.551 10 5 EFBEMO CCC[C@]1(CO)CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001642933473 1101257798 /nfs/dbraw/zinc/25/77/98/1101257798.db2.gz FXNRZKIYHSFPQN-QGZVFWFLSA-N 1 1 346.387 2.772 10 5 EFBEMO O=[N+]([O-])c1cnc2ccccc2c1NC[C@H]1CC[N@H+]1C1CCCC1 ZINC001643024536 1101264928 /nfs/dbraw/zinc/26/49/28/1101264928.db2.gz FUXSLIYLFMEDLJ-CQSZACIVSA-N 1 1 326.400 2.994 10 5 EFBEMO O=[N+]([O-])c1cc2c(nc1N[C@@H]1CCC[N@H+]3CCSC[C@H]13)CCCC2 ZINC001643172159 1101276889 /nfs/dbraw/zinc/27/68/89/1101276889.db2.gz GYBULZKEFNYMPV-GDBMZVCRSA-N 1 1 348.472 2.860 10 5 EFBEMO Cn1cc[nH+]c1CCNc1c2cccc(Cl)c2ncc1[N+](=O)[O-] ZINC001651416249 1101325504 /nfs/dbraw/zinc/32/55/04/1101325504.db2.gz ZYJNDTUJEDESSC-UHFFFAOYSA-N 1 1 331.763 2.606 10 5 EFBEMO CC[N@H+]1CCC[C@@H](CNc2c3cc(F)ccc3ncc2[N+](=O)[O-])C1 ZINC001651441040 1101331182 /nfs/dbraw/zinc/33/11/82/1101331182.db2.gz CYZYRUCLLPCFFX-LBPRGKRZSA-N 1 1 332.379 2.848 10 5 EFBEMO C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC[N@H+]1C1CCCC1 ZINC001652233781 1101457310 /nfs/dbraw/zinc/45/73/10/1101457310.db2.gz BKVGKVPRTIIMKN-GFCCVEGCSA-N 1 1 334.376 2.956 10 5 EFBEMO Cn1c[nH+]cc1C1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC001652330146 1101478854 /nfs/dbraw/zinc/47/88/54/1101478854.db2.gz MUEAIILOQBUPEG-UHFFFAOYSA-N 1 1 331.332 2.621 10 5 EFBEMO Cc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[N@H+](C)CC2(C)C)cc1Cl ZINC001652491321 1101499459 /nfs/dbraw/zinc/49/94/59/1101499459.db2.gz IUNSDROLSDWWGP-CYBMUJFWSA-N 1 1 325.796 2.627 10 5 EFBEMO C[N@H+]1C[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C(C)(C)C1 ZINC001652491603 1101499533 /nfs/dbraw/zinc/49/95/33/1101499533.db2.gz MGRPRXCGYYNOBE-LLVKDONJSA-N 1 1 346.214 2.972 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1C[N@@H+](C)CC1(C)C ZINC001652491553 1101500356 /nfs/dbraw/zinc/50/03/56/1101500356.db2.gz LJNVOVJUBVARBK-HOCLYGCPSA-N 1 1 333.432 2.620 10 5 EFBEMO CC[N@H+]1C[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C(C)(C)C1 ZINC001652603583 1101520308 /nfs/dbraw/zinc/52/03/08/1101520308.db2.gz NIVNJMXFMMSFDE-AWEZNQCLSA-N 1 1 330.388 2.536 10 5 EFBEMO C[C@H]1[C@H](CO)CC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001654308608 1101702161 /nfs/dbraw/zinc/70/21/61/1101702161.db2.gz KWUXASNATWWVGF-UWVGGRQHSA-N 1 1 329.194 2.560 10 5 EFBEMO C[C@H]1[C@H](CO)CC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001654308608 1101702168 /nfs/dbraw/zinc/70/21/68/1101702168.db2.gz KWUXASNATWWVGF-UWVGGRQHSA-N 1 1 329.194 2.560 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c1 ZINC001655024914 1101779292 /nfs/dbraw/zinc/77/92/92/1101779292.db2.gz QLPYQFNHHMNXPR-QWHCGFSZSA-N 1 1 335.404 2.914 10 5 EFBEMO O=C(C[N@H+]1CCC[C@@H](C2CCC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001655119296 1101785749 /nfs/dbraw/zinc/78/57/49/1101785749.db2.gz YDRTWDILZHPJLD-MRXNPFEDSA-N 1 1 343.427 2.996 10 5 EFBEMO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)c3nn(C)cc3[N+](=O)[O-])C2)s1 ZINC001655629929 1101862124 /nfs/dbraw/zinc/86/21/24/1101862124.db2.gz OPBRRPOQFWBYSY-ZDUSSCGKSA-N 1 1 349.460 2.657 10 5 EFBEMO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@@H]2Cc2ccc(O)cc2)n1 ZINC001655853707 1101901127 /nfs/dbraw/zinc/90/11/27/1101901127.db2.gz VAZCIBOLVYHLJX-OAHLLOKOSA-N 1 1 330.388 2.594 10 5 EFBEMO CCc1[nH+]ccn1CCNc1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] ZINC001655850543 1101901171 /nfs/dbraw/zinc/90/11/71/1101901171.db2.gz MCUFYBGCOVBQAJ-ALCCZGGFSA-N 1 1 344.371 2.652 10 5 EFBEMO CN(C(=O)C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC001655877213 1101904983 /nfs/dbraw/zinc/90/49/83/1101904983.db2.gz HPKQUNJSMCCMLV-SJORKVTESA-N 1 1 347.415 2.591 10 5 EFBEMO CN(C(=O)C[N@H+]1CCCC[C@@H]1[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC001655877213 1101904989 /nfs/dbraw/zinc/90/49/89/1101904989.db2.gz HPKQUNJSMCCMLV-SJORKVTESA-N 1 1 347.415 2.591 10 5 EFBEMO Nc1[nH+]ccc2c1CN(c1ccc(Br)cc1[N+](=O)[O-])CC2 ZINC001655942288 1101914758 /nfs/dbraw/zinc/91/47/58/1101914758.db2.gz KUJGGUNZASBVNN-UHFFFAOYSA-N 1 1 349.188 2.897 10 5 EFBEMO C[N@H+]1C[C@@H]2CC[C@H](Nc3c4cccc(Cl)c4ncc3[N+](=O)[O-])[C@H]2C1 ZINC001655955455 1101915924 /nfs/dbraw/zinc/91/59/24/1101915924.db2.gz KAUUXHKHDVVSHT-JKOKRWQUSA-N 1 1 346.818 2.970 10 5 EFBEMO Cc1cc(C)c(Cn2c(=O)onc2-c2ccc([N+](=O)[O-])cc2)c(C)[nH+]1 ZINC001656250012 1102016893 /nfs/dbraw/zinc/01/68/93/1102016893.db2.gz REWBRBONLHDVAG-UHFFFAOYSA-N 1 1 340.339 2.780 10 5 EFBEMO Cn1cc(C[N@H+]2CCCC[C@H]2Cc2ccc(O)cc2)c([N+](=O)[O-])n1 ZINC001656470171 1102102581 /nfs/dbraw/zinc/10/25/81/1102102581.db2.gz USNWSSCJTVBNPF-HNNXBMFYSA-N 1 1 330.388 2.631 10 5 EFBEMO C[C@H]1CC[C@@](CO)([NH2+]Cc2cccnc2[N+](=O)[O-])c2ccccc21 ZINC001656512458 1102111586 /nfs/dbraw/zinc/11/15/86/1102111586.db2.gz XFIRACAGPWWCTL-UGSOOPFHSA-N 1 1 327.384 2.865 10 5 EFBEMO C[C@H]1CC[C@](CO)([NH2+]Cc2cccnc2[N+](=O)[O-])c2ccccc21 ZINC001656512457 1102111811 /nfs/dbraw/zinc/11/18/11/1102111811.db2.gz XFIRACAGPWWCTL-SCLBCKFNSA-N 1 1 327.384 2.865 10 5 EFBEMO O=C(CC[N@H+]1CCCC[C@@]12CCOC2)Nc1ccc([N+](=O)[O-])cc1 ZINC001656549824 1102119266 /nfs/dbraw/zinc/11/92/66/1102119266.db2.gz VCJDCCBMAGHNDE-KRWDZBQOSA-N 1 1 333.388 2.568 10 5 EFBEMO O=C(CC[N@H+]1CCCC[C@]12CCOC2)Nc1ccc([N+](=O)[O-])cc1 ZINC001656549825 1102119310 /nfs/dbraw/zinc/11/93/10/1102119310.db2.gz VCJDCCBMAGHNDE-QGZVFWFLSA-N 1 1 333.388 2.568 10 5 EFBEMO C[N@H+]1CCN(Cc2c(Br)cccc2[N+](=O)[O-])CC1(C)C ZINC001658433284 1102460251 /nfs/dbraw/zinc/46/02/51/1102460251.db2.gz JEZCGECUKQUMAB-UHFFFAOYSA-N 1 1 342.237 2.883 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@@H](c3cnccn3)C2)c([N+](=O)[O-])cc1F ZINC001660351643 1102702156 /nfs/dbraw/zinc/70/21/56/1102702156.db2.gz GANWOZRYEOLZFZ-LLVKDONJSA-N 1 1 332.335 2.522 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@@H](c3cnccn3)C2)c([N+](=O)[O-])cc1F ZINC001660351643 1102702165 /nfs/dbraw/zinc/70/21/65/1102702165.db2.gz GANWOZRYEOLZFZ-LLVKDONJSA-N 1 1 332.335 2.522 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccoc1C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001480903954 1102743495 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EFBEMO Cc1ccncc1C(=O)N(C)CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001271984924 1103345876 /nfs/dbraw/zinc/34/58/76/1103345876.db2.gz XPYSRDRWHBOXMG-UHFFFAOYSA-N 1 1 342.399 2.502 10 5 EFBEMO CCc1[nH]ccc1C(=O)N(C)CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001272005703 1103693895 /nfs/dbraw/zinc/69/38/95/1103693895.db2.gz VSLDPWZFPJRCSJ-UHFFFAOYSA-N 1 1 344.415 2.689 10 5 EFBEMO CCc1[nH]ccc1C(=O)N(C)CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001272005703 1103693899 /nfs/dbraw/zinc/69/38/99/1103693899.db2.gz VSLDPWZFPJRCSJ-UHFFFAOYSA-N 1 1 344.415 2.689 10 5 EFBEMO Cc1nsc(C)c1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001663342654 1104062541 /nfs/dbraw/zinc/06/25/41/1104062541.db2.gz RGGJMEMHTALFOL-UHFFFAOYSA-N 1 1 348.428 2.530 10 5 EFBEMO Cc1nsc(C)c1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001663342654 1104062552 /nfs/dbraw/zinc/06/25/52/1104062552.db2.gz RGGJMEMHTALFOL-UHFFFAOYSA-N 1 1 348.428 2.530 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ccc(C)o1)Cc1cccc([N+](=O)[O-])c1 ZINC001663355906 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346.358 2.532 10 5 EFBEMO O=[N+]([O-])c1ccc(OC[C@H](O)C[N@H+]2CCc3ccccc3C2)cc1F ZINC000154189398 1111987494 /nfs/dbraw/zinc/98/74/94/1111987494.db2.gz WLMYOQFZDKLMDO-OAHLLOKOSA-N 1 1 346.358 2.532 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000175012407 529406767 /nfs/dbraw/zinc/40/67/67/529406767.db2.gz CQYDMNWPGZHISQ-TZMCWYRMSA-N 1 1 342.399 2.775 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000174124016 231126312 /nfs/dbraw/zinc/12/63/12/231126312.db2.gz IEYLONSWTVXRTP-YHWZYXNKSA-N 1 1 348.403 2.740 10 5 EFBEMO CN(C)C(=O)C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000174810201 231315417 /nfs/dbraw/zinc/31/54/17/231315417.db2.gz KRQIGNOIMQDCKK-UHFFFAOYSA-N 1 1 325.796 2.548 10 5 EFBEMO CCc1csc([C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)n1 ZINC000174838646 529692641 /nfs/dbraw/zinc/69/26/41/529692641.db2.gz BGVNBJGJMAALDZ-GFCCVEGCSA-N 1 1 335.433 2.690 10 5 EFBEMO Cc1sc(C(=O)N2CCC[C@H]2Cn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000177195391 231823260 /nfs/dbraw/zinc/82/32/60/231823260.db2.gz KLZFHMOJNKAOAY-LBPRGKRZSA-N 1 1 334.401 2.774 10 5 EFBEMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)CC[C@@H]21 ZINC000154178769 530058632 /nfs/dbraw/zinc/05/86/32/530058632.db2.gz UJJMLNCEDCJCSC-PXAZEXFGSA-N 1 1 342.399 2.632 10 5 EFBEMO Cc1nccn1C[C@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000178289829 232126654 /nfs/dbraw/zinc/12/66/54/232126654.db2.gz ZUNPWGVRAODJSQ-MRXNPFEDSA-N 1 1 330.388 2.643 10 5 EFBEMO Cc1nccn1C[C@H]1CCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000178291222 232127322 /nfs/dbraw/zinc/12/73/22/232127322.db2.gz KVPRLUFDAXLQMO-MRXNPFEDSA-N 1 1 330.388 2.643 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cnn4ccccc34)CC2)cc1 ZINC000179534913 233143429 /nfs/dbraw/zinc/14/34/29/233143429.db2.gz AVWXANYXGGVHPT-UHFFFAOYSA-N 1 1 337.383 2.565 10 5 EFBEMO CC[NH+]1CCN(C(=O)c2cc3c(ccc4ccccc43)oc2=O)CC1 ZINC000040803051 213389118 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CAFCQPVPLMXYHE-XQQFMLRXSA-N 1 1 337.445 2.626 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nc(CN3CC[N@H+]4CCCC[C@H]4C3)co2)cc1 ZINC000246012257 243184385 /nfs/dbraw/zinc/18/43/85/243184385.db2.gz ZTMFHDDTQFKDMI-KRWDZBQOSA-N 1 1 342.399 2.920 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000246796442 243320278 /nfs/dbraw/zinc/32/02/78/243320278.db2.gz PHBNQBPSJKOPNO-LSDHHAIUSA-N 1 1 348.447 2.646 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N2CC[N@H+]3CCCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000246940642 243336551 /nfs/dbraw/zinc/33/65/51/243336551.db2.gz HMQQBLBIRRUDHL-HOCLYGCPSA-N 1 1 346.431 2.844 10 5 EFBEMO Cn1ccnc1[C@H]([NH2+][C@@H]1CCC[C@H](CO)C1)c1ccc([N+](=O)[O-])cc1 ZINC000414337156 244094528 /nfs/dbraw/zinc/09/45/28/244094528.db2.gz KNWHNNKJXPKEPC-YSVLISHTSA-N 1 1 344.415 2.558 10 5 EFBEMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000419002668 245328015 /nfs/dbraw/zinc/32/80/15/245328015.db2.gz MMVLGXIESTVEPG-QWRGUYRKSA-N 1 1 347.337 2.505 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@H](O)CC34CCC4)n2)c1 ZINC000420995622 245791771 /nfs/dbraw/zinc/79/17/71/245791771.db2.gz PJIXQHFIRASLBW-AWEZNQCLSA-N 1 1 344.371 2.524 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@H](O)CC34CCC4)n2)c1 ZINC000420995622 245791775 /nfs/dbraw/zinc/79/17/75/245791775.db2.gz PJIXQHFIRASLBW-AWEZNQCLSA-N 1 1 344.371 2.524 10 5 EFBEMO CC[C@H](NC(=O)N(C)C[C@@H]1CCC[N@H+]1C)c1cccc([N+](=O)[O-])c1 ZINC000422194308 246294206 /nfs/dbraw/zinc/29/42/06/246294206.db2.gz YQHMWZWZROQSBT-HOTGVXAUSA-N 1 1 334.420 2.782 10 5 EFBEMO C[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000425407401 247072695 /nfs/dbraw/zinc/07/26/95/247072695.db2.gz PBFLGXQBLBTRNK-GFCCVEGCSA-N 1 1 329.194 2.968 10 5 EFBEMO C[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000425407401 247072700 /nfs/dbraw/zinc/07/27/00/247072700.db2.gz PBFLGXQBLBTRNK-GFCCVEGCSA-N 1 1 329.194 2.968 10 5 EFBEMO COC(=O)COc1ccc(C[N@@H+]2CC(C)=C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000430877233 247844531 /nfs/dbraw/zinc/84/45/31/247844531.db2.gz WAHSIUYSBPULST-LBPRGKRZSA-N 1 1 334.372 2.545 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CCCC[N@H+]2C2CC2)c1 ZINC000433816919 248092140 /nfs/dbraw/zinc/09/21/40/248092140.db2.gz AUOCNHWCVISRNM-CQSZACIVSA-N 1 1 333.388 2.810 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441198694 250007490 /nfs/dbraw/zinc/00/74/90/250007490.db2.gz NNGAXRSRHLKXIM-LSDHHAIUSA-N 1 1 347.415 2.590 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)cc1 ZINC000449418553 251018188 /nfs/dbraw/zinc/01/81/88/251018188.db2.gz DHGISENWFIERJP-ROUUACIJSA-N 1 1 330.359 2.895 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)cc1 ZINC000449418553 251018194 /nfs/dbraw/zinc/01/81/94/251018194.db2.gz DHGISENWFIERJP-ROUUACIJSA-N 1 1 330.359 2.895 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](O)C[C@H]2[C@H]2CCCOC2)c(Cl)c1 ZINC000449433464 251026540 /nfs/dbraw/zinc/02/65/40/251026540.db2.gz MMRDQTUJSUSZSN-BJJXKVORSA-N 1 1 340.807 2.610 10 5 EFBEMO COc1nccnc1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449503170 251046048 /nfs/dbraw/zinc/04/60/48/251046048.db2.gz SYUOEGNIABYWLX-CQSZACIVSA-N 1 1 328.372 2.773 10 5 EFBEMO COc1nccnc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449503170 251046049 /nfs/dbraw/zinc/04/60/49/251046049.db2.gz SYUOEGNIABYWLX-CQSZACIVSA-N 1 1 328.372 2.773 10 5 EFBEMO C[C@@H]1OCC[C@H]1[N@@H+](CCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000449676092 251113619 /nfs/dbraw/zinc/11/36/19/251113619.db2.gz FBUAAJAQOURHEB-SUMWQHHRSA-N 1 1 346.383 2.827 10 5 EFBEMO C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000449679065 251113638 /nfs/dbraw/zinc/11/36/38/251113638.db2.gz QULGHDCWCNCCCC-CJNGLKHVSA-N 1 1 346.383 2.827 10 5 EFBEMO COC[C@H]1CCC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000449776933 251152099 /nfs/dbraw/zinc/15/20/99/251152099.db2.gz PIDQNTXPRGNPCQ-ZDUSSCGKSA-N 1 1 338.404 2.861 10 5 EFBEMO COCC[N@H+]1CCC[C@@H]1CNc1nccc2c1cccc2[N+](=O)[O-] ZINC000450310603 251339678 /nfs/dbraw/zinc/33/96/78/251339678.db2.gz XNNDILFJBLGYMN-CYBMUJFWSA-N 1 1 330.388 2.666 10 5 EFBEMO C[C@H](N=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000450436883 251386124 /nfs/dbraw/zinc/38/61/24/251386124.db2.gz RVCFPJTWAFGTCU-STQMWFEESA-N 1 1 343.431 2.958 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@@H](CC(C)(C)C(N)=O)C2)ccc1[N+](=O)[O-] ZINC000451220378 251480831 /nfs/dbraw/zinc/48/08/31/251480831.db2.gz VOXQKZKCUZQQAV-AWEZNQCLSA-N 1 1 349.431 2.717 10 5 EFBEMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H](c3nncn3C3CC3)C2)cc1 ZINC000152496589 223974985 /nfs/dbraw/zinc/97/49/85/223974985.db2.gz ZTXFZOAJWZHBAY-HNNXBMFYSA-N 1 1 341.415 2.943 10 5 EFBEMO COC[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000452110130 251790545 /nfs/dbraw/zinc/79/05/45/251790545.db2.gz YCVHPFOXYYTMMD-AWEZNQCLSA-N 1 1 335.404 2.672 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](Cn3cncn3)C2)ccc1Cl ZINC000153884604 224170842 /nfs/dbraw/zinc/17/08/42/224170842.db2.gz WWQZEXILWABCPX-CYBMUJFWSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](Cn3cncn3)C2)ccc1Cl ZINC000153884604 224170845 /nfs/dbraw/zinc/17/08/45/224170845.db2.gz WWQZEXILWABCPX-CYBMUJFWSA-N 1 1 335.795 2.752 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000174122727 533224670 /nfs/dbraw/zinc/22/46/70/533224670.db2.gz UVYSJHDEOMVZKN-VXGBXAGGSA-N 1 1 336.392 2.550 10 5 EFBEMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)C[C@@H]1CCCO1 ZINC000187833016 533314286 /nfs/dbraw/zinc/31/42/86/533314286.db2.gz CHQDKOOZVVXUGV-JQWIXIFHSA-N 1 1 341.795 2.686 10 5 EFBEMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@@H]1CCCO1 ZINC000187833016 533314289 /nfs/dbraw/zinc/31/42/89/533314289.db2.gz CHQDKOOZVVXUGV-JQWIXIFHSA-N 1 1 341.795 2.686 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN(Cc2cnn(C)c2)CC1 ZINC000105869502 141356107 /nfs/dbraw/zinc/35/61/07/141356107.db2.gz VLJITANVFOHIJG-OAHLLOKOSA-N 1 1 343.431 2.597 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[N@H+](Cc2cnn(C)c2)CC1 ZINC000105869502 141356108 /nfs/dbraw/zinc/35/61/08/141356108.db2.gz VLJITANVFOHIJG-OAHLLOKOSA-N 1 1 343.431 2.597 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[N@@H+](Cc2cnn(C)c2)CC1 ZINC000105869502 141356109 /nfs/dbraw/zinc/35/61/09/141356109.db2.gz VLJITANVFOHIJG-OAHLLOKOSA-N 1 1 343.431 2.597 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCCOCc1ccccc1)CC2 ZINC000347783941 142271639 /nfs/dbraw/zinc/27/16/39/142271639.db2.gz KQHPLSSBKWVPTH-UHFFFAOYSA-N 1 1 327.384 2.955 10 5 EFBEMO C[C@@H](C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000347843171 142280942 /nfs/dbraw/zinc/28/09/42/142280942.db2.gz JGOYOVXUMBHEGG-RISCZKNCSA-N 1 1 335.379 2.533 10 5 EFBEMO C[C@H](C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000347843170 142281022 /nfs/dbraw/zinc/28/10/22/142281022.db2.gz JGOYOVXUMBHEGG-FZMZJTMJSA-N 1 1 335.379 2.533 10 5 EFBEMO Cc1cnc(N2CC[NH+](Cc3ccc([N+](=O)[O-])cc3C)CC2)s1 ZINC000349976169 142386320 /nfs/dbraw/zinc/38/63/20/142386320.db2.gz PAESGLLMJHFNEF-UHFFFAOYSA-N 1 1 332.429 2.990 10 5 EFBEMO CCCCNC(=O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000352400661 142480817 /nfs/dbraw/zinc/48/08/17/142480817.db2.gz SLNVQQKDDIRKNU-HNNXBMFYSA-N 1 1 349.431 2.732 10 5 EFBEMO C[C@@H]1CC[C@@]2(CC[N@@H+](C[C@H](O)COc3ccccc3[N+](=O)[O-])C2)C1 ZINC000343763553 145288495 /nfs/dbraw/zinc/28/84/95/145288495.db2.gz VWSFRCBBZWQROA-RVKKMQEKSA-N 1 1 334.416 2.847 10 5 EFBEMO COC(=O)c1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)nc1C1CC1 ZINC000349132558 146057408 /nfs/dbraw/zinc/05/74/08/146057408.db2.gz RVDKTRVQOSTCHG-UHFFFAOYSA-N 1 1 341.367 2.944 10 5 EFBEMO COc1cc(C[NH+]2CCN(c3ccc(O)cc3)CC2)ccc1[N+](=O)[O-] ZINC000351971542 146251793 /nfs/dbraw/zinc/25/17/93/146251793.db2.gz UBHNDHGOYKKNJI-UHFFFAOYSA-N 1 1 343.383 2.631 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2C[C@@H](C)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000355730842 147047159 /nfs/dbraw/zinc/04/71/59/147047159.db2.gz PKQIXOOWHFEIOA-QWHCGFSZSA-N 1 1 336.388 2.767 10 5 EFBEMO C[C@@H]1C[C@H](C)[C@H](C)[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000355738100 147048995 /nfs/dbraw/zinc/04/89/95/147048995.db2.gz HHBFGSYWWZNQOX-RDBSUJKOSA-N 1 1 340.445 2.735 10 5 EFBEMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000355738100 147048997 /nfs/dbraw/zinc/04/89/97/147048997.db2.gz HHBFGSYWWZNQOX-RDBSUJKOSA-N 1 1 340.445 2.735 10 5 EFBEMO C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000355791892 147064867 /nfs/dbraw/zinc/06/48/67/147064867.db2.gz XYTFJAUZVKAGKX-UTUOFQBUSA-N 1 1 349.387 2.628 10 5 EFBEMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000355791892 147064868 /nfs/dbraw/zinc/06/48/68/147064868.db2.gz XYTFJAUZVKAGKX-UTUOFQBUSA-N 1 1 349.387 2.628 10 5 EFBEMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000359779050 148186872 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344.415 2.543 10 5 EFBEMO C[C@@H]1C[C@H](N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123118025 222219217 /nfs/dbraw/zinc/21/92/17/222219217.db2.gz FTSYRLGCEOWADK-IUODEOHRSA-N 1 1 346.431 2.724 10 5 EFBEMO O=[N+]([O-])c1cccc(F)c1OC[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000184775747 265027192 /nfs/dbraw/zinc/02/71/92/265027192.db2.gz GHNKNESLCPMPRE-OAHLLOKOSA-N 1 1 346.358 2.532 10 5 EFBEMO CC[N@H+]1CCC[C@H](NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000194633875 265378934 /nfs/dbraw/zinc/37/89/34/265378934.db2.gz ZTQDWMYAAHPSBU-OLZOCXBDSA-N 1 1 337.445 2.676 10 5 EFBEMO C[C@H](c1nc(Cc2ccc([N+](=O)[O-])cn2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000276924164 267077872 /nfs/dbraw/zinc/07/78/72/267077872.db2.gz NAHRYYBOHQNYIC-GRYCIOLGSA-N 1 1 331.376 2.897 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000277908995 267296374 /nfs/dbraw/zinc/29/63/74/267296374.db2.gz DGODJGZNCDOAOK-NSHDSACASA-N 1 1 337.807 2.771 10 5 EFBEMO 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ZINC000190447957 473277134 /nfs/dbraw/zinc/27/71/34/473277134.db2.gz DTBUAHGYXQZCFE-MRXNPFEDSA-N 1 1 341.415 2.652 10 5 EFBEMO C[N@H+](Cc1cccnc1)C[C@H]1CCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000190483564 473290754 /nfs/dbraw/zinc/29/07/54/473290754.db2.gz JDJFGBBIKGFJCQ-GOSISDBHSA-N 1 1 340.427 2.944 10 5 EFBEMO CN(Cc1cccnc1)C[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000190483564 473290762 /nfs/dbraw/zinc/29/07/62/473290762.db2.gz JDJFGBBIKGFJCQ-GOSISDBHSA-N 1 1 340.427 2.944 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000177036921 473291155 /nfs/dbraw/zinc/29/11/55/473291155.db2.gz CJKDDEIBKCKGRK-GFCCVEGCSA-N 1 1 337.445 2.873 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000177033073 473291585 /nfs/dbraw/zinc/29/15/85/473291585.db2.gz ISBYVYPSUARMDB-CYBMUJFWSA-N 1 1 330.388 2.632 10 5 EFBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1C ZINC000177207291 473332526 /nfs/dbraw/zinc/33/25/26/473332526.db2.gz ORNPGSRZVIDHNE-HNNXBMFYSA-N 1 1 328.372 2.713 10 5 EFBEMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000113197901 473364823 /nfs/dbraw/zinc/36/48/23/473364823.db2.gz JCFYWZVXVOLQCM-GFCCVEGCSA-N 1 1 325.434 2.959 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000177496807 473390099 /nfs/dbraw/zinc/39/00/99/473390099.db2.gz REDNAJYMMKOGTM-LSDHHAIUSA-N 1 1 332.404 2.994 10 5 EFBEMO CC1(C)CCC[C@@H]1[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000592153588 478800518 /nfs/dbraw/zinc/80/05/18/478800518.db2.gz HCPIGNRPOBOKPI-GOEBONIOSA-N 1 1 333.432 2.905 10 5 EFBEMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000619867566 479898841 /nfs/dbraw/zinc/89/88/41/479898841.db2.gz WHUZYUIKRQPETN-GFCCVEGCSA-N 1 1 330.388 2.632 10 5 EFBEMO Cn1cnc([N+](=O)[O-])c1NC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000067384736 472027392 /nfs/dbraw/zinc/02/73/92/472027392.db2.gz ODMMEPULXGRAAC-OAHLLOKOSA-N 1 1 329.404 2.795 10 5 EFBEMO CCCCNC(=O)C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000054174779 472065175 /nfs/dbraw/zinc/06/51/75/472065175.db2.gz NEVKIWMIDWLDMX-UHFFFAOYSA-N 1 1 325.434 2.785 10 5 EFBEMO Cc1sc(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000069035914 472280110 /nfs/dbraw/zinc/28/01/10/472280110.db2.gz JSZFABAZBWMBJE-GFCCVEGCSA-N 1 1 325.434 2.815 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000154569406 472447629 /nfs/dbraw/zinc/44/76/29/472447629.db2.gz RLMBHEMDQHCCAJ-ZDUSSCGKSA-N 1 1 342.399 2.699 10 5 EFBEMO C[C@H]1CCC[N@H+]1C1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1 ZINC000154926516 472487038 /nfs/dbraw/zinc/48/70/38/472487038.db2.gz KXVYGCSSCVWVPK-NSHDSACASA-N 1 1 335.433 2.757 10 5 EFBEMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089901322 472540907 /nfs/dbraw/zinc/54/09/07/472540907.db2.gz QVBVILFWDRCIQJ-CXAGYDPISA-N 1 1 342.399 2.918 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)c1 ZINC000155614650 472581081 /nfs/dbraw/zinc/58/10/81/472581081.db2.gz OGNYNRNUALONIR-FZMZJTMJSA-N 1 1 337.445 2.775 10 5 EFBEMO Cc1cccc(N2CCN(C(=O)c3csc([N+](=O)[O-])c3)[C@@H](C)C2)[nH+]1 ZINC000071908097 472613584 /nfs/dbraw/zinc/61/35/84/472613584.db2.gz AKYQOXYMJMZDJT-LBPRGKRZSA-N 1 1 346.412 2.711 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[NH+]2CCN(c3ccc(F)cc3)CC2)c1 ZINC000058933366 472613703 /nfs/dbraw/zinc/61/37/03/472613703.db2.gz GTFXOZIYQBYKOY-UHFFFAOYSA-N 1 1 345.374 2.935 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000090517877 472628270 /nfs/dbraw/zinc/62/82/70/472628270.db2.gz YFWHOOWWXKBLBA-INIZCTEOSA-N 1 1 345.374 2.603 10 5 EFBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NCCCC[N@@H+]1CCCC[C@H]1C ZINC000046989657 472636930 /nfs/dbraw/zinc/63/69/30/472636930.db2.gz FGCRMLNUKLPDFW-CYBMUJFWSA-N 1 1 334.420 2.683 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000047145282 472661548 /nfs/dbraw/zinc/66/15/48/472661548.db2.gz GTVGBHULUYNHEX-ZDUSSCGKSA-N 1 1 346.431 2.773 10 5 EFBEMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CCOCC1 ZINC000156122121 472667943 /nfs/dbraw/zinc/66/79/43/472667943.db2.gz ASMBCPXOJXLGOY-UHFFFAOYSA-N 1 1 332.360 2.503 10 5 EFBEMO COc1cc(C[NH2+]Cc2ccccc2[N+](=O)[O-])cc(OC)c1OC ZINC000061030671 472689558 /nfs/dbraw/zinc/68/95/58/472689558.db2.gz WGYKPMVYAFJBRV-UHFFFAOYSA-N 1 1 332.356 2.910 10 5 EFBEMO CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000105851251 472787838 /nfs/dbraw/zinc/78/78/38/472787838.db2.gz LWQNJIPNFRBGFO-HNNXBMFYSA-N 1 1 328.372 2.831 10 5 EFBEMO COc1ccc(C[N@@H+]2CCC[C@@H](n3cc(C)cn3)C2)cc1[N+](=O)[O-] ZINC000105901398 472804086 /nfs/dbraw/zinc/80/40/86/472804086.db2.gz AMFIMWJQBWDTHR-OAHLLOKOSA-N 1 1 330.388 2.945 10 5 EFBEMO COc1ccc(C[N@H+]2CCC[C@@H](n3cc(C)cn3)C2)cc1[N+](=O)[O-] ZINC000105901398 472804091 /nfs/dbraw/zinc/80/40/91/472804091.db2.gz AMFIMWJQBWDTHR-OAHLLOKOSA-N 1 1 330.388 2.945 10 5 EFBEMO Cc1ccc(CN2CCC([N@@H+]3CCO[C@H](C)C3)CC2)cc1[N+](=O)[O-] ZINC000092079177 472854181 /nfs/dbraw/zinc/85/41/81/472854181.db2.gz GJKBFJZFILRQTP-OAHLLOKOSA-N 1 1 333.432 2.588 10 5 EFBEMO Cc1ccc(C[NH+]2CCC(N3CCO[C@H](C)C3)CC2)cc1[N+](=O)[O-] ZINC000092079177 472854190 /nfs/dbraw/zinc/85/41/90/472854190.db2.gz GJKBFJZFILRQTP-OAHLLOKOSA-N 1 1 333.432 2.588 10 5 EFBEMO CCC[C@@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000121894538 472938720 /nfs/dbraw/zinc/93/87/20/472938720.db2.gz VXVAPDLUVPANBY-CQSZACIVSA-N 1 1 327.450 2.589 10 5 EFBEMO COc1cc(C[NH+]2CCC(c3cc[nH]n3)CC2)c([N+](=O)[O-])cc1OC ZINC000092810822 472988565 /nfs/dbraw/zinc/98/85/65/472988565.db2.gz QUJYLVOSWRAWJY-UHFFFAOYSA-N 1 1 346.387 2.715 10 5 EFBEMO COc1cc(N[C@@H]2CC[N@@H+](C[C@@H]3CCCO3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000108088418 473000808 /nfs/dbraw/zinc/00/08/08/473000808.db2.gz MQMACDRHCXUVHG-CWRNSKLLSA-N 1 1 349.431 2.905 10 5 EFBEMO C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000159613697 473044693 /nfs/dbraw/zinc/04/46/93/473044693.db2.gz LLAXYIBNIBJQEV-TZMCWYRMSA-N 1 1 343.383 2.941 10 5 EFBEMO CC(C)[N@H+](CCc1nccs1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000159824636 473063820 /nfs/dbraw/zinc/06/38/20/473063820.db2.gz GVGMMYZDTRDXES-UHFFFAOYSA-N 1 1 348.428 2.943 10 5 EFBEMO CC(C)[N@@H+](CCc1nccs1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000159824636 473063828 /nfs/dbraw/zinc/06/38/28/473063828.db2.gz GVGMMYZDTRDXES-UHFFFAOYSA-N 1 1 348.428 2.943 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)CC12CCCCC2 ZINC000080940776 473107683 /nfs/dbraw/zinc/10/76/83/473107683.db2.gz DWCCKZFGDSHPJU-UHFFFAOYSA-N 1 1 331.416 2.994 10 5 EFBEMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000160464091 473128670 /nfs/dbraw/zinc/12/86/70/473128670.db2.gz AZEGPVOCSCSCTD-QGZVFWFLSA-N 1 1 333.432 2.764 10 5 EFBEMO CCc1ccc(NC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)cc1[N+](=O)[O-] ZINC000081057396 473138386 /nfs/dbraw/zinc/13/83/86/473138386.db2.gz RBSDDPLNRRUGLR-CABCVRRESA-N 1 1 332.404 2.858 10 5 EFBEMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123464487 473143486 /nfs/dbraw/zinc/14/34/86/473143486.db2.gz APKLWHRINAJVCI-MFKMUULPSA-N 1 1 325.796 2.803 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177507763 473392385 /nfs/dbraw/zinc/39/23/85/473392385.db2.gz VVYHOZTVBZWXTM-ZIAGYGMSSA-N 1 1 332.404 2.994 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177706639 473420470 /nfs/dbraw/zinc/42/04/70/473420470.db2.gz USRKBEHFKYTOQG-GJZGRUSLSA-N 1 1 348.447 2.646 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177708834 473421880 /nfs/dbraw/zinc/42/18/80/473421880.db2.gz FDVVUPDDAGAGQV-HNNXBMFYSA-N 1 1 348.447 2.648 10 5 EFBEMO CCN1CCC[C@H]1C[N@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177708834 473421883 /nfs/dbraw/zinc/42/18/83/473421883.db2.gz FDVVUPDDAGAGQV-HNNXBMFYSA-N 1 1 348.447 2.648 10 5 EFBEMO CCN1CCC[C@H]1C[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177708834 473421886 /nfs/dbraw/zinc/42/18/86/473421886.db2.gz FDVVUPDDAGAGQV-HNNXBMFYSA-N 1 1 348.447 2.648 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177708817 473422465 /nfs/dbraw/zinc/42/24/65/473422465.db2.gz FDVVUPDDAGAGQV-OAHLLOKOSA-N 1 1 348.447 2.648 10 5 EFBEMO CCN1CCC[C@@H]1C[N@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177708817 473422467 /nfs/dbraw/zinc/42/24/67/473422467.db2.gz FDVVUPDDAGAGQV-OAHLLOKOSA-N 1 1 348.447 2.648 10 5 EFBEMO CCN1CCC[C@@H]1C[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177708817 473422474 /nfs/dbraw/zinc/42/24/74/473422474.db2.gz FDVVUPDDAGAGQV-OAHLLOKOSA-N 1 1 348.447 2.648 10 5 EFBEMO CC[N@@H+]1CCC[C@H](Nc2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000165733482 473515724 /nfs/dbraw/zinc/51/57/24/473515724.db2.gz SPQQDUXSBHVKIE-JTQLQIEISA-N 1 1 343.225 2.957 10 5 EFBEMO CC[N@H+]1CCC[C@H](Nc2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000165733482 473515728 /nfs/dbraw/zinc/51/57/28/473515728.db2.gz SPQQDUXSBHVKIE-JTQLQIEISA-N 1 1 343.225 2.957 10 5 EFBEMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000152328095 473549077 /nfs/dbraw/zinc/54/90/77/473549077.db2.gz XNYQXIVSNAOKST-OAHLLOKOSA-N 1 1 334.420 2.514 10 5 EFBEMO COC(=O)C[C@](C)([NH2+]Cc1ccc([N+](=O)[O-])cc1C)c1ccncc1 ZINC000191906185 473588742 /nfs/dbraw/zinc/58/87/42/473588742.db2.gz WTCOGCYIHAECDC-SFHVURJKSA-N 1 1 343.383 2.866 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)CSc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000127664164 473638488 /nfs/dbraw/zinc/63/84/88/473638488.db2.gz HEQRWHOJUWUJIL-STQMWFEESA-N 1 1 337.445 2.628 10 5 EFBEMO CCOCC[N@H+]1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000116278053 473645523 /nfs/dbraw/zinc/64/55/23/473645523.db2.gz KFTPNEROSYLHPW-ZDUSSCGKSA-N 1 1 341.839 2.791 10 5 EFBEMO C[C@H]1C[C@H](N(C)C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000127806659 473652231 /nfs/dbraw/zinc/65/22/31/473652231.db2.gz OWTFCZKTQGKHTB-CMPLNLGQSA-N 1 1 325.796 2.803 10 5 EFBEMO Cc1ccc(OC[C@@H](O)C[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000154061536 473664067 /nfs/dbraw/zinc/66/40/67/473664067.db2.gz JONUWZSOYHIITG-KRWDZBQOSA-N 1 1 342.395 2.701 10 5 EFBEMO COC(=O)c1cc(C)nc(NC[C@@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-] ZINC000287610049 473711218 /nfs/dbraw/zinc/71/12/18/473711218.db2.gz GACXKZHOZJIELC-ZDUSSCGKSA-N 1 1 348.403 2.514 10 5 EFBEMO Cn1nccc1[C@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000281479493 473734293 /nfs/dbraw/zinc/73/42/93/473734293.db2.gz SFNUTDOUYZBJEL-IAGOWNOFSA-N 1 1 330.388 2.589 10 5 EFBEMO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000281495159 473740086 /nfs/dbraw/zinc/74/00/86/473740086.db2.gz UBPZKKHIEYDGRP-WHUJPVCOSA-N 1 1 348.443 2.890 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2csc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000180157499 473812954 /nfs/dbraw/zinc/81/29/54/473812954.db2.gz KOMWSVIVRMOUJY-ZFWWWQNUSA-N 1 1 331.397 2.832 10 5 EFBEMO C[C@@H]1CN(C(=O)c2cc3ccccc3c3cccnc23)CC[N@@H+]1CCO ZINC000187257297 473847706 /nfs/dbraw/zinc/84/77/06/473847706.db2.gz CHFZPOICUODTDK-OAHLLOKOSA-N 1 1 349.434 2.527 10 5 EFBEMO C[C@@H]1CN(C(=O)c2cc3ccccc3c3cccnc23)CC[N@H+]1CCO ZINC000187257297 473847714 /nfs/dbraw/zinc/84/77/14/473847714.db2.gz CHFZPOICUODTDK-OAHLLOKOSA-N 1 1 349.434 2.527 10 5 EFBEMO Cc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)n1 ZINC000187262300 473848205 /nfs/dbraw/zinc/84/82/05/473848205.db2.gz HTLNIWMOERPJMV-OAHLLOKOSA-N 1 1 327.388 2.688 10 5 EFBEMO CCc1[nH+]ccn1[C@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000173572209 473880983 /nfs/dbraw/zinc/88/09/83/473880983.db2.gz GDZJVCDEQKSNDL-INIZCTEOSA-N 1 1 342.399 2.760 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000246558350 473900450 /nfs/dbraw/zinc/90/04/50/473900450.db2.gz LRVSDNNCTDAHRQ-OLZOCXBDSA-N 1 1 337.807 2.947 10 5 EFBEMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000246716983 473940870 /nfs/dbraw/zinc/94/08/70/473940870.db2.gz XJDIDEVFIJGYAJ-FZMZJTMJSA-N 1 1 337.807 2.805 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2COc3ccccc3[C@@H]2O)c1 ZINC000288459987 473948905 /nfs/dbraw/zinc/94/89/05/473948905.db2.gz DTSBGIVNJUDVRW-ZBFHGGJFSA-N 1 1 334.759 2.832 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H]2CN2CCOCC2)c1 ZINC000174013121 473972318 /nfs/dbraw/zinc/97/23/18/473972318.db2.gz BZXAJDAVPMCMEL-OAHLLOKOSA-N 1 1 339.823 2.545 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H]2CN2CCOCC2)c1 ZINC000174013121 473972327 /nfs/dbraw/zinc/97/23/27/473972327.db2.gz BZXAJDAVPMCMEL-OAHLLOKOSA-N 1 1 339.823 2.545 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000246844001 473981496 /nfs/dbraw/zinc/98/14/96/473981496.db2.gz FDHLZTJTCKRDQY-IUODEOHRSA-N 1 1 337.445 2.532 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000246905623 473999766 /nfs/dbraw/zinc/99/97/66/473999766.db2.gz HVQLIONIBKLLMG-AAEUAGOBSA-N 1 1 337.807 2.947 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000246945581 474012177 /nfs/dbraw/zinc/01/21/77/474012177.db2.gz LEUXXGGPDVAYEI-KGLIPLIRSA-N 1 1 337.807 2.947 10 5 EFBEMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@H]2c2ccco2)c1 ZINC000247041994 474045703 /nfs/dbraw/zinc/04/57/03/474045703.db2.gz OACJUTGXBPTWQA-HOCLYGCPSA-N 1 1 332.356 2.765 10 5 EFBEMO CC[N@H+]1CC[C@H](CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000247157953 474076901 /nfs/dbraw/zinc/07/69/01/474076901.db2.gz NXDXQGXDHQDOMM-QWHCGFSZSA-N 1 1 337.445 2.533 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@H](C)C1 ZINC000174779400 474095255 /nfs/dbraw/zinc/09/52/55/474095255.db2.gz QNEKLPRETOXPBT-PBHICJAKSA-N 1 1 348.447 2.504 10 5 EFBEMO CCn1c(C)nc([N+](=O)[O-])c1N(C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000288943635 474097538 /nfs/dbraw/zinc/09/75/38/474097538.db2.gz RTDJMNTWHOWLTG-INIZCTEOSA-N 1 1 343.431 2.830 10 5 EFBEMO COc1ccc([C@@H]2C[C@@H](C)[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000174869576 474109666 /nfs/dbraw/zinc/10/96/66/474109666.db2.gz 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CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000174960300 474122801 /nfs/dbraw/zinc/12/28/01/474122801.db2.gz LEUXXGGPDVAYEI-UONOGXRCSA-N 1 1 337.807 2.947 10 5 EFBEMO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)o1 ZINC000182588482 474212488 /nfs/dbraw/zinc/21/24/88/474212488.db2.gz UXDVHXIHNCKQLB-IUODEOHRSA-N 1 1 329.356 2.952 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000247982161 474238738 /nfs/dbraw/zinc/23/87/38/474238738.db2.gz HSOQJKBVQAUOHL-IEBWSBKVSA-N 1 1 339.395 2.699 10 5 EFBEMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@]3(O)CCCC[C@H]3C2)cc1 ZINC000247994778 474241984 /nfs/dbraw/zinc/24/19/84/474241984.db2.gz JURNTKDXBWKOMS-MAUKXSAKSA-N 1 1 334.416 2.991 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000248043187 474250217 /nfs/dbraw/zinc/25/02/17/474250217.db2.gz MKHXACAEXBAECP-IAGOWNOFSA-N 1 1 325.368 2.770 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000275900708 474356420 /nfs/dbraw/zinc/35/64/20/474356420.db2.gz UCKFPOXRVVZFHU-OLZOCXBDSA-N 1 1 337.807 2.865 10 5 EFBEMO CC[C@@H](NC(=O)NCC[N@@H+](CC)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000176083339 474379226 /nfs/dbraw/zinc/37/92/26/474379226.db2.gz RPFFXUAPYDSVPC-MRXNPFEDSA-N 1 1 334.420 2.829 10 5 EFBEMO Cc1cc(C)cc([C@H]2CC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C2)c1 ZINC000183465145 474381994 /nfs/dbraw/zinc/38/19/94/474381994.db2.gz ZLOMXLIETQFFPG-INIZCTEOSA-N 1 1 341.411 2.863 10 5 EFBEMO CC[C@@H](NC(=O)NC[C@H]1CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000176174343 474401235 /nfs/dbraw/zinc/40/12/35/474401235.db2.gz CYICFDIPQFUSAT-CZUORRHYSA-N 1 1 334.420 2.687 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCCN(c3ccccn3)CC2)c1 ZINC000183773263 474427720 /nfs/dbraw/zinc/42/77/20/474427720.db2.gz PTNJSVWGAXKZBO-UHFFFAOYSA-N 1 1 342.399 2.581 10 5 EFBEMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCCN(c3ccccn3)CC2)cc1 ZINC000183825179 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WAZAMCLUFPZENS-OAHLLOKOSA-N 1 1 349.431 2.762 10 5 EFBEMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1C[C@@H]2CCC[N@@H+]2C[C@H]1C ZINC000249138023 474536630 /nfs/dbraw/zinc/53/66/30/474536630.db2.gz VTQDDVNPIHWRLH-KGLIPLIRSA-N 1 1 332.404 2.912 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000249261302 474549854 /nfs/dbraw/zinc/54/98/54/474549854.db2.gz HSBXFNWFDPVRGM-OCCSQVGLSA-N 1 1 348.403 2.694 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000249654830 474602098 /nfs/dbraw/zinc/60/20/98/474602098.db2.gz VAPDSYRMUPCGBL-WFASDCNBSA-N 1 1 349.431 2.714 10 5 EFBEMO CC(C)[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CCOC1 ZINC000291771308 474679225 /nfs/dbraw/zinc/67/92/25/474679225.db2.gz LSGXGBQDEHWCPQ-AWEZNQCLSA-N 1 1 332.360 2.644 10 5 EFBEMO CC(C)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CCOC1 ZINC000291771308 474679235 /nfs/dbraw/zinc/67/92/35/474679235.db2.gz LSGXGBQDEHWCPQ-AWEZNQCLSA-N 1 1 332.360 2.644 10 5 EFBEMO COc1ccc(C[N@@H+](C)[C@H]2Cc3ccccc3[C@H]2O)cc1[N+](=O)[O-] ZINC000252512620 474691384 /nfs/dbraw/zinc/69/13/84/474691384.db2.gz TVOMOHXIRDWKOQ-FUHWJXTLSA-N 1 1 328.368 2.694 10 5 EFBEMO Cc1cccc(OC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000305301810 474729304 /nfs/dbraw/zinc/72/93/04/474729304.db2.gz JSSXSMRCUQWFMJ-KRWDZBQOSA-N 1 1 342.395 2.701 10 5 EFBEMO Cc1nn(C)c(C)c1NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000340911177 474771393 /nfs/dbraw/zinc/77/13/93/474771393.db2.gz KWJYTPRKZHTJAY-ZYHUDNBSSA-N 1 1 345.403 2.623 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000278683423 474775536 /nfs/dbraw/zinc/77/55/36/474775536.db2.gz RUIVMLWRRYHQIO-MRXNPFEDSA-N 1 1 343.387 2.792 10 5 EFBEMO COc1cc(C[N@@H+]2CCc3ccccc3[C@H]2CO)ccc1[N+](=O)[O-] ZINC000305856375 474799306 /nfs/dbraw/zinc/79/93/06/474799306.db2.gz WOPJRQZUUVUEPY-QGZVFWFLSA-N 1 1 328.368 2.695 10 5 EFBEMO COc1cc(C[N@H+]2CCc3ccccc3[C@H]2CO)ccc1[N+](=O)[O-] ZINC000305856375 474799317 /nfs/dbraw/zinc/79/93/17/474799317.db2.gz WOPJRQZUUVUEPY-QGZVFWFLSA-N 1 1 328.368 2.695 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)CC[N@@H+](C)C1CC1 ZINC000278818159 474851720 /nfs/dbraw/zinc/85/17/20/474851720.db2.gz UJNAOMJPERJOAM-UHFFFAOYSA-N 1 1 325.796 2.723 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255615387 474881297 /nfs/dbraw/zinc/88/12/97/474881297.db2.gz AZWDLXKMQPSZLK-VONQVCDISA-N 1 1 329.400 2.693 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H](C)C1=CC[N@@H+](C)CC1 ZINC000278895051 474899090 /nfs/dbraw/zinc/89/90/90/474899090.db2.gz ZTQZRCAXWSJKFR-LLVKDONJSA-N 1 1 337.807 2.937 10 5 EFBEMO COc1ccc(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000341035214 474902042 /nfs/dbraw/zinc/90/20/42/474902042.db2.gz IKGQHQNATQWCRO-BETUJISGSA-N 1 1 335.404 2.596 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2F)[C@@H](C)C1 ZINC000273474143 474918332 /nfs/dbraw/zinc/91/83/32/474918332.db2.gz PAZUTYSOGSPSIG-XHDPSFHLSA-N 1 1 338.383 2.928 10 5 EFBEMO C[N@H+]1CCC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000613860529 480134259 /nfs/dbraw/zinc/13/42/59/480134259.db2.gz OBLBWENPPKFRGC-JTQLQIEISA-N 1 1 346.309 2.829 10 5 EFBEMO COc1cc(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000341069102 474938819 /nfs/dbraw/zinc/93/88/19/474938819.db2.gz NUCVPRBAPLZZFX-BETUJISGSA-N 1 1 335.404 2.596 10 5 EFBEMO CCOc1ccc(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000341071894 474942535 /nfs/dbraw/zinc/94/25/35/474942535.db2.gz SDNVSSGLGYBGQJ-OKILXGFUSA-N 1 1 349.431 2.986 10 5 EFBEMO C[C@@H]1OCC[C@H]1[N@@H+](CCO)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339149540 474977569 /nfs/dbraw/zinc/97/75/69/474977569.db2.gz SBKLGVZYASPWDD-IINYFYTJSA-N 1 1 348.321 2.585 10 5 EFBEMO CCNC(=O)C[C@@H]1CCCC[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000285357182 474987437 /nfs/dbraw/zinc/98/74/37/474987437.db2.gz QHGVKIDBCKCUJI-NSHDSACASA-N 1 1 341.358 2.754 10 5 EFBEMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000285357182 474987450 /nfs/dbraw/zinc/98/74/50/474987450.db2.gz QHGVKIDBCKCUJI-NSHDSACASA-N 1 1 341.358 2.754 10 5 EFBEMO COC(=O)c1cc(N2CC[C@]3(C2)CCC[N@@H+](C)C3)cc(C)c1[N+](=O)[O-] ZINC000292699883 475159159 /nfs/dbraw/zinc/15/91/59/475159159.db2.gz GAHRUNNXHCMNOY-GOSISDBHSA-N 1 1 347.415 2.612 10 5 EFBEMO COC[C@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000341645106 475203433 /nfs/dbraw/zinc/20/34/33/475203433.db2.gz ZWYCQFKXQFUDNM-HNNXBMFYSA-N 1 1 343.383 2.819 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H]1CN1CCOCC1 ZINC000347354071 475260039 /nfs/dbraw/zinc/26/00/39/475260039.db2.gz GECHJGJEGCRUBI-BAILOTOSSA-N 1 1 345.443 2.795 10 5 EFBEMO COc1ccc([C@@H](CO)[N@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000352415316 475272491 /nfs/dbraw/zinc/27/24/91/475272491.db2.gz AKEIMDITVZFBSL-QGZVFWFLSA-N 1 1 346.383 2.777 10 5 EFBEMO COc1ccc([C@@H](CO)[N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000352415316 475272499 /nfs/dbraw/zinc/27/24/99/475272499.db2.gz AKEIMDITVZFBSL-QGZVFWFLSA-N 1 1 346.383 2.777 10 5 EFBEMO COc1cc(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000352541314 475396152 /nfs/dbraw/zinc/39/61/52/475396152.db2.gz WIWIQBDQCQFUCC-INIZCTEOSA-N 1 1 333.432 2.767 10 5 EFBEMO CC[N@H+]1CCC[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000358101696 475400943 /nfs/dbraw/zinc/40/09/43/475400943.db2.gz YVQTUBMSAJIMLE-LBPRGKRZSA-N 1 1 337.395 2.612 10 5 EFBEMO CC1=CC[N@@H+](CCNC(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000358191012 475476188 /nfs/dbraw/zinc/47/61/88/475476188.db2.gz NNYWFLIBJKBBMH-CQSZACIVSA-N 1 1 332.404 2.607 10 5 EFBEMO CC[C@@H](NC(=O)[C@H]1CCCc2[nH+]ccn21)c1cccc([N+](=O)[O-])c1 ZINC000354910754 475511063 /nfs/dbraw/zinc/51/10/63/475511063.db2.gz CMHAFDBRPOTWBR-HUUCEWRRSA-N 1 1 328.372 2.936 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2CCCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000354923743 475524766 /nfs/dbraw/zinc/52/47/66/475524766.db2.gz NOBIXDGSSPPSFO-ZDUSSCGKSA-N 1 1 336.388 2.911 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCCC[C@@H]3CCO)n2)c1 ZINC000342067282 475544308 /nfs/dbraw/zinc/54/43/08/475544308.db2.gz RTSBDMGIJXCWJS-CQSZACIVSA-N 1 1 346.387 2.772 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)ccc1[N+](=O)[O-] ZINC000352776295 475612425 /nfs/dbraw/zinc/61/24/25/475612425.db2.gz BPAIOZUMTDNHCQ-BBRMVZONSA-N 1 1 330.388 2.883 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000297152484 475630836 /nfs/dbraw/zinc/63/08/36/475630836.db2.gz VOJACVNIRLFVNK-YHWZYXNKSA-N 1 1 337.807 2.912 10 5 EFBEMO C[N@H+]1CCC[C@H]1CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000355168113 475713838 /nfs/dbraw/zinc/71/38/38/475713838.db2.gz SGIZMDYILWQUAI-JTQLQIEISA-N 1 1 346.309 2.829 10 5 EFBEMO Cc1[nH+]ccn1CCCNC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000338323579 475787658 /nfs/dbraw/zinc/78/76/58/475787658.db2.gz FAOLDTMJSUEOAG-UHFFFAOYSA-N 1 1 336.779 2.882 10 5 EFBEMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(-n2cncn2)cc1 ZINC000348668801 475807381 /nfs/dbraw/zinc/80/73/81/475807381.db2.gz FKYOETPRCUGYJT-UHFFFAOYSA-N 1 1 337.383 2.850 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1OC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000340166505 475817819 /nfs/dbraw/zinc/81/78/19/475817819.db2.gz FUJDOSZAWCCCDN-KRWDZBQOSA-N 1 1 342.395 2.701 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000348707208 475827405 /nfs/dbraw/zinc/82/74/05/475827405.db2.gz RJEQRHKYOCFJND-CABCVRRESA-N 1 1 348.447 2.504 10 5 EFBEMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1C ZINC000338425094 475891546 /nfs/dbraw/zinc/89/15/46/475891546.db2.gz PSYGSQSCURXOOL-CQSZACIVSA-N 1 1 334.420 2.683 10 5 EFBEMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000297877245 475912566 /nfs/dbraw/zinc/91/25/66/475912566.db2.gz RFSIYWMZCBKUON-NXEZZACHSA-N 1 1 345.321 2.778 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](C[C@@H](O)Cc1cccc(Cl)c1)CC2 ZINC000346977230 476005079 /nfs/dbraw/zinc/00/50/79/476005079.db2.gz WLWGPPALQMYYOM-INIZCTEOSA-N 1 1 347.802 2.605 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](C[C@@H](O)Cc1cccc(Cl)c1)CC2 ZINC000346977230 476005084 /nfs/dbraw/zinc/00/50/84/476005084.db2.gz WLWGPPALQMYYOM-INIZCTEOSA-N 1 1 347.802 2.605 10 5 EFBEMO Cc1sc(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000298294721 476047636 /nfs/dbraw/zinc/04/76/36/476047636.db2.gz HSEYHHILRFTFTJ-CQSZACIVSA-N 1 1 345.424 2.969 10 5 EFBEMO Cc1sc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000298294721 476047641 /nfs/dbraw/zinc/04/76/41/476047641.db2.gz HSEYHHILRFTFTJ-CQSZACIVSA-N 1 1 345.424 2.969 10 5 EFBEMO C[C@@]12CC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@@H]1C2(F)F ZINC000298435926 476093470 /nfs/dbraw/zinc/09/34/70/476093470.db2.gz YRSNAUSQCNYKRZ-QWHCGFSZSA-N 1 1 327.287 2.980 10 5 EFBEMO C[C@@]12CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@@H]1C2(F)F ZINC000298435926 476093480 /nfs/dbraw/zinc/09/34/80/476093480.db2.gz YRSNAUSQCNYKRZ-QWHCGFSZSA-N 1 1 327.287 2.980 10 5 EFBEMO Cc1ccc(C[N@H+]2CCC[C@@H](C(=O)N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000353578891 476095318 /nfs/dbraw/zinc/09/53/18/476095318.db2.gz VEGGOBWCBSBPOF-MRXNPFEDSA-N 1 1 331.416 2.738 10 5 EFBEMO Cc1[nH+]ccn1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000340546099 476099374 /nfs/dbraw/zinc/09/93/74/476099374.db2.gz LTSAHJGAFQRJHO-UHFFFAOYSA-N 1 1 343.368 2.862 10 5 EFBEMO C[N@@H+](CCCN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)Cc1ccccc1 ZINC000336677492 476123727 /nfs/dbraw/zinc/12/37/27/476123727.db2.gz ZJSOHOBTJCJPGW-UHFFFAOYSA-N 1 1 339.399 2.827 10 5 EFBEMO CO[C@@H]1CC[C@@H]([NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000353668087 476172766 /nfs/dbraw/zinc/17/27/66/476172766.db2.gz FPNDNGOXOOBXMP-FVQBIDKESA-N 1 1 330.388 2.575 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@H](OCc3ccncc3)C2)ccc1[N+](=O)[O-] ZINC000347229012 476188256 /nfs/dbraw/zinc/18/82/56/476188256.db2.gz ZYRXIICUSNBBRF-INIZCTEOSA-N 1 1 343.383 2.790 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@]2(CCCOC2)C1 ZINC000357098036 476229516 /nfs/dbraw/zinc/22/95/16/476229516.db2.gz JJQRIABAOMNSGZ-KDOFPFPSSA-N 1 1 347.415 2.814 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000357098036 476229523 /nfs/dbraw/zinc/22/95/23/476229523.db2.gz JJQRIABAOMNSGZ-KDOFPFPSSA-N 1 1 347.415 2.814 10 5 EFBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000357105106 476235162 /nfs/dbraw/zinc/23/51/62/476235162.db2.gz XDXVDOAQHSMZLU-KBXCAEBGSA-N 1 1 347.415 2.814 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]3COCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000362447008 476257303 /nfs/dbraw/zinc/25/73/03/476257303.db2.gz JVEBWDFQAHYREY-PBHICJAKSA-N 1 1 347.415 2.733 10 5 EFBEMO CSc1cccc(C(=O)NCC[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000362840347 476434924 /nfs/dbraw/zinc/43/49/24/476434924.db2.gz KJVWIUCVDPNFSZ-LBPRGKRZSA-N 1 1 337.445 2.921 10 5 EFBEMO COc1cc(C(=O)N2CCC(n3c[nH+]cc3C)CC2)ccc1[N+](=O)[O-] ZINC000369782364 476522249 /nfs/dbraw/zinc/52/22/49/476522249.db2.gz DGAUAPBOVGTNFL-UHFFFAOYSA-N 1 1 344.371 2.586 10 5 EFBEMO CCC[N@@H+](CC)C[C@@H](C)Nc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-] ZINC000357775889 476594341 /nfs/dbraw/zinc/59/43/41/476594341.db2.gz RQZDNIRTHSKHDQ-GFCCVEGCSA-N 1 1 338.408 2.617 10 5 EFBEMO CO[C@@H](C)C[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000354366083 476614092 /nfs/dbraw/zinc/61/40/92/476614092.db2.gz FZNFTNKWNDNVCZ-ZDUSSCGKSA-N 1 1 337.420 2.977 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)s2)C[C@@H]1C ZINC000354424301 476653780 /nfs/dbraw/zinc/65/37/80/476653780.db2.gz IYDKRBNVRNMNTP-JQWIXIFHSA-N 1 1 325.434 2.910 10 5 EFBEMO CO[C@H](C)C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000354431156 476657695 /nfs/dbraw/zinc/65/76/95/476657695.db2.gz LVCHQGZSYILSOT-LLVKDONJSA-N 1 1 343.811 2.932 10 5 EFBEMO CCOc1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](CC)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000354438035 476661227 /nfs/dbraw/zinc/66/12/27/476661227.db2.gz UKLXGFXENBHLNR-UKRRQHHQSA-N 1 1 349.431 2.938 10 5 EFBEMO CO[C@@H](C)C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000354447069 476667855 /nfs/dbraw/zinc/66/78/55/476667855.db2.gz GHLJVYQHDRQAEE-NSHDSACASA-N 1 1 343.811 2.932 10 5 EFBEMO CO[C@@H](C)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(C)C ZINC000354465339 476676190 /nfs/dbraw/zinc/67/61/90/476676190.db2.gz VLILMDNDQGBBOQ-AWEZNQCLSA-N 1 1 337.420 2.977 10 5 EFBEMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(c2c[nH]cn2)CC1 ZINC000378060428 476680944 /nfs/dbraw/zinc/68/09/44/476680944.db2.gz OYUDPAUYYRVBDH-LBPRGKRZSA-N 1 1 343.387 2.525 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@]4(CCOC4)C3)o2)cc1 ZINC000451898313 476708382 /nfs/dbraw/zinc/70/83/82/476708382.db2.gz FNIMEVNFLSOFKA-KRWDZBQOSA-N 1 1 344.371 2.647 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@]4(CCOC4)C3)n2)cc1 ZINC000451904502 476714485 /nfs/dbraw/zinc/71/44/85/476714485.db2.gz QYPRTEDSORUZTM-KRWDZBQOSA-N 1 1 344.371 2.647 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@]4(CCOC4)C3)n2)cc1 ZINC000451904502 476714493 /nfs/dbraw/zinc/71/44/93/476714493.db2.gz QYPRTEDSORUZTM-KRWDZBQOSA-N 1 1 344.371 2.647 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@]3(CCOC3)C2)cccc1[N+](=O)[O-] ZINC000451905840 476714984 /nfs/dbraw/zinc/71/49/84/476714984.db2.gz SLSQBQZLMYPDAO-KDOFPFPSSA-N 1 1 347.415 2.733 10 5 EFBEMO O=[N+]([O-])c1cnc(NC[C@@H]2CCCC[N@H+]2Cc2ccccc2)s1 ZINC000379681062 476730288 /nfs/dbraw/zinc/73/02/88/476730288.db2.gz OVNZMGBHLBPYPY-AWEZNQCLSA-N 1 1 332.429 2.940 10 5 EFBEMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000370396853 476790027 /nfs/dbraw/zinc/79/00/27/476790027.db2.gz RUAICZORYGGDEN-IBGZPJMESA-N 1 1 339.395 2.857 10 5 EFBEMO C[C@@H](CN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[N@@H+](C)Cc1ccccc1 ZINC000390650215 476795594 /nfs/dbraw/zinc/79/55/94/476795594.db2.gz VVEGJXDIICCDNR-ZDUSSCGKSA-N 1 1 339.399 2.825 10 5 EFBEMO Nc1nccc([C@@H]2CCC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n1 ZINC000365989753 476799658 /nfs/dbraw/zinc/79/96/58/476799658.db2.gz ONXKNGDYYAQOAE-GFCCVEGCSA-N 1 1 347.806 2.830 10 5 EFBEMO Nc1nccc([C@@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n1 ZINC000365989753 476799663 /nfs/dbraw/zinc/79/96/63/476799663.db2.gz ONXKNGDYYAQOAE-GFCCVEGCSA-N 1 1 347.806 2.830 10 5 EFBEMO COC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000452075729 476808143 /nfs/dbraw/zinc/80/81/43/476808143.db2.gz AYPSTOIBZCJRFS-LSDHHAIUSA-N 1 1 349.431 2.979 10 5 EFBEMO COC[C@@H]1CCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000452076943 476808575 /nfs/dbraw/zinc/80/85/75/476808575.db2.gz CBOTWSCVWJVGBB-OAHLLOKOSA-N 1 1 349.431 2.980 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000446055055 476814137 /nfs/dbraw/zinc/81/41/37/476814137.db2.gz SGFAZXHDCUUSEG-GASCZTMLSA-N 1 1 333.432 2.907 10 5 EFBEMO COC[C@H]1CCC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000452090357 476817617 /nfs/dbraw/zinc/81/76/17/476817617.db2.gz RZPKTOKWMOUNJA-AWEZNQCLSA-N 1 1 338.404 2.731 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2nc(C3CC3)no2)C1 ZINC000375473485 476856785 /nfs/dbraw/zinc/85/67/85/476856785.db2.gz WKIZPIVQSGTLIF-LBPRGKRZSA-N 1 1 344.371 2.853 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)CC1(C)C ZINC000408411256 476949742 /nfs/dbraw/zinc/94/97/42/476949742.db2.gz FLQHRWHZEZDOAT-UHFFFAOYSA-N 1 1 325.796 2.723 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C)CC1(C)C ZINC000408411256 476949748 /nfs/dbraw/zinc/94/97/48/476949748.db2.gz FLQHRWHZEZDOAT-UHFFFAOYSA-N 1 1 325.796 2.723 10 5 EFBEMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@@H]([NH3+])c1ccccc1 ZINC000423237000 476972893 /nfs/dbraw/zinc/97/28/93/476972893.db2.gz HTRIOZXQOHPGCU-CXAGYDPISA-N 1 1 342.399 2.602 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H]1C[C@H](O)c1cnn(C)c1 ZINC000375781495 477002050 /nfs/dbraw/zinc/00/20/50/477002050.db2.gz 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CCn1nc2c(cc1=O)C[N@H+]([C@@H](C)c1cc([N+](=O)[O-])ccc1C)CC2 ZINC000371497580 477356210 /nfs/dbraw/zinc/35/62/10/477356210.db2.gz QAQZGSCFDRJHSI-ZDUSSCGKSA-N 1 1 342.399 2.599 10 5 EFBEMO CCn1nc2c(cc1=O)C[N@@H+]([C@@H](C)c1cc([N+](=O)[O-])ccc1C)CC2 ZINC000371497580 477356215 /nfs/dbraw/zinc/35/62/15/477356215.db2.gz QAQZGSCFDRJHSI-ZDUSSCGKSA-N 1 1 342.399 2.599 10 5 EFBEMO C[C@H](N=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000450436881 477593949 /nfs/dbraw/zinc/59/39/49/477593949.db2.gz RVCFPJTWAFGTCU-QWHCGFSZSA-N 1 1 343.431 2.958 10 5 EFBEMO C[N@H+]1CC[C@@H](CNC(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000455421047 477626391 /nfs/dbraw/zinc/62/63/91/477626391.db2.gz ULZXWYRVMCBILU-LBPRGKRZSA-N 1 1 334.420 2.966 10 5 EFBEMO CCc1cc(CCC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)on1 ZINC000450573020 477638932 /nfs/dbraw/zinc/63/89/32/477638932.db2.gz VSPBEIUELZMTND-CQSZACIVSA-N 1 1 345.403 2.659 10 5 EFBEMO 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CS(=O)(=O)CCCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590757625 478322887 /nfs/dbraw/zinc/32/28/87/478322887.db2.gz PNODRDVZCKABFK-OAHLLOKOSA-N 1 1 340.445 2.599 10 5 EFBEMO C[N@H+]1CCCC[C@@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000600312313 478334479 /nfs/dbraw/zinc/33/44/79/478334479.db2.gz DSYJJKHSGOAAJL-LBPRGKRZSA-N 1 1 330.388 2.538 10 5 EFBEMO CCC(C)(C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)s2)CC1 ZINC000594390467 478358707 /nfs/dbraw/zinc/35/87/07/478358707.db2.gz WXLMFAQTGZETHK-UHFFFAOYSA-N 1 1 325.434 2.911 10 5 EFBEMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000594417195 478373975 /nfs/dbraw/zinc/37/39/75/478373975.db2.gz AXOZHQNFEIVFGW-IRXDYDNUSA-N 1 1 342.399 2.823 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000600471464 478382245 /nfs/dbraw/zinc/38/22/45/478382245.db2.gz SFZQQJDSGTUKGQ-OKZBNKHCSA-N 1 1 343.427 2.831 10 5 EFBEMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1cc(Cl)cc([N+](=O)[O-])c1 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/nfs/dbraw/zinc/71/62/88/478716288.db2.gz QXXNZQADYIJIEB-DFHBCGBQSA-N 1 1 345.399 2.543 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@@H]2CNc2ncc(F)cc2[N+](=O)[O-])cc1 ZINC000601200767 478720467 /nfs/dbraw/zinc/72/04/67/478720467.db2.gz HDAGYVLVMFLKLC-CQSZACIVSA-N 1 1 346.362 2.824 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2ncc(F)cc2[N+](=O)[O-])cc1 ZINC000601200767 478720471 /nfs/dbraw/zinc/72/04/71/478720471.db2.gz HDAGYVLVMFLKLC-CQSZACIVSA-N 1 1 346.362 2.824 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000601203012 478721140 /nfs/dbraw/zinc/72/11/40/478721140.db2.gz LPIQVIHTNOGMRX-JTQLQIEISA-N 1 1 347.341 2.776 10 5 EFBEMO CC[C@@H]1[C@@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000601211628 478724731 /nfs/dbraw/zinc/72/47/31/478724731.db2.gz FXVVBJKQDCUBMX-DLBZAZTESA-N 1 1 333.432 2.764 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[NH+](Cc3ccc(O)cc3)CC2)n1 ZINC000601257256 478750538 /nfs/dbraw/zinc/75/05/38/478750538.db2.gz MIGSMCWCWWRFEG-UHFFFAOYSA-N 1 1 342.399 2.634 10 5 EFBEMO CC(C)[C@@H](O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592132742 478790829 /nfs/dbraw/zinc/79/08/29/478790829.db2.gz NNFYRVGJYGQQDU-BQFCYCMXSA-N 1 1 336.432 2.717 10 5 EFBEMO COc1cc(C[NH2+][C@H](CCO)c2ccccc2F)ccc1[N+](=O)[O-] ZINC000592162318 478807217 /nfs/dbraw/zinc/80/72/17/478807217.db2.gz VYIHJYDBIMSQRB-OAHLLOKOSA-N 1 1 334.347 2.956 10 5 EFBEMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000592183069 478815711 /nfs/dbraw/zinc/81/57/11/478815711.db2.gz CPWMDKNIFHNDFW-QMTHXVAHSA-N 1 1 345.321 2.656 10 5 EFBEMO CNC(=O)[C@]1(C(F)(F)F)CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000592185579 478816883 /nfs/dbraw/zinc/81/68/83/478816883.db2.gz ZXOLEDZEWLDKTE-HZMBPMFUSA-N 1 1 345.321 2.656 10 5 EFBEMO CCCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H]1CCc2ncsc2C1 ZINC000592189865 478820441 /nfs/dbraw/zinc/82/04/41/478820441.db2.gz YDCWCTVHPYGRAY-ZDUSSCGKSA-N 1 1 349.460 2.907 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cn[nH]c1)[C@H]1CC[C@H](O)CC1 ZINC000595562883 478857292 /nfs/dbraw/zinc/85/72/92/478857292.db2.gz MVUMYMJYCWXZHJ-WKILWMFISA-N 1 1 330.388 2.624 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cn[nH]c1)[C@H]1CC[C@H](O)CC1 ZINC000595562883 478857294 /nfs/dbraw/zinc/85/72/94/478857294.db2.gz MVUMYMJYCWXZHJ-WKILWMFISA-N 1 1 330.388 2.624 10 5 EFBEMO Cc1noc(C[N@H+]2CC[C@H](C)[C@H](C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000595562378 478858160 /nfs/dbraw/zinc/85/81/60/478858160.db2.gz JOQXKJSNKWXBMF-CMPLNLGQSA-N 1 1 339.392 2.691 10 5 EFBEMO Cc1noc(C[N@@H+]2CC[C@H](C)[C@H](C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000595562378 478858170 /nfs/dbraw/zinc/85/81/70/478858170.db2.gz JOQXKJSNKWXBMF-CMPLNLGQSA-N 1 1 339.392 2.691 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CC[N@@H+]1Cc1ccccc1 ZINC000598512388 478873229 /nfs/dbraw/zinc/87/32/29/478873229.db2.gz ZEEOFDJDGSRHHT-KRWDZBQOSA-N 1 1 339.395 2.908 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000598512388 478873237 /nfs/dbraw/zinc/87/32/37/478873237.db2.gz ZEEOFDJDGSRHHT-KRWDZBQOSA-N 1 1 339.395 2.908 10 5 EFBEMO COc1cc(C[N@@H+](C)[C@@H](CO)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000595591124 478873294 /nfs/dbraw/zinc/87/32/94/478873294.db2.gz DNWXRIYNPAWVCC-MRXNPFEDSA-N 1 1 330.384 2.639 10 5 EFBEMO COc1cccc([C@@H](C)[NH+]2CCN(c3ccncc3[N+](=O)[O-])CC2)c1 ZINC000505613203 478876053 /nfs/dbraw/zinc/87/60/53/478876053.db2.gz QXTQRUTYYUBBQD-CQSZACIVSA-N 1 1 342.399 2.882 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2[C@H]2CCCOC2)c1 ZINC000592516980 478926440 /nfs/dbraw/zinc/92/64/40/478926440.db2.gz MNZOQSKAFDDWSZ-GOEBONIOSA-N 1 1 348.399 2.772 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000595672888 478926732 /nfs/dbraw/zinc/92/67/32/478926732.db2.gz CNLOIFRBJCPHOB-QGZVFWFLSA-N 1 1 343.383 2.967 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000595672888 478926738 /nfs/dbraw/zinc/92/67/38/478926738.db2.gz CNLOIFRBJCPHOB-QGZVFWFLSA-N 1 1 343.383 2.967 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](c3cccnc3)C2)c1 ZINC000592520322 478928720 /nfs/dbraw/zinc/92/87/20/478928720.db2.gz LAQXDQYYORCJRZ-HNNXBMFYSA-N 1 1 341.367 2.766 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@]2(C)COC[C@]2(C)C1 ZINC000595691075 478939050 /nfs/dbraw/zinc/93/90/50/478939050.db2.gz YLYVPCILBAYYKF-HDICACEKSA-N 1 1 347.415 2.590 10 5 EFBEMO O=C(C[N@@H+]1CCC[C@@H](CCF)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595756657 478978178 /nfs/dbraw/zinc/97/81/78/478978178.db2.gz VKTFMIFKKUKOEG-ZDUSSCGKSA-N 1 1 335.379 2.556 10 5 EFBEMO O=C(C[N@H+]1CCC[C@@H](CCF)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595756657 478978188 /nfs/dbraw/zinc/97/81/88/478978188.db2.gz VKTFMIFKKUKOEG-ZDUSSCGKSA-N 1 1 335.379 2.556 10 5 EFBEMO C[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H](C)O1 ZINC000595783826 478995212 /nfs/dbraw/zinc/99/52/12/478995212.db2.gz PEZPEWSGXXKVQW-NEPJUHHUSA-N 1 1 332.360 2.644 10 5 EFBEMO C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H](C)O1 ZINC000595783826 478995218 /nfs/dbraw/zinc/99/52/18/478995218.db2.gz PEZPEWSGXXKVQW-NEPJUHHUSA-N 1 1 332.360 2.644 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H](C2CCC2)C1 ZINC000595832074 479021906 /nfs/dbraw/zinc/02/19/06/479021906.db2.gz HJVQPYGEVWCUGG-HZPDHXFCSA-N 1 1 334.416 2.847 10 5 EFBEMO CC(C)NC(=O)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000595849182 479032291 /nfs/dbraw/zinc/03/22/91/479032291.db2.gz DGRCCVYOGUNJCI-CYBMUJFWSA-N 1 1 339.823 2.985 10 5 EFBEMO CC(C)NC(=O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000595849182 479032296 /nfs/dbraw/zinc/03/22/96/479032296.db2.gz DGRCCVYOGUNJCI-CYBMUJFWSA-N 1 1 339.823 2.985 10 5 EFBEMO COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000595856709 479034942 /nfs/dbraw/zinc/03/49/42/479034942.db2.gz PJFHHBYXBDUYAI-WVSHTKLVSA-N 1 1 346.305 2.997 10 5 EFBEMO O=C(C[N@@H+](CCC1CC1)CC1CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595870819 479042282 /nfs/dbraw/zinc/04/22/82/479042282.db2.gz GKIRHVGZSCCBJA-UHFFFAOYSA-N 1 1 343.427 2.996 10 5 EFBEMO CCC[N@H+](C)CC(C)(C)NCCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000595873633 479044713 /nfs/dbraw/zinc/04/47/13/479044713.db2.gz OPQQWLZATNAVSL-UHFFFAOYSA-N 1 1 336.436 2.633 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NCCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000595873633 479044720 /nfs/dbraw/zinc/04/47/20/479044720.db2.gz OPQQWLZATNAVSL-UHFFFAOYSA-N 1 1 336.436 2.633 10 5 EFBEMO CCN1CC[C@@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)[C@H](C)C1 ZINC000573360050 479048720 /nfs/dbraw/zinc/04/87/20/479048720.db2.gz BQUTYVKPTHYZEO-CXAGYDPISA-N 1 1 330.432 2.939 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1NC ZINC000592826365 479061864 /nfs/dbraw/zinc/06/18/64/479061864.db2.gz QANKNQQOZPNIQD-LLVKDONJSA-N 1 1 331.376 2.985 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595905017 479062860 /nfs/dbraw/zinc/06/28/60/479062860.db2.gz OECVSCFCTRNULZ-HDICACEKSA-N 1 1 332.400 2.996 10 5 EFBEMO C[N@H+]1C[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)C1 ZINC000592883470 479088235 /nfs/dbraw/zinc/08/82/35/479088235.db2.gz ZUFSVKCSCIKGEO-AEFFLSMTSA-N 1 1 339.395 2.670 10 5 EFBEMO CCC[NH+]1CCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)CC1 ZINC000596054108 479109667 /nfs/dbraw/zinc/10/96/67/479109667.db2.gz LORKOWZRQVQQMR-UHFFFAOYSA-N 1 1 341.795 2.567 10 5 EFBEMO O=[N+]([O-])c1ccc(C[NH2+]C[C@H](n2cccn2)C(F)(F)F)c(F)c1 ZINC000598989495 479116232 /nfs/dbraw/zinc/11/62/32/479116232.db2.gz IZJRQJCHMYVCDZ-LBPRGKRZSA-N 1 1 332.257 2.824 10 5 EFBEMO CC[C@H](O)[C@H]1CCCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000593014354 479125170 /nfs/dbraw/zinc/12/51/70/479125170.db2.gz JBWXRNWLESBRBF-CVEARBPZSA-N 1 1 336.388 2.507 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]([C@H](C)CO)C2CCCC2)c1 ZINC000593025396 479130800 /nfs/dbraw/zinc/13/08/00/479130800.db2.gz RYPDPNUFKPURPV-GFCCVEGCSA-N 1 1 336.388 2.507 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@H]2C[C@H](C)O)c1 ZINC000593028410 479131900 /nfs/dbraw/zinc/13/19/00/479131900.db2.gz FMDRKQYBPTZBHM-WFASDCNBSA-N 1 1 336.388 2.507 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCSC[C@H]2C2CC2)c1 ZINC000593030926 479133898 /nfs/dbraw/zinc/13/38/98/479133898.db2.gz RREJSYPAQNVNFW-HNNXBMFYSA-N 1 1 336.413 2.709 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCSC[C@H]2C2CC2)c1 ZINC000593030926 479133904 /nfs/dbraw/zinc/13/39/04/479133904.db2.gz RREJSYPAQNVNFW-HNNXBMFYSA-N 1 1 336.413 2.709 10 5 EFBEMO CN(C)c1[nH+]cc(CNc2ccc3cnccc3c2[N+](=O)[O-])n1C ZINC000599045328 479136320 /nfs/dbraw/zinc/13/63/20/479136320.db2.gz WFUHNQWUIGZJMQ-UHFFFAOYSA-N 1 1 326.360 2.555 10 5 EFBEMO COCC[N@H+]1CCC[C@@H](Nc2cc(OC)c([N+](=O)[O-])cc2Cl)C1 ZINC000596115549 479147550 /nfs/dbraw/zinc/14/75/50/479147550.db2.gz BEVRYJTYECLLKK-LLVKDONJSA-N 1 1 343.811 2.780 10 5 EFBEMO CC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCCOC1 ZINC000593066283 479154654 /nfs/dbraw/zinc/15/46/54/479154654.db2.gz AYEKVYMAUGYNDS-AWEZNQCLSA-N 1 1 332.360 2.646 10 5 EFBEMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCCOC1 ZINC000593066283 479154661 /nfs/dbraw/zinc/15/46/61/479154661.db2.gz AYEKVYMAUGYNDS-AWEZNQCLSA-N 1 1 332.360 2.646 10 5 EFBEMO COc1cc(N2CC[NH+](CCCF)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000599091496 479157490 /nfs/dbraw/zinc/15/74/90/479157490.db2.gz ANRGHSBQNMUSMV-UHFFFAOYSA-N 1 1 331.775 2.738 10 5 EFBEMO COC(=O)c1cnc(NC[C@H]2CC[N@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000599125795 479170007 /nfs/dbraw/zinc/17/00/07/479170007.db2.gz BVCWLXKHABALCE-CQSZACIVSA-N 1 1 348.403 2.595 10 5 EFBEMO C[C@@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCc2ccccc21 ZINC000593096434 479173170 /nfs/dbraw/zinc/17/31/70/479173170.db2.gz SNKDESFBKWZLHW-CYBMUJFWSA-N 1 1 339.395 2.856 10 5 EFBEMO CC[N@@H+]1CCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)C[C@H]1C ZINC000596172206 479177859 /nfs/dbraw/zinc/17/78/59/479177859.db2.gz INAVSUBAJHCOMR-SNVBAGLBSA-N 1 1 341.795 2.565 10 5 EFBEMO CC[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)C[C@H]1C ZINC000596172206 479177867 /nfs/dbraw/zinc/17/78/67/479177867.db2.gz INAVSUBAJHCOMR-SNVBAGLBSA-N 1 1 341.795 2.565 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@H]2CNc2ncccc2[N+](=O)[O-])cc1 ZINC000599140445 479179054 /nfs/dbraw/zinc/17/90/54/479179054.db2.gz STGCKRIIUDVUED-AWEZNQCLSA-N 1 1 328.372 2.685 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@H]2CNc2ncccc2[N+](=O)[O-])cc1 ZINC000599140445 479179059 /nfs/dbraw/zinc/17/90/59/479179059.db2.gz STGCKRIIUDVUED-AWEZNQCLSA-N 1 1 328.372 2.685 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2ccc([N+](=O)[O-])nc2)cc1 ZINC000599141099 479179097 /nfs/dbraw/zinc/17/90/97/479179097.db2.gz WSEGSYQHDYWGLM-OAHLLOKOSA-N 1 1 328.372 2.685 10 5 EFBEMO O=C([C@@H]1C[C@H]1c1cnc[nH]1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000602112287 479181149 /nfs/dbraw/zinc/18/11/49/479181149.db2.gz YIRPSLVYPZKLKH-IOASZLSFSA-N 1 1 344.396 2.696 10 5 EFBEMO C[C@H](c1cccc(F)c1)[NH+]1CCN(c2cc[nH]c(=O)c2[N+](=O)[O-])CC1 ZINC000596178317 479182696 /nfs/dbraw/zinc/18/26/96/479182696.db2.gz IIZGIRYTPCZNEU-GFCCVEGCSA-N 1 1 346.362 2.718 10 5 EFBEMO O=C(CC[N@H+]1CC[C@@]2(CC2(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000593115249 479183354 /nfs/dbraw/zinc/18/33/54/479183354.db2.gz BMSJHSYOQSONTR-CQSZACIVSA-N 1 1 325.315 2.655 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@]4(CC4(F)F)C3)n2)cc1 ZINC000593117919 479185789 /nfs/dbraw/zinc/18/57/89/479185789.db2.gz OIJIPHGRIDUNJP-AWEZNQCLSA-N 1 1 336.298 2.876 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@]4(CC4(F)F)C3)n2)cc1 ZINC000593117919 479185795 /nfs/dbraw/zinc/18/57/95/479185795.db2.gz OIJIPHGRIDUNJP-AWEZNQCLSA-N 1 1 336.298 2.876 10 5 EFBEMO COC(=O)c1c(Cl)c(N2CC[N@H+](C)[C@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000596181937 479185991 /nfs/dbraw/zinc/18/59/91/479185991.db2.gz HWTQKALXKODYDV-ZJUUUORDSA-N 1 1 341.795 2.564 10 5 EFBEMO COC(=O)c1c(Cl)c(N2CC[N@@H+](C)[C@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000596181937 479186001 /nfs/dbraw/zinc/18/60/01/479186001.db2.gz HWTQKALXKODYDV-ZJUUUORDSA-N 1 1 341.795 2.564 10 5 EFBEMO O=[N+]([O-])c1ccc2c(ccnc2NC[C@@H]2CC[N@H+]2C2CCCC2)c1 ZINC000599163557 479189530 /nfs/dbraw/zinc/18/95/30/479189530.db2.gz DJUXABYAHNQYQU-INIZCTEOSA-N 1 1 326.400 2.994 10 5 EFBEMO CCOC(=O)c1ccnc(NC[C@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-] ZINC000599164024 479189937 /nfs/dbraw/zinc/18/99/37/479189937.db2.gz HWMWZZCUWMOVQC-CYBMUJFWSA-N 1 1 348.403 2.595 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@H+]2C2CCCC2)c1 ZINC000599166492 479190984 /nfs/dbraw/zinc/19/09/84/479190984.db2.gz WNIDZSGPKYKNIU-CQSZACIVSA-N 1 1 333.388 2.810 10 5 EFBEMO Cc1ccc(OC[C@H](O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000556831220 479218136 /nfs/dbraw/zinc/21/81/36/479218136.db2.gz GRXHAXCXGPLKKK-QGZVFWFLSA-N 1 1 344.411 2.817 10 5 EFBEMO COc1cc(N2CC[C@@]3(CC[N@@H+](C)C3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596241471 479219113 /nfs/dbraw/zinc/21/91/13/479219113.db2.gz FTAYPRGRIRMXTF-OAHLLOKOSA-N 1 1 325.796 2.789 10 5 EFBEMO COc1cc(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c(Cl)cc1[N+](=O)[O-] ZINC000596259651 479228123 /nfs/dbraw/zinc/22/81/23/479228123.db2.gz YKYDNIMRGHBJBW-PHIMTYICSA-N 1 1 341.795 2.532 10 5 EFBEMO Cc1cc(N2CCC([N@H+]3CCCOCC3)CC2)c([N+](=O)[O-])s1 ZINC000596269665 479232066 /nfs/dbraw/zinc/23/20/66/479232066.db2.gz XHKNFDJSHFYAAZ-UHFFFAOYSA-N 1 1 325.434 2.656 10 5 EFBEMO COC(=O)c1c(Cl)c(N(C)C[C@@H]2CCC[N@H+]2C)ccc1[N+](=O)[O-] ZINC000596279282 479235319 /nfs/dbraw/zinc/23/53/19/479235319.db2.gz RXRXSVZTHRJQEY-JTQLQIEISA-N 1 1 341.795 2.565 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000593203236 479237967 /nfs/dbraw/zinc/23/79/67/479237967.db2.gz IRUCAEBVZHRVSB-CYBMUJFWSA-N 1 1 339.411 2.932 10 5 EFBEMO CC[N@H+]1CC[C@H]2OCCN(C/C(C)=C\c3cccc([N+](=O)[O-])c3)[C@H]2C1 ZINC000556927601 479239464 /nfs/dbraw/zinc/23/94/64/479239464.db2.gz UNCKODLNLZODPQ-GYVFVFFDSA-N 1 1 345.443 2.793 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c1 ZINC000596307364 479248588 /nfs/dbraw/zinc/24/85/88/479248588.db2.gz LGALREDHUZKYDA-LBPRGKRZSA-N 1 1 335.404 2.914 10 5 EFBEMO C[C@@H]1C[C@@H]1C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000599370494 479272695 /nfs/dbraw/zinc/27/26/95/479272695.db2.gz IXZRMFFUJLBFKK-CHWSQXEVSA-N 1 1 329.404 2.639 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000593314029 479288478 /nfs/dbraw/zinc/28/84/78/479288478.db2.gz FFKRKGVRHXBWBK-AWEZNQCLSA-N 1 1 336.436 2.933 10 5 EFBEMO O=[N+]([O-])c1ccc(NCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)s1 ZINC000596422568 479288724 /nfs/dbraw/zinc/28/87/24/479288724.db2.gz FGWQOKJLWOGFFC-AWEZNQCLSA-N 1 1 333.413 2.835 10 5 EFBEMO O=[N+]([O-])c1ccc(NCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000596422581 479288912 /nfs/dbraw/zinc/28/89/12/479288912.db2.gz FRDROQBTTYLXAW-SFHVURJKSA-N 1 1 327.384 2.774 10 5 EFBEMO O=[N+]([O-])c1ccccc1NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000596422884 479289053 /nfs/dbraw/zinc/28/90/53/479289053.db2.gz JDWCHWXSROJZLO-INIZCTEOSA-N 1 1 327.384 2.774 10 5 EFBEMO CCN(C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000596453682 479301103 /nfs/dbraw/zinc/30/11/03/479301103.db2.gz JUXCXVBZFHBSDX-ZFWWWQNUSA-N 1 1 334.420 2.700 10 5 EFBEMO CC[C@@H](NC(=O)N(CC)[C@@H]1CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000596456929 479303124 /nfs/dbraw/zinc/30/31/24/479303124.db2.gz UZOKCRWXMFILQW-HZPDHXFCSA-N 1 1 334.420 2.782 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](C(F)F)C1 ZINC000611180309 479305566 /nfs/dbraw/zinc/30/55/66/479305566.db2.gz WQDNPYKLEWLLPG-JTQLQIEISA-N 1 1 343.330 2.519 10 5 EFBEMO COc1ccc([N+](=O)[O-])c(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c1 ZINC000596514881 479324617 /nfs/dbraw/zinc/32/46/17/479324617.db2.gz NZHLFEWWJJQUGS-IAGOWNOFSA-N 1 1 347.415 2.659 10 5 EFBEMO COc1cc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)ccc1[N+](=O)[O-] ZINC000596515125 479324739 /nfs/dbraw/zinc/32/47/39/479324739.db2.gz SSRIGNGDKFPGNA-IAGOWNOFSA-N 1 1 347.415 2.659 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)Nc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-] ZINC000596543311 479334105 /nfs/dbraw/zinc/33/41/05/479334105.db2.gz RKURKNYVJYWXFS-UHFFFAOYSA-N 1 1 338.408 2.617 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@H]([C@H]3CCOC3)C1)OCCO2 ZINC000611287563 479338867 /nfs/dbraw/zinc/33/88/67/479338867.db2.gz RTBIFGDWPOXXHD-KBPBESRZSA-N 1 1 348.399 2.615 10 5 EFBEMO CC1(C)COCC[N@@H+]1CCNc1ccnc2cc([N+](=O)[O-])ccc21 ZINC000593462166 479351899 /nfs/dbraw/zinc/35/18/99/479351899.db2.gz SLPZKQVQRJWPPG-UHFFFAOYSA-N 1 1 330.388 2.666 10 5 EFBEMO CC1(C)COCC[N@H+]1CCNc1ccnc2cc([N+](=O)[O-])ccc21 ZINC000593462166 479351903 /nfs/dbraw/zinc/35/19/03/479351903.db2.gz SLPZKQVQRJWPPG-UHFFFAOYSA-N 1 1 330.388 2.666 10 5 EFBEMO Cn1ncc2c1CC(C)(C)C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C2 ZINC000596599395 479353092 /nfs/dbraw/zinc/35/30/92/479353092.db2.gz SFEQDRUWEVMCGF-UHFFFAOYSA-N 1 1 344.415 2.792 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1Cc2cnn(C)c2CC(C)(C)C1 ZINC000596598778 479353932 /nfs/dbraw/zinc/35/39/32/479353932.db2.gz PKGWIRMZAFSLAW-UHFFFAOYSA-N 1 1 344.415 2.921 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1Cc2cnn(C)c2CC(C)(C)C1 ZINC000596598778 479353938 /nfs/dbraw/zinc/35/39/38/479353938.db2.gz PKGWIRMZAFSLAW-UHFFFAOYSA-N 1 1 344.415 2.921 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H]2CCC[C@]2(CO)C1 ZINC000599640286 479364361 /nfs/dbraw/zinc/36/43/61/479364361.db2.gz UDIULBNGAKFJSY-MAUKXSAKSA-N 1 1 334.416 2.976 10 5 EFBEMO C[C@]12CCCC[C@H]1C[N@H+]2CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000599674849 479384229 /nfs/dbraw/zinc/38/42/29/479384229.db2.gz JJRGWGCZPDRUGL-KSSFIOAISA-N 1 1 329.400 2.748 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000599693860 479394716 /nfs/dbraw/zinc/39/47/16/479394716.db2.gz NNFCIWFWJCQEAZ-CQSZACIVSA-N 1 1 348.403 2.742 10 5 EFBEMO COc1ccc(NC(=O)CC[N@H+]2CC[C@H](C)[C@@H](F)C2)c([N+](=O)[O-])c1 ZINC000611501902 479397381 /nfs/dbraw/zinc/39/73/81/479397381.db2.gz KJKWSRVIVARUIF-AAEUAGOBSA-N 1 1 339.367 2.612 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611502429 479397852 /nfs/dbraw/zinc/39/78/52/479397852.db2.gz SEQUOTBPBHYATL-YPMHNXCESA-N 1 1 339.367 2.612 10 5 EFBEMO COc1cc(C[N@@H+]2CCC[C@@H]2c2cn(C)nc2C)ccc1[N+](=O)[O-] ZINC000611516445 479403363 /nfs/dbraw/zinc/40/33/63/479403363.db2.gz ZMDMCNXCEYPXAJ-OAHLLOKOSA-N 1 1 330.388 2.982 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@@H]2c2cn(C)nc2C)ccc1[N+](=O)[O-] ZINC000611516445 479403369 /nfs/dbraw/zinc/40/33/69/479403369.db2.gz ZMDMCNXCEYPXAJ-OAHLLOKOSA-N 1 1 330.388 2.982 10 5 EFBEMO CC[N@@H+](C)Cc1cccc(CNc2cc(N)c([N+](=O)[O-])c(CO)c2)c1 ZINC000611525472 479405952 /nfs/dbraw/zinc/40/59/52/479405952.db2.gz FQWDRSOIPBWDIG-UHFFFAOYSA-N 1 1 344.415 2.733 10 5 EFBEMO Cn1ccnc1[C@H]([NH2+]CCC1(CO)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000593692097 479425230 /nfs/dbraw/zinc/42/52/30/479425230.db2.gz JDCCOUAWSREFMQ-MRXNPFEDSA-N 1 1 344.415 2.560 10 5 EFBEMO O=[N+]([O-])c1ccc(O)cc1CN1CC[NH2+]C[C@H]1c1cccc(F)c1 ZINC000593727443 479435879 /nfs/dbraw/zinc/43/58/79/479435879.db2.gz JQCIUHWYTFQQTA-KRWDZBQOSA-N 1 1 331.347 2.586 10 5 EFBEMO CC(C)[N@@H+](C)CCNC(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599830040 479442761 /nfs/dbraw/zinc/44/27/61/479442761.db2.gz POAAJEVAEXWLKZ-UHFFFAOYSA-N 1 1 331.376 2.605 10 5 EFBEMO CC[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C[C@H]1C ZINC000599833383 479444278 /nfs/dbraw/zinc/44/42/78/479444278.db2.gz RAJPPYUYWOOKQU-GFCCVEGCSA-N 1 1 343.387 2.701 10 5 EFBEMO O=C(NCC[N@@H+]1CC=CCC1)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599836525 479446752 /nfs/dbraw/zinc/44/67/52/479446752.db2.gz SRLPGFQBCKJYAD-UHFFFAOYSA-N 1 1 341.371 2.526 10 5 EFBEMO O=C1Nc2ccccc2[C@@]12CC[N@H+](Cc1csc([N+](=O)[O-])c1)C2 ZINC000614585365 479450194 /nfs/dbraw/zinc/45/01/94/479450194.db2.gz VIKULBHIJITAMW-INIZCTEOSA-N 1 1 329.381 2.752 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)c2ncnc3ccc([N+](=O)[O-])cc32)[C@H](C)C1 ZINC000611706643 479451819 /nfs/dbraw/zinc/45/18/19/479451819.db2.gz KUMMCZVXRVLCPF-MLGOLLRUSA-N 1 1 329.404 2.705 10 5 EFBEMO CC(C)c1ccc(C(=O)N2CC[NH+](CCCF)CC2)cc1[N+](=O)[O-] ZINC000600076889 479509504 /nfs/dbraw/zinc/50/95/04/479509504.db2.gz PPQZVCVRPXRQFO-UHFFFAOYSA-N 1 1 337.395 2.836 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000589502348 479532907 /nfs/dbraw/zinc/53/29/07/479532907.db2.gz VCBDVLPJZFGJDZ-CJNGLKHVSA-N 1 1 349.431 2.544 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2C2CCOCC2)c1 ZINC000589509532 479535764 /nfs/dbraw/zinc/53/57/64/479535764.db2.gz XODPCMALHXXPPG-MRXNPFEDSA-N 1 1 348.399 2.772 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)c1 ZINC000589514747 479537548 /nfs/dbraw/zinc/53/75/48/479537548.db2.gz KFRFFYULSDXLRL-MRXNPFEDSA-N 1 1 348.399 2.772 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](OCC3CC3)C2)c1 ZINC000589514747 479537555 /nfs/dbraw/zinc/53/75/55/479537555.db2.gz KFRFFYULSDXLRL-MRXNPFEDSA-N 1 1 348.399 2.772 10 5 EFBEMO COC(=O)c1oc(C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1C ZINC000597053793 479552150 /nfs/dbraw/zinc/55/21/50/479552150.db2.gz UAEGRGWZXBLXGF-UHFFFAOYSA-N 1 1 334.328 2.581 10 5 EFBEMO C[N@H+]1C[C@H]2CCN(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000590053069 479597324 /nfs/dbraw/zinc/59/73/24/479597324.db2.gz WIWMGAYCIPJWOS-RHSMWYFYSA-N 1 1 327.384 2.991 10 5 EFBEMO CN1C[C@H]2CC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000590053069 479597328 /nfs/dbraw/zinc/59/73/28/479597328.db2.gz WIWMGAYCIPJWOS-RHSMWYFYSA-N 1 1 327.384 2.991 10 5 EFBEMO CN1C[C@H]2CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000590053069 479597333 /nfs/dbraw/zinc/59/73/33/479597333.db2.gz WIWMGAYCIPJWOS-RHSMWYFYSA-N 1 1 327.384 2.991 10 5 EFBEMO C[N@H+]1C[C@@H]2CCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)[C@@H]2C1 ZINC000590052432 479597594 /nfs/dbraw/zinc/59/75/94/479597594.db2.gz BXPBQPVXVIYPNB-SUMWQHHRSA-N 1 1 327.384 2.991 10 5 EFBEMO CN1C[C@@H]2CC[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)[C@@H]2C1 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ZINC000774910510 581503992 /nfs/dbraw/zinc/50/39/92/581503992.db2.gz CFIMNSORQZUTMM-OCCSQVGLSA-N 1 1 335.360 2.752 10 5 EFBEMO CCC[N@H+](CCNC(=O)c1ccncc1)Cc1ccccc1[N+](=O)[O-] ZINC001691174187 1248506359 /nfs/dbraw/zinc/50/63/59/1248506359.db2.gz RASNLPJBCLVGLG-UHFFFAOYSA-N 1 1 342.399 2.632 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1ccncc1)Cc1ccccc1[N+](=O)[O-] ZINC001691174187 1248506364 /nfs/dbraw/zinc/50/63/64/1248506364.db2.gz RASNLPJBCLVGLG-UHFFFAOYSA-N 1 1 342.399 2.632 10 5 EFBEMO Cc1ccoc1C(=O)NCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001691201500 1248530999 /nfs/dbraw/zinc/53/09/99/1248530999.db2.gz MCFTZKAFVFUICP-UHFFFAOYSA-N 1 1 343.383 2.891 10 5 EFBEMO CN(CCC[N@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)C1CC=CC1 ZINC001484736399 1252872090 /nfs/dbraw/zinc/87/20/90/1252872090.db2.gz MTVIGVJLKVLJLZ-UHFFFAOYSA-N 1 1 337.445 2.903 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)C1CC=CC1 ZINC001484736399 1252872103 /nfs/dbraw/zinc/87/21/03/1252872103.db2.gz MTVIGVJLKVLJLZ-UHFFFAOYSA-N 1 1 337.445 2.903 10 5 EFBEMO COC(=O)/C=C/c1ccc(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000742412367 1270039941 /nfs/dbraw/zinc/03/99/41/1270039941.db2.gz PUNJFXNVONRXBM-RCOIXESOSA-N 1 1 333.388 2.676 10 5 EFBEMO CCC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](CC)C(=O)OCC ZINC001169234141 1272747985 /nfs/dbraw/zinc/74/79/85/1272747985.db2.gz QGNFSDOJTVNYLS-HZPDHXFCSA-N 1 1 338.404 2.682 10 5 EFBEMO CCC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](CC)C(=O)OCC ZINC001169234141 1272747995 /nfs/dbraw/zinc/74/79/95/1272747995.db2.gz QGNFSDOJTVNYLS-HZPDHXFCSA-N 1 1 338.404 2.682 10 5 EFBEMO O=C1O[C@@H](C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CN1C1CC1 ZINC000844338534 1278897199 /nfs/dbraw/zinc/89/71/99/1278897199.db2.gz QLUVDNPREBYHNY-PBHICJAKSA-N 1 1 345.399 2.757 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC001143982882 1278989495 /nfs/dbraw/zinc/98/94/95/1278989495.db2.gz WBJIVMOOBJYNEU-GASCZTMLSA-N 1 1 348.447 2.728 10 5 EFBEMO CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CC[N@H+]1CC[C@H](F)C1 ZINC001136153817 1276544268 /nfs/dbraw/zinc/54/42/68/1276544268.db2.gz VTAMHNRNIIMZLI-LBPRGKRZSA-N 1 1 343.786 2.641 10 5 EFBEMO Cc1nn(C[N@H+]2CC[C@@]3(C2)CCCOC3)c2ccc([N+](=O)[O-])cc12 ZINC000789566069 1276816686 /nfs/dbraw/zinc/81/66/86/1276816686.db2.gz NVRNKZRREYJJGR-QGZVFWFLSA-N 1 1 330.388 2.713 10 5 EFBEMO C[N@H+]1C[C@@H]2CCCN(c3ccc([N+](=O)[O-])cc3Br)[C@@H]2C1 ZINC000819952488 1276965765 /nfs/dbraw/zinc/96/57/65/1276965765.db2.gz AYMFCRKDLYIKHB-IINYFYTJSA-N 1 1 340.221 2.888 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC000923271823 1277442287 /nfs/dbraw/zinc/44/22/87/1277442287.db2.gz WBQXTPMEGNOWRG-HSYXRWIHSA-N 1 1 329.400 2.693 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCC[C@]4(CC4(F)F)C3)n2)c1 ZINC000844748404 1279216935 /nfs/dbraw/zinc/21/69/35/1279216935.db2.gz SEKTVCGPIMDEKV-HNNXBMFYSA-N 1 1 349.341 2.932 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@]4(CC4(F)F)C3)n2)c1 ZINC000844748404 1279216940 /nfs/dbraw/zinc/21/69/40/1279216940.db2.gz SEKTVCGPIMDEKV-HNNXBMFYSA-N 1 1 349.341 2.932 10 5 EFBEMO Cn1cc(C[NH2+]Cc2cccnc2F)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000793285867 1279494948 /nfs/dbraw/zinc/49/49/48/1279494948.db2.gz YHQWASVTIZDFKJ-UHFFFAOYSA-N 1 1 341.346 2.819 10 5 EFBEMO CN(C)CC[NH+]1CCC(Nc2cc(Cl)c(F)cc2[N+](=O)[O-])CC1 ZINC000845465640 1279660325 /nfs/dbraw/zinc/66/03/25/1279660325.db2.gz MMNZENPUDUBBLQ-UHFFFAOYSA-N 1 1 344.818 2.825 10 5 EFBEMO C[C@H]1O[C@@H](C)[C@H](C)[C@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001175301178 1287370456 /nfs/dbraw/zinc/37/04/56/1287370456.db2.gz OAHLIGBHKFXACP-KIGUWFBYSA-N 1 1 332.360 2.546 10 5 EFBEMO COCC[N@H+]1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)C(C)(C)C1 ZINC000846103626 1280035279 /nfs/dbraw/zinc/03/52/79/1280035279.db2.gz SFCXUSWSOSYRGA-UHFFFAOYSA-N 1 1 341.839 2.791 10 5 EFBEMO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCCN2Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000846227182 1280077689 /nfs/dbraw/zinc/07/76/89/1280077689.db2.gz IQKFRPONQJJMAO-DJIMGWMZSA-N 1 1 337.395 2.595 10 5 EFBEMO CC(C)C[N@H+]1CCO[C@H](CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872017817 1287400270 /nfs/dbraw/zinc/40/02/70/1287400270.db2.gz FHYSWOTYYNFRBZ-UONOGXRCSA-N 1 1 339.411 2.741 10 5 EFBEMO C[C@H]([NH2+]C[C@@H](O)COc1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020233 1287401291 /nfs/dbraw/zinc/40/12/91/1287401291.db2.gz FXVUZJHDARROLF-QWHCGFSZSA-N 1 1 334.347 2.824 10 5 EFBEMO C[C@@H]([NH2+]C[C@@H](O)COc1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020231 1287401621 /nfs/dbraw/zinc/40/16/21/1287401621.db2.gz FXVUZJHDARROLF-CHWSQXEVSA-N 1 1 334.347 2.824 10 5 EFBEMO C[C@H]([NH2+][C@@H](CO)C[C@H](O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052501 1287413252 /nfs/dbraw/zinc/41/32/52/1287413252.db2.gz SNUBTJLOIBBWMU-QEORTHHSSA-N 1 1 348.374 2.869 10 5 EFBEMO C[C@H]([NH2+][C@H](CO)C[C@H](O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052500 1287413273 /nfs/dbraw/zinc/41/32/73/1287413273.db2.gz SNUBTJLOIBBWMU-JDFRZJQESA-N 1 1 348.374 2.869 10 5 EFBEMO C[C@@H](NCCC[N@H+]1CCCO[C@@H](C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872065564 1287417466 /nfs/dbraw/zinc/41/74/66/1287417466.db2.gz DNRUMIXCJJTFDS-UONOGXRCSA-N 1 1 339.411 2.885 10 5 EFBEMO C[C@H]([NH2+]CC1(CS(C)(=O)=O)CCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872079799 1287422089 /nfs/dbraw/zinc/42/20/89/1287422089.db2.gz KLUGNUKYYUJIAV-NSHDSACASA-N 1 1 344.408 2.599 10 5 EFBEMO NC(=O)c1ccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c([N+](=O)[O-])c1 ZINC000872280392 1287519147 /nfs/dbraw/zinc/51/91/47/1287519147.db2.gz RBFCQRLAKAYKMF-INIZCTEOSA-N 1 1 347.415 2.617 10 5 EFBEMO C[N@H+]1CCCC[C@H]1CCOC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000808563287 1281797991 /nfs/dbraw/zinc/79/79/91/1281797991.db2.gz JZPMKBWIOXNLKU-NSHDSACASA-N 1 1 342.342 2.833 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC3(C2)Oc2ccccc2O3)cc1 ZINC000808792431 1281901875 /nfs/dbraw/zinc/90/18/75/1281901875.db2.gz ISHZNVZGQKQKRL-OAHLLOKOSA-N 1 1 342.351 2.502 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC3(C2)Oc2ccccc2O3)cc1 ZINC000808792431 1281901882 /nfs/dbraw/zinc/90/18/82/1281901882.db2.gz ISHZNVZGQKQKRL-OAHLLOKOSA-N 1 1 342.351 2.502 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000810761698 1283607425 /nfs/dbraw/zinc/60/74/25/1283607425.db2.gz POTDBEORCRJURM-INIZCTEOSA-N 1 1 349.366 2.622 10 5 EFBEMO CC(C)([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(F)cc1F ZINC001176174747 1287728144 /nfs/dbraw/zinc/72/81/44/1287728144.db2.gz GHLHMOYGLIMMPR-UHFFFAOYSA-N 1 1 349.337 2.997 10 5 EFBEMO Nc1[nH+]ccc2c1CN(c1ccc([N+](=O)[O-])c(OC(F)F)c1)CC2 ZINC000952993038 1284969527 /nfs/dbraw/zinc/96/95/27/1284969527.db2.gz VHKCSVRYQRFZOA-UHFFFAOYSA-N 1 1 336.298 2.736 10 5 EFBEMO CC(C)[N@@H+](Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)[C@@H]1CCOC1 ZINC000812290916 1285027943 /nfs/dbraw/zinc/02/79/43/1285027943.db2.gz IQZAISPKAKQKHZ-QGZVFWFLSA-N 1 1 330.388 2.915 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000747831286 1285578414 /nfs/dbraw/zinc/57/84/14/1285578414.db2.gz LVICILGUUVPLQV-GJZGRUSLSA-N 1 1 344.415 2.959 10 5 EFBEMO C[C@H](COC(=O)[C@H](C)[NH+]1CCC(Cc2ccccc2)CC1)[N+](=O)[O-] ZINC000813101905 1285651412 /nfs/dbraw/zinc/65/14/12/1285651412.db2.gz LFMNCEAHHNWJQY-CABCVRRESA-N 1 1 334.416 2.538 10 5 EFBEMO CCCCOCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171467 1285703001 /nfs/dbraw/zinc/70/30/01/1285703001.db2.gz WJFTYBAJBCTIJX-INIZCTEOSA-N 1 1 336.388 2.529 10 5 EFBEMO CCCCOCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171467 1285703006 /nfs/dbraw/zinc/70/30/06/1285703006.db2.gz WJFTYBAJBCTIJX-INIZCTEOSA-N 1 1 336.388 2.529 10 5 EFBEMO O=C(CCOCC1CC1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172160 1285703100 /nfs/dbraw/zinc/70/31/00/1285703100.db2.gz GSBCWGLAQOAQQN-KRWDZBQOSA-N 1 1 348.399 2.529 10 5 EFBEMO O=C(CCOCC1CC1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172160 1285703106 /nfs/dbraw/zinc/70/31/06/1285703106.db2.gz GSBCWGLAQOAQQN-KRWDZBQOSA-N 1 1 348.399 2.529 10 5 EFBEMO CC1(OCC(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCC1 ZINC000813172883 1285703430 /nfs/dbraw/zinc/70/34/30/1285703430.db2.gz RVIQRQUILWLYTC-INIZCTEOSA-N 1 1 348.399 2.672 10 5 EFBEMO CC1(OCC(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCC1 ZINC000813172883 1285703434 /nfs/dbraw/zinc/70/34/34/1285703434.db2.gz RVIQRQUILWLYTC-INIZCTEOSA-N 1 1 348.399 2.672 10 5 EFBEMO CS[C@H](C)CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174106 1285703837 /nfs/dbraw/zinc/70/38/37/1285703837.db2.gz PTOWMGUNGIWIMG-DOMZBBRYSA-N 1 1 338.429 2.854 10 5 EFBEMO CS[C@H](C)CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174106 1285703840 /nfs/dbraw/zinc/70/38/40/1285703840.db2.gz PTOWMGUNGIWIMG-DOMZBBRYSA-N 1 1 338.429 2.854 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H]2CSC[C@@]2(C)C1 ZINC001176803158 1288127359 /nfs/dbraw/zinc/12/73/59/1288127359.db2.gz CRQLAFDYVGRTLS-BLLLJJGKSA-N 1 1 335.429 2.527 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H]2CSC[C@@]2(C)C1 ZINC001176803158 1288127365 /nfs/dbraw/zinc/12/73/65/1288127365.db2.gz CRQLAFDYVGRTLS-BLLLJJGKSA-N 1 1 335.429 2.527 10 5 EFBEMO COc1ccc(NC(=O)C[NH2+][C@H](C)c2ncccc2C)c([N+](=O)[O-])c1 ZINC001176897670 1288182448 /nfs/dbraw/zinc/18/24/48/1288182448.db2.gz NDTBGMYZYKXXKS-GFCCVEGCSA-N 1 1 344.371 2.596 10 5 EFBEMO O=C(CC[N@H+]1CCc2cc(O)ccc2C1)Nc1ccccc1[N+](=O)[O-] ZINC001177015839 1288228123 /nfs/dbraw/zinc/22/81/23/1288228123.db2.gz QIORLWHGWVCODD-UHFFFAOYSA-N 1 1 341.367 2.687 10 5 EFBEMO C[N@H+]1C[C@H]2CCN(C(=O)c3cc(Cl)cc(Cl)c3[N+](=O)[O-])[C@@H]2C1 ZINC000816952712 1288336983 /nfs/dbraw/zinc/33/69/83/1288336983.db2.gz QKJOPOTYGPERTI-PRHODGIISA-N 1 1 344.198 2.678 10 5 EFBEMO C[N@H+]1C[C@H]2CCN(C(=O)c3cc(Cl)cc(Cl)c3[N+](=O)[O-])[C@H]2C1 ZINC000816952711 1288337068 /nfs/dbraw/zinc/33/70/68/1288337068.db2.gz QKJOPOTYGPERTI-PELKAZGASA-N 1 1 344.198 2.678 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+](C(C)C)C1 ZINC001136452969 1288737055 /nfs/dbraw/zinc/73/70/55/1288737055.db2.gz PBYAFLZZKMJJJY-CYBMUJFWSA-N 1 1 337.395 2.893 10 5 EFBEMO Cc1[nH]c(CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c(C)[nH+]1 ZINC001178441844 1288771051 /nfs/dbraw/zinc/77/10/51/1288771051.db2.gz XPOWAJGRRIUAKH-SNVBAGLBSA-N 1 1 334.401 2.732 10 5 EFBEMO Cc1ccc(NCCNC(=O)c2cc([N+](=O)[O-])c(F)cc2C)[nH+]c1 ZINC001178609262 1288837000 /nfs/dbraw/zinc/83/70/00/1288837000.db2.gz IWTQFNHVMZYFTP-UHFFFAOYSA-N 1 1 332.335 2.588 10 5 EFBEMO CC[N@H+]1C[C@H](NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C(C)(C)C1 ZINC001178870037 1288950715 /nfs/dbraw/zinc/95/07/15/1288950715.db2.gz XBFFOIJRDQDEFH-HNNXBMFYSA-N 1 1 337.395 2.513 10 5 EFBEMO COc1cc(C[N@@H+](C)C[C@@](C)(O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000823604900 1289381570 /nfs/dbraw/zinc/38/15/70/1289381570.db2.gz GDRILFOVGGUHNB-GOSISDBHSA-N 1 1 330.384 2.943 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)C1=CCCC1 ZINC001273501660 1290644304 /nfs/dbraw/zinc/64/43/04/1290644304.db2.gz NABRTMSXEQAHKD-UHFFFAOYSA-N 1 1 331.416 2.985 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(NCC[N@H+]2CCC[C@H]2C)cc1C ZINC001185565912 1290712319 /nfs/dbraw/zinc/71/23/19/1290712319.db2.gz WMNMTEWYIAYJDV-CYBMUJFWSA-N 1 1 335.404 2.976 10 5 EFBEMO O=[N+]([O-])c1cnc2ccccc2c1N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC001186872769 1291030545 /nfs/dbraw/zinc/03/05/45/1291030545.db2.gz PVGRITZCFMROHG-HOTGVXAUSA-N 1 1 326.400 2.994 10 5 EFBEMO C[N@H+]1CCCC[C@H]1CCC(=O)OCCOc1ccc([N+](=O)[O-])cc1 ZINC000803854924 1313256297 /nfs/dbraw/zinc/25/62/97/1313256297.db2.gz ATSHTLSFPUPKFY-AWEZNQCLSA-N 1 1 336.388 2.781 10 5 EFBEMO C[N@H+]1CCCC[C@H]1CCC(=O)OCCOc1ccccc1[N+](=O)[O-] ZINC000803859938 1313266491 /nfs/dbraw/zinc/26/64/91/1313266491.db2.gz YZEADTBLEYLDGT-AWEZNQCLSA-N 1 1 336.388 2.781 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H](O)CCC2(O)CCC2)C2CC2)cc1 ZINC000930140943 1297239866 /nfs/dbraw/zinc/23/98/66/1297239866.db2.gz LOQKVRISACBIIW-KRWDZBQOSA-N 1 1 334.416 2.615 10 5 EFBEMO O=[N+]([O-])c1cccnc1N1CC[NH+](C[C@H]2CCCC3(CCC3)O2)CC1 ZINC000930680900 1297280884 /nfs/dbraw/zinc/28/08/84/1297280884.db2.gz PHAZRZHUZXODRW-OAHLLOKOSA-N 1 1 346.431 2.604 10 5 EFBEMO Cc1ccc(OCC[N@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776275770 1297342054 /nfs/dbraw/zinc/34/20/54/1297342054.db2.gz KZJQXKORVHYNSK-SFHVURJKSA-N 1 1 330.384 2.947 10 5 EFBEMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)N[C@H]1CC[N@@H+](C)[C@@H]1C ZINC000931627306 1297358250 /nfs/dbraw/zinc/35/82/50/1297358250.db2.gz ZMIYUBZZHAYHGL-KOLCDFICSA-N 1 1 326.784 2.771 10 5 EFBEMO Cc1ncc(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])n1C ZINC000689252087 1313496831 /nfs/dbraw/zinc/49/68/31/1313496831.db2.gz RBFFUENNNBQTCJ-UHFFFAOYSA-N 1 1 339.193 2.689 10 5 EFBEMO Cc1[nH+]cc(CNCc2ccc(Br)cc2[N+](=O)[O-])n1C ZINC000689252087 1313496835 /nfs/dbraw/zinc/49/68/35/1313496835.db2.gz RBFFUENNNBQTCJ-UHFFFAOYSA-N 1 1 339.193 2.689 10 5 EFBEMO C[C@@H](CCc1ccccc1[N+](=O)[O-])N[C@@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903975305 1313522540 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Cc1ccc(CC(=O)NCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC001267232584 1093301492 /nfs/dbraw/zinc/30/14/92/1093301492.db2.gz JKSADOVSLLNMQR-UHFFFAOYSA-N 1 1 347.440 2.755 10 5 EFBEMO Cc1ccc(CC(=O)NCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC001267232584 1093301495 /nfs/dbraw/zinc/30/14/95/1093301495.db2.gz JKSADOVSLLNMQR-UHFFFAOYSA-N 1 1 347.440 2.755 10 5 EFBEMO CCC[N@@H+](CCNC(=O)C(C)(C)F)Cc1ccc([N+](=O)[O-])cc1 ZINC001267309978 1093549390 /nfs/dbraw/zinc/54/93/90/1093549390.db2.gz XNVVCNZFEIKVCY-UHFFFAOYSA-N 1 1 325.384 2.671 10 5 EFBEMO Cc1coc(C(=O)NCC[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC001267331308 1093596255 /nfs/dbraw/zinc/59/62/55/1093596255.db2.gz DPBXYRMHTZQWFI-UHFFFAOYSA-N 1 1 343.383 2.891 10 5 EFBEMO Cc1coc(C(=O)NCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC001267331308 1093596261 /nfs/dbraw/zinc/59/62/61/1093596261.db2.gz DPBXYRMHTZQWFI-UHFFFAOYSA-N 1 1 343.383 2.891 10 5 EFBEMO C/C(=C\C(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000785336961 1094834959 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331.416 2.723 10 5 EFBEMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC001611165640 1098985681 /nfs/dbraw/zinc/98/56/81/1098985681.db2.gz QYGKZYXVGDHYGS-PBHICJAKSA-N 1 1 333.432 2.887 10 5 EFBEMO CC[C@H]1COC(C)(C)C[N@@H+]1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC001619854746 1099338228 /nfs/dbraw/zinc/33/82/28/1099338228.db2.gz UPFTYXVZYZQWPR-ZDUSSCGKSA-N 1 1 338.404 2.872 10 5 EFBEMO CC[C@H]1COC(C)(C)C[N@H+]1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC001619854746 1099338239 /nfs/dbraw/zinc/33/82/39/1099338239.db2.gz UPFTYXVZYZQWPR-ZDUSSCGKSA-N 1 1 338.404 2.872 10 5 EFBEMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@H](O)[C@@H]3CCCC[C@H]32)cc1 ZINC001620524139 1099359174 /nfs/dbraw/zinc/35/91/74/1099359174.db2.gz LUALHQVVLRTRBT-KURKYZTESA-N 1 1 334.416 2.989 10 5 EFBEMO Cc1ccc2nc(C[NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)cc(=O)n2c1 ZINC001620569291 1099360136 /nfs/dbraw/zinc/36/01/36/1099360136.db2.gz BLUULURPUMOLKJ-ZDUSSCGKSA-N 1 1 338.367 2.762 10 5 EFBEMO 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CCOC(=O)c1cc([N+](=O)[O-])c(NC[C@@H](C)[N@@H+](C)C2CC2)cc1C ZINC001642214724 1101199489 /nfs/dbraw/zinc/19/94/89/1101199489.db2.gz ONQMJZSPCFPVMT-GFCCVEGCSA-N 1 1 335.404 2.975 10 5 EFBEMO CCC[N@@H+](CC)CCNc1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-] ZINC001642356926 1101208489 /nfs/dbraw/zinc/20/84/89/1101208489.db2.gz WZAHIPDNJYLMDL-UHFFFAOYSA-N 1 1 347.375 2.617 10 5 EFBEMO C[N@@H+](CCSc1ccc([N+](=O)[O-])c(C(N)=O)c1)Cc1ccccc1 ZINC001642641451 1101230349 /nfs/dbraw/zinc/23/03/49/1101230349.db2.gz OILZYHSGPCAFJN-UHFFFAOYSA-N 1 1 345.424 2.918 10 5 EFBEMO O=C(c1cc(F)ccc1[N+](=O)[O-])N1CC[NH2+][C@H](c2ccccc2)C1 ZINC001642844061 1101247658 /nfs/dbraw/zinc/24/76/58/1101247658.db2.gz ZPHNBKNWAANUQX-HNNXBMFYSA-N 1 1 329.331 2.521 10 5 EFBEMO Cc1cc(N2CC[N@H+](C)C(C)(C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001642877204 1101252944 /nfs/dbraw/zinc/25/29/44/1101252944.db2.gz AMVCMYOOAJTCAZ-UHFFFAOYSA-N 1 1 341.415 2.891 10 5 EFBEMO CCC[N@H+]1CC[C@@H](Nc2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)C1 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NEHFEWIMQKCZAD-UHFFFAOYSA-N 1 1 347.337 2.875 10 5 EFBEMO C[N@@H+](CCNC(=O)CCCC(F)(F)F)Cc1ccccc1[N+](=O)[O-] ZINC001266328700 1101568456 /nfs/dbraw/zinc/56/84/56/1101568456.db2.gz NEHFEWIMQKCZAD-UHFFFAOYSA-N 1 1 347.337 2.875 10 5 EFBEMO CC1CCC([NH+]2CCN(Cc3cc(O)ccc3[N+](=O)[O-])CC2)CC1 ZINC001653388978 1101617546 /nfs/dbraw/zinc/61/75/46/1101617546.db2.gz QVFNNDOMCGUTAP-UHFFFAOYSA-N 1 1 333.432 2.997 10 5 EFBEMO C[N@H+]1CCN(Cc2cc([N+](=O)[O-])ccc2Br)C(C)(C)C1 ZINC001653797207 1101651828 /nfs/dbraw/zinc/65/18/28/1101651828.db2.gz YFZVODJSXZUWTB-UHFFFAOYSA-N 1 1 342.237 2.883 10 5 EFBEMO C[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCCC[C@@H]1O ZINC001653948506 1101662402 /nfs/dbraw/zinc/66/24/02/1101662402.db2.gz JCAIBCXXGZIRMJ-DOMZBBRYSA-N 1 1 346.387 2.628 10 5 EFBEMO Cc1ccccc1CC(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001266358483 1101700656 /nfs/dbraw/zinc/70/06/56/1101700656.db2.gz SRFVSMXUDAWOFU-UHFFFAOYSA-N 1 1 341.411 2.694 10 5 EFBEMO Cc1ccccc1CC(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001266358483 1101700668 /nfs/dbraw/zinc/70/06/68/1101700668.db2.gz SRFVSMXUDAWOFU-UHFFFAOYSA-N 1 1 341.411 2.694 10 5 EFBEMO Cc1nsc(C)c1C(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001266362647 1101724318 /nfs/dbraw/zinc/72/43/18/1101724318.db2.gz OWATWMOCPUNCHI-UHFFFAOYSA-N 1 1 348.428 2.530 10 5 EFBEMO Cc1nsc(C)c1C(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001266362647 1101724331 /nfs/dbraw/zinc/72/43/31/1101724331.db2.gz OWATWMOCPUNCHI-UHFFFAOYSA-N 1 1 348.428 2.530 10 5 EFBEMO C[C@@H]1CN(c2ccc(C(F)(F)F)cc2)C[C@@H](C)[NH+]1CC[N+](=O)[O-] ZINC001654614276 1101739279 /nfs/dbraw/zinc/73/92/79/1101739279.db2.gz BUMIAUDESDQBGU-VXGBXAGGSA-N 1 1 331.338 2.881 10 5 EFBEMO CCOC(=O)[C@@]1(F)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1CC ZINC001654755706 1101755022 /nfs/dbraw/zinc/75/50/22/1101755022.db2.gz GLUZCJGMBNYFHF-WMLDXEAASA-N 1 1 338.379 2.751 10 5 EFBEMO Nc1nnc([C@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)o1 ZINC001655205877 1101793724 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Nc1[nH+]ccc2c1CN(c1c(Br)cccc1[N+](=O)[O-])CC2 ZINC001655942491 1101914495 /nfs/dbraw/zinc/91/44/95/1101914495.db2.gz MGFPCRRFMDMUIU-UHFFFAOYSA-N 1 1 349.188 2.897 10 5 EFBEMO CN(C(=O)C[N@H+]1C[C@H]2[C@H]3CC[C@H](C3)[C@@]2(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC001656307322 1102031067 /nfs/dbraw/zinc/03/10/67/1102031067.db2.gz RKLWMCPLNMQZKT-BDEJMISXSA-N 1 1 343.427 2.926 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[NH2+]C3([C@@H]4CCCO4)CCC3)n2)cc1 ZINC001656523483 1102113052 /nfs/dbraw/zinc/11/30/52/1102113052.db2.gz LGCLCITWCXMWBA-AWEZNQCLSA-N 1 1 344.371 2.836 10 5 EFBEMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@]12CCC[C@H]1OCC2 ZINC001656558934 1102122577 /nfs/dbraw/zinc/12/25/77/1102122577.db2.gz UUGWQWFZWHOGPB-SJLPKXTDSA-N 1 1 347.415 2.814 10 5 EFBEMO O=[N+]([O-])c1cccc(N2CC[NH+](CCOCC3CCCC3)CC2)c1 ZINC001656976555 1102276540 /nfs/dbraw/zinc/27/65/40/1102276540.db2.gz GNNSFMWEHMZTQG-UHFFFAOYSA-N 1 1 333.432 2.924 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C1(C(=O)NCC2CC2)CCCC1 ZINC001657653855 1102400281 /nfs/dbraw/zinc/40/02/81/1102400281.db2.gz FYPASNHJLAUQRU-UHFFFAOYSA-N 1 1 347.415 2.532 10 5 EFBEMO C[C@]1([NH2+]Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CCO[C@@H]1C1CC1 ZINC001658211534 1102445651 /nfs/dbraw/zinc/44/56/51/1102445651.db2.gz QODHAWWZOSVEEN-WBVHZDCISA-N 1 1 344.371 2.692 10 5 EFBEMO CCC[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](CC)C(=O)OCC ZINC001658232182 1102447482 /nfs/dbraw/zinc/44/74/82/1102447482.db2.gz LEEHALHLARLNKO-JKSUJKDBSA-N 1 1 338.404 2.682 10 5 EFBEMO CCC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](CC)C(=O)OCC ZINC001658232182 1102447487 /nfs/dbraw/zinc/44/74/87/1102447487.db2.gz LEEHALHLARLNKO-JKSUJKDBSA-N 1 1 338.404 2.682 10 5 EFBEMO CCC[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H](CC)C(=O)OCC ZINC001658232181 1102448012 /nfs/dbraw/zinc/44/80/12/1102448012.db2.gz LEEHALHLARLNKO-HZPDHXFCSA-N 1 1 338.404 2.682 10 5 EFBEMO CCC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H](CC)C(=O)OCC ZINC001658232181 1102448020 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IOVIPZTXSLOFOZ-QMMMGPOBSA-N 1 1 340.792 2.994 10 5 EFBEMO CCCCCC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21 ZINC001266898729 1102632706 /nfs/dbraw/zinc/63/27/06/1102632706.db2.gz XXCOFVNPNOXQIO-VQFNDLOPSA-N 1 1 331.416 2.722 10 5 EFBEMO O=C(CC[N@H+]1CCCC[C@H]1[C@H]1CCCO1)Nc1ccc([N+](=O)[O-])cc1 ZINC001660627120 1102894984 /nfs/dbraw/zinc/89/49/84/1102894984.db2.gz ZURKWDBBVYBQFI-DLBZAZTESA-N 1 1 347.415 2.957 10 5 EFBEMO O=C(CC[N@H+]1CCCC[C@@]12CCOC2)Nc1ccccc1[N+](=O)[O-] ZINC001660666992 1102920131 /nfs/dbraw/zinc/92/01/31/1102920131.db2.gz ASCOXAOTKHVQST-KRWDZBQOSA-N 1 1 333.388 2.568 10 5 EFBEMO CC1(C(=O)NCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC001660684874 1102926044 /nfs/dbraw/zinc/92/60/44/1102926044.db2.gz CREIBODDJJVGKW-UHFFFAOYSA-N 1 1 331.416 2.866 10 5 EFBEMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@]12CCC[C@H]1OCC2 ZINC001660683236 1102926618 /nfs/dbraw/zinc/92/66/18/1102926618.db2.gz RRKUXBOGSNRGAC-SJLPKXTDSA-N 1 1 347.415 2.814 10 5 EFBEMO CN(CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1ccccc1F ZINC001271949481 1103170003 /nfs/dbraw/zinc/17/00/03/1103170003.db2.gz AVMYYYQPXJADQN-UHFFFAOYSA-N 1 1 345.374 2.938 10 5 EFBEMO CN(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1ccccc1F ZINC001271949481 1103170011 /nfs/dbraw/zinc/17/00/11/1103170011.db2.gz AVMYYYQPXJADQN-UHFFFAOYSA-N 1 1 345.374 2.938 10 5 EFBEMO Cc1nn(C[N@H+]2C[C@H]3C[C@@]3(c3ccccc3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000905682111 1103498416 /nfs/dbraw/zinc/49/84/16/1103498416.db2.gz PGKKUVVRQIEWCJ-BEFAXECRSA-N 1 1 349.394 2.879 10 5 EFBEMO Cn1ccc([C@H]2CCC[N@@H+](Cn3ncc4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000905720317 1103538819 /nfs/dbraw/zinc/53/88/19/1103538819.db2.gz VJDODQKFILMMEC-AWEZNQCLSA-N 1 1 340.387 2.515 10 5 EFBEMO Cn1ccc([C@@H]2CCC[N@@H+](Cn3ncc4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000905720322 1103539346 /nfs/dbraw/zinc/53/93/46/1103539346.db2.gz VJDODQKFILMMEC-CQSZACIVSA-N 1 1 340.387 2.515 10 5 EFBEMO CCC(CC)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21 ZINC001662021137 1103566987 /nfs/dbraw/zinc/56/69/87/1103566987.db2.gz HYNXZSOZBJIVDD-FVQHAEBGSA-N 1 1 331.416 2.577 10 5 EFBEMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)CCC1(O)CCC1 ZINC000905900577 1103710051 /nfs/dbraw/zinc/71/00/51/1103710051.db2.gz QLPFDIAQVBQSJW-CQSZACIVSA-N 1 1 342.823 2.736 10 5 EFBEMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)CCC1(O)CCC1 ZINC000905900577 1103710061 /nfs/dbraw/zinc/71/00/61/1103710061.db2.gz QLPFDIAQVBQSJW-CQSZACIVSA-N 1 1 342.823 2.736 10 5 EFBEMO C[N@H+](CCNC(=O)c1ccc(F)s1)Cc1ccccc1[N+](=O)[O-] ZINC001663343273 1104065163 /nfs/dbraw/zinc/06/51/63/1104065163.db2.gz ZSPUTSZLXWZEGW-UHFFFAOYSA-N 1 1 337.376 2.657 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccc(F)s1)Cc1ccccc1[N+](=O)[O-] ZINC001663343273 1104065174 /nfs/dbraw/zinc/06/51/74/1104065174.db2.gz ZSPUTSZLXWZEGW-UHFFFAOYSA-N 1 1 337.376 2.657 10 5 EFBEMO O=C(C=C1CCC1)NCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001663714824 1104197081 /nfs/dbraw/zinc/19/70/81/1104197081.db2.gz AAVXWPKRLXTONI-UHFFFAOYSA-N 1 1 329.400 2.786 10 5 EFBEMO Cc1ncc(C(=O)N(C)CC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)s1 ZINC001667540827 1105158462 /nfs/dbraw/zinc/15/84/62/1105158462.db2.gz JEFRRDQUURYIFA-UHFFFAOYSA-N 1 1 348.428 2.564 10 5 EFBEMO Cc1ncc(C(=O)N(C)CC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)s1 ZINC001667540827 1105158465 /nfs/dbraw/zinc/15/84/65/1105158465.db2.gz JEFRRDQUURYIFA-UHFFFAOYSA-N 1 1 348.428 2.564 10 5 EFBEMO CC(C)(C(=O)NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1)C(F)F ZINC001483056324 1107717285 /nfs/dbraw/zinc/71/72/85/1107717285.db2.gz DIVAGKXKOAXFGU-ARJAWSKDSA-N 1 1 347.387 2.710 10 5 EFBEMO Cc1cc(C(=O)NCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC001266255669 1108697555 /nfs/dbraw/zinc/69/75/55/1108697555.db2.gz YZHGODONOOEGDF-UHFFFAOYSA-N 1 1 331.372 2.666 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccoc1Cl)Cc1ccc([N+](=O)[O-])cc1 ZINC001266270510 1108748231 /nfs/dbraw/zinc/74/82/31/1108748231.db2.gz ULOVDOVUEIVOSW-UHFFFAOYSA-N 1 1 337.763 2.703 10 5 EFBEMO Cc1sccc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001266273454 1108756753 /nfs/dbraw/zinc/75/67/53/1108756753.db2.gz RUJOQGLDGXXXJA-UHFFFAOYSA-N 1 1 333.413 2.827 10 5 EFBEMO Cc1sccc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001266273454 1108756761 /nfs/dbraw/zinc/75/67/61/1108756761.db2.gz RUJOQGLDGXXXJA-UHFFFAOYSA-N 1 1 333.413 2.827 10 5 EFBEMO O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC([NH+]2CCCC2)C1 ZINC000898614463 1109030613 /nfs/dbraw/zinc/03/06/13/1109030613.db2.gz LFKRUTZDKCEHPW-UHFFFAOYSA-N 1 1 331.397 2.730 10 5 EFBEMO CCC1([NH+]2CCC2)CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])CC1 ZINC000899560458 1109391682 /nfs/dbraw/zinc/39/16/82/1109391682.db2.gz QUVGHMDSRTZQQD-UHFFFAOYSA-N 1 1 349.435 2.532 10 5 EFBEMO CC/C=C/CC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001483816057 1112485355 /nfs/dbraw/zinc/48/53/55/1112485355.db2.gz NAACJYYLTNUECO-GVKUHWBJSA-N 1 1 349.475 2.711 10 5 EFBEMO CC/C=C/CC[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001483816057 1112485356 /nfs/dbraw/zinc/48/53/56/1112485356.db2.gz NAACJYYLTNUECO-GVKUHWBJSA-N 1 1 349.475 2.711 10 5 EFBEMO CC/C=C/CC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001483816057 1112485358 /nfs/dbraw/zinc/48/53/58/1112485358.db2.gz NAACJYYLTNUECO-GVKUHWBJSA-N 1 1 349.475 2.711 10 5 EFBEMO C[NH+]1CCN(c2ccc([N+](=O)[O-])c(Nc3ccc(F)cc3)n2)CC1 ZINC000097673575 219045883 /nfs/dbraw/zinc/04/58/83/219045883.db2.gz NKUHMHSMVKSMAR-UHFFFAOYSA-N 1 1 331.351 2.624 10 5 EFBEMO C[N@H+](CC(=O)OC(C)(C)C)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000187668008 529840551 /nfs/dbraw/zinc/84/05/51/529840551.db2.gz ZTMGYPJYRYNPAC-UHFFFAOYSA-N 1 1 349.431 2.837 10 5 EFBEMO C[N@@H+](CC(=O)OC(C)(C)C)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000187668008 529840552 /nfs/dbraw/zinc/84/05/52/529840552.db2.gz ZTMGYPJYRYNPAC-UHFFFAOYSA-N 1 1 349.431 2.837 10 5 EFBEMO C[N@@H+](CCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)C1CCCC1 ZINC000104575206 219395688 /nfs/dbraw/zinc/39/56/88/219395688.db2.gz SNVUXHGZCXVVIF-UHFFFAOYSA-N 1 1 330.388 2.680 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]([C@H](O)c2nccn2C)C1 ZINC000183393106 235046857 /nfs/dbraw/zinc/04/68/57/235046857.db2.gz CYVQAPWVOVJUOW-WBVHZDCISA-N 1 1 344.415 2.582 10 5 EFBEMO COc1cc(C[N@H+]2C[C@H](O)C[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000411927345 243029629 /nfs/dbraw/zinc/02/96/29/243029629.db2.gz SBNUKHANVLMMHB-WBVHZDCISA-N 1 1 328.368 2.911 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+](C)[C@@H]2CCN(C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000246739290 243306391 /nfs/dbraw/zinc/30/63/91/243306391.db2.gz MROKTJXXKFFMSF-DZGCQCFKSA-N 1 1 348.447 2.646 10 5 EFBEMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000246745603 243306991 /nfs/dbraw/zinc/30/69/91/243306991.db2.gz BEEHLDFAXVWCJU-XHDPSFHLSA-N 1 1 339.823 2.636 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000246796428 243319569 /nfs/dbraw/zinc/31/95/69/243319569.db2.gz PHBNQBPSJKOPNO-GJZGRUSLSA-N 1 1 348.447 2.646 10 5 EFBEMO Cn1ccnc1[C@H]([NH2+][C@@H]1CCC[C@H](CO)C1)c1cccc([N+](=O)[O-])c1 ZINC000414327072 244089888 /nfs/dbraw/zinc/08/98/88/244089888.db2.gz BCSIDWWLHDRTIP-YSVLISHTSA-N 1 1 344.415 2.558 10 5 EFBEMO CN(C)C(=O)C1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000414485930 244190672 /nfs/dbraw/zinc/19/06/72/244190672.db2.gz MKWHGJIVRVOSAN-UHFFFAOYSA-N 1 1 329.356 2.565 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](N2CCCC2=O)CC1 ZINC000414547349 244224723 /nfs/dbraw/zinc/22/47/23/244224723.db2.gz IJYAQEKYMBIBBN-INIZCTEOSA-N 1 1 331.416 2.880 10 5 EFBEMO C[C@H](O)[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000414575977 244243978 /nfs/dbraw/zinc/24/39/78/244243978.db2.gz FSVBSRFCYSBQGN-LRDDRELGSA-N 1 1 348.424 2.905 10 5 EFBEMO C[C@H](O)[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000414575977 244243986 /nfs/dbraw/zinc/24/39/86/244243986.db2.gz FSVBSRFCYSBQGN-LRDDRELGSA-N 1 1 348.424 2.905 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000421885445 246152268 /nfs/dbraw/zinc/15/22/68/246152268.db2.gz GCQYHHDEXRCFCX-QGZVFWFLSA-N 1 1 339.395 2.998 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H](c3nnc[nH]3)C2)o1 ZINC000425355552 247055856 /nfs/dbraw/zinc/05/58/56/247055856.db2.gz MLFLFPMJFVTAMI-LBPRGKRZSA-N 1 1 339.355 2.962 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](c4nnc[nH]4)C3)o2)cc1 ZINC000425353510 247056523 /nfs/dbraw/zinc/05/65/23/247056523.db2.gz JEOPOROXEFEMBY-ZDUSSCGKSA-N 1 1 339.355 2.962 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000087324256 217724519 /nfs/dbraw/zinc/72/45/19/217724519.db2.gz MLDXQJONWFSBLY-RHSMWYFYSA-N 1 1 333.432 2.716 10 5 EFBEMO C[C@]1(CNC(=O)c2cc([N+](=O)[O-])c[nH]2)CCC[N@H+]1Cc1ccccc1 ZINC000426104534 247236702 /nfs/dbraw/zinc/23/67/02/247236702.db2.gz YVIOPXLHSQCHHB-GOSISDBHSA-N 1 1 342.399 2.707 10 5 EFBEMO C[C@@]1(CNC(=O)c2cc([N+](=O)[O-])c[nH]2)CCC[N@H+]1Cc1ccccc1 ZINC000426104539 247236863 /nfs/dbraw/zinc/23/68/63/247236863.db2.gz YVIOPXLHSQCHHB-SFHVURJKSA-N 1 1 342.399 2.707 10 5 EFBEMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC(C)=C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000430283303 247761048 /nfs/dbraw/zinc/76/10/48/247761048.db2.gz JAXDNOCKEFGBIZ-WCQYABFASA-N 1 1 333.388 2.828 10 5 EFBEMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC(C)=C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000430283303 247761050 /nfs/dbraw/zinc/76/10/50/247761050.db2.gz JAXDNOCKEFGBIZ-WCQYABFASA-N 1 1 333.388 2.828 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433303040 248041226 /nfs/dbraw/zinc/04/12/26/248041226.db2.gz ZMEHQOZKCSQXDC-CQSZACIVSA-N 1 1 347.802 2.899 10 5 EFBEMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000266512238 248338980 /nfs/dbraw/zinc/33/89/80/248338980.db2.gz GYRFIAZUYMZOMW-MQVJKMGUSA-N 1 1 346.431 2.752 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441209082 250008713 /nfs/dbraw/zinc/00/87/13/250008713.db2.gz RVLYZGVMYPDBAX-KFWWJZLASA-N 1 1 347.415 2.670 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]([C@@H]4CCOC4)C3)nc2c1 ZINC000441212574 250008794 /nfs/dbraw/zinc/00/87/94/250008794.db2.gz UIKDWWBAYLIPGV-CHWSQXEVSA-N 1 1 331.372 2.985 10 5 EFBEMO CC1(C)CCC[N@@H+](CCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000444605745 250315898 /nfs/dbraw/zinc/31/58/98/250315898.db2.gz DDXRXJMUHSQKAT-UHFFFAOYSA-N 1 1 344.415 2.928 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC[N@H+]1C ZINC000267440412 251059744 /nfs/dbraw/zinc/05/97/44/251059744.db2.gz YROUQKYSNGCHLO-QWRGUYRKSA-N 1 1 325.796 2.803 10 5 EFBEMO C[C@@H]1CN(CC(F)(F)F)CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000449663633 251103969 /nfs/dbraw/zinc/10/39/69/251103969.db2.gz KCHTXRYYRHXSPQ-LBPRGKRZSA-N 1 1 331.338 2.911 10 5 EFBEMO C[C@@H]1CN(CC(F)(F)F)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000449663633 251103975 /nfs/dbraw/zinc/10/39/75/251103975.db2.gz KCHTXRYYRHXSPQ-LBPRGKRZSA-N 1 1 331.338 2.911 10 5 EFBEMO C[C@H]1OCC[C@H]1[N@@H+](CCO)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000449676596 251113573 /nfs/dbraw/zinc/11/35/73/251113573.db2.gz IJLPYZUWBSHBMR-CXAGYDPISA-N 1 1 346.383 2.827 10 5 EFBEMO COC[C@@H]1CCC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000449776932 251151457 /nfs/dbraw/zinc/15/14/57/251151457.db2.gz PIDQNTXPRGNPCQ-CYBMUJFWSA-N 1 1 338.404 2.861 10 5 EFBEMO COc1ccc(N2CC[NH+](Cc3cccc([N+](=O)[O-])c3C)CC2)nc1 ZINC000452054366 251770326 /nfs/dbraw/zinc/77/03/26/251770326.db2.gz FZABQFNKBLRUEP-UHFFFAOYSA-N 1 1 342.399 2.629 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117756455 221086899 /nfs/dbraw/zinc/08/68/99/221086899.db2.gz GMILBGGMRMHLGW-GFCCVEGCSA-N 1 1 339.823 2.781 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000119212583 221267052 /nfs/dbraw/zinc/26/70/52/221267052.db2.gz PWOPUFVANDRFCS-OAHLLOKOSA-N 1 1 344.415 2.561 10 5 EFBEMO C[C@@H]([NH2+]CC(=O)NCc1cc(F)cc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000342310238 145097799 /nfs/dbraw/zinc/09/77/99/145097799.db2.gz VVLBKOSXNIOYAA-LLVKDONJSA-N 1 1 349.337 2.840 10 5 EFBEMO C[C@H]([NH2+]CC(=O)NCc1cc(F)cc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000342310241 145098273 /nfs/dbraw/zinc/09/82/73/145098273.db2.gz VVLBKOSXNIOYAA-NSHDSACASA-N 1 1 349.337 2.840 10 5 EFBEMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000343622372 145255252 /nfs/dbraw/zinc/25/52/52/145255252.db2.gz WLXHXRSVUYBIPH-ZDUSSCGKSA-N 1 1 343.383 2.802 10 5 EFBEMO C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@H]1CC=CCC1 ZINC000344063903 145359250 /nfs/dbraw/zinc/35/92/50/145359250.db2.gz OFZFRDCOTCVWEC-AWEZNQCLSA-N 1 1 329.400 2.772 10 5 EFBEMO Cc1nn(-c2ccncc2)cc1C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000344096634 145367214 /nfs/dbraw/zinc/36/72/14/145367214.db2.gz CBBJBZNVUZJKRQ-UHFFFAOYSA-N 1 1 337.383 2.816 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[NH2+][C@H](CO)c2ccsc2)cccc1[N+](=O)[O-] ZINC000352033090 146271388 /nfs/dbraw/zinc/27/13/88/146271388.db2.gz QJUZJBSSIJWMAK-BXUZGUMPSA-N 1 1 349.412 2.615 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[NH2+][C@@H](CO)c2ccsc2)cccc1[N+](=O)[O-] ZINC000352033091 146271393 /nfs/dbraw/zinc/27/13/93/146271393.db2.gz QJUZJBSSIJWMAK-FZMZJTMJSA-N 1 1 349.412 2.615 10 5 EFBEMO COc1cc(C[N@H+]2CCSC3(CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000352037972 146273153 /nfs/dbraw/zinc/27/31/53/146273153.db2.gz BUWIMERARQTDCJ-UHFFFAOYSA-N 1 1 338.429 2.701 10 5 EFBEMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+]1C ZINC000356396944 147234115 /nfs/dbraw/zinc/23/41/15/147234115.db2.gz VJVMIQXGPKLAGC-ZDUSSCGKSA-N 1 1 337.445 2.921 10 5 EFBEMO CC[N@@H+](CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)C1CC1 ZINC000356807361 147340845 /nfs/dbraw/zinc/34/08/45/147340845.db2.gz KYRZYYAMRVEPTK-UHFFFAOYSA-N 1 1 342.193 2.780 10 5 EFBEMO C[C@H]1CC[C@]2(CC[N@@H+](CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)C2)C1 ZINC000359563517 148124336 /nfs/dbraw/zinc/12/43/36/148124336.db2.gz SPECMNDMJPOQPG-LIRRHRJNSA-N 1 1 343.427 2.996 10 5 EFBEMO COc1cc(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc([N+](=O)[O-])c1C ZINC000359635966 148146982 /nfs/dbraw/zinc/14/69/82/148146982.db2.gz OQSQAIBBBBMHGW-BETUJISGSA-N 1 1 349.431 2.905 10 5 EFBEMO COc1ccc(C[N@H+]2CCC[C@H](c3ccncn3)C2)cc1[N+](=O)[O-] ZINC000364358173 149134762 /nfs/dbraw/zinc/13/47/62/149134762.db2.gz JFGDZFPAEUCKPR-AWEZNQCLSA-N 1 1 328.372 2.773 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1C[C@H]2CCCC[C@H]21 ZINC000368082481 150031039 /nfs/dbraw/zinc/03/10/39/150031039.db2.gz WDFCZKIFUGHILB-YWPYICTPSA-N 1 1 333.388 2.805 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1C[C@H]2CCCC[C@H]21 ZINC000368082481 150031043 /nfs/dbraw/zinc/03/10/43/150031043.db2.gz WDFCZKIFUGHILB-YWPYICTPSA-N 1 1 333.388 2.805 10 5 EFBEMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2C[C@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000368092091 150034466 /nfs/dbraw/zinc/03/44/66/150034466.db2.gz IWMMUFLBWBZNJZ-YWPYICTPSA-N 1 1 333.388 2.805 10 5 EFBEMO COc1ccc(NC(=O)[C@H](C)[N@H+]2C[C@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000368092091 150034469 /nfs/dbraw/zinc/03/44/69/150034469.db2.gz IWMMUFLBWBZNJZ-YWPYICTPSA-N 1 1 333.388 2.805 10 5 EFBEMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000368092165 150034529 /nfs/dbraw/zinc/03/45/29/150034529.db2.gz JIHNZWBOSMYMEU-MRVPVSSYSA-N 1 1 335.751 2.650 10 5 EFBEMO COCC[C@H]1CCCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000368656641 150172642 /nfs/dbraw/zinc/17/26/42/150172642.db2.gz ZJRSTMMSZACZJD-OAHLLOKOSA-N 1 1 349.431 2.696 10 5 EFBEMO C[C@@H]1C[C@@]2(CCO1)C[N@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@H](C)O2 ZINC000374012916 151268086 /nfs/dbraw/zinc/26/80/86/151268086.db2.gz GKXMGZHTYPRVPI-VKJFTORMSA-N 1 1 334.416 2.796 10 5 EFBEMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCO[C@H](C)C2)O1 ZINC000374012912 151268176 /nfs/dbraw/zinc/26/81/76/151268176.db2.gz GKXMGZHTYPRVPI-RKVPGOIHSA-N 1 1 334.416 2.796 10 5 EFBEMO Cn1cc([C@@H](O)C[C@@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])cn1 ZINC000378365015 152068218 /nfs/dbraw/zinc/06/82/18/152068218.db2.gz SSOQVZXPSPFGTN-RDJZCZTQSA-N 1 1 348.378 2.556 10 5 EFBEMO Cn1cc([C@H](O)C[C@@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])cn1 ZINC000378365013 152068277 /nfs/dbraw/zinc/06/82/77/152068277.db2.gz SSOQVZXPSPFGTN-DOTOQJQBSA-N 1 1 348.378 2.556 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1C ZINC000158423748 225012922 /nfs/dbraw/zinc/01/29/22/225012922.db2.gz CRFATLYMZVHSDA-JQWIXIFHSA-N 1 1 325.796 2.803 10 5 EFBEMO C[C@@H]1C[C@@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000123968111 222359528 /nfs/dbraw/zinc/35/95/28/222359528.db2.gz ODIJUXGRFMDPIS-YPMHNXCESA-N 1 1 339.823 2.732 10 5 EFBEMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](CNc3ccccn3)C2)cc1 ZINC000171641879 227192056 /nfs/dbraw/zinc/19/20/56/227192056.db2.gz KJLGQDLYGNEXPC-INIZCTEOSA-N 1 1 326.400 2.966 10 5 EFBEMO CCN(CC)C(=O)[C@@H]1CCC[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000092509882 544547649 /nfs/dbraw/zinc/54/76/49/544547649.db2.gz OCVXZRZJHSWPPI-JEJOPICUSA-N 1 1 331.416 2.941 10 5 EFBEMO CCN(CC)C(=O)[C@@H]1CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000092509882 544547653 /nfs/dbraw/zinc/54/76/53/544547653.db2.gz OCVXZRZJHSWPPI-JEJOPICUSA-N 1 1 331.416 2.941 10 5 EFBEMO O=[N+]([O-])c1cccc(F)c1OC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000184775730 265027162 /nfs/dbraw/zinc/02/71/62/265027162.db2.gz GHNKNESLCPMPRE-HNNXBMFYSA-N 1 1 346.358 2.532 10 5 EFBEMO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000191214262 265255832 /nfs/dbraw/zinc/25/58/32/265255832.db2.gz FTFJJRGOYCFMHV-XYPHTWIQSA-N 1 1 348.399 2.637 10 5 EFBEMO CC(C)c1nnc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000271685649 266042137 /nfs/dbraw/zinc/04/21/37/266042137.db2.gz DHYSYXJFCLMTGK-JTQLQIEISA-N 1 1 349.416 2.859 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000272324096 266229093 /nfs/dbraw/zinc/22/90/93/266229093.db2.gz LPPKSHIEMZCTFT-GOEBONIOSA-N 1 1 349.431 2.571 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000272324096 266229096 /nfs/dbraw/zinc/22/90/96/266229096.db2.gz LPPKSHIEMZCTFT-GOEBONIOSA-N 1 1 349.431 2.571 10 5 EFBEMO CC[C@@H](NC(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000272778246 266379881 /nfs/dbraw/zinc/37/98/81/266379881.db2.gz RCILCKIAMKEGMD-SUMWQHHRSA-N 1 1 346.431 2.996 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1[C@H](C)C[NH+](C)C[C@H]1C ZINC000275730271 266865026 /nfs/dbraw/zinc/86/50/26/266865026.db2.gz AHALGOPKEPJIJK-GHMZBOCLSA-N 1 1 325.796 2.721 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cc(C)c2F)[C@H](C)C1 ZINC000277727521 267246127 /nfs/dbraw/zinc/24/61/27/267246127.db2.gz PWQFDYQVGSMZHV-IUODEOHRSA-N 1 1 337.395 2.845 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000277988741 267315675 /nfs/dbraw/zinc/31/56/75/267315675.db2.gz NARCOAAHMMKYMW-GFCCVEGCSA-N 1 1 339.823 2.970 10 5 EFBEMO CC[N@H+]1CCC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000194319350 273068397 /nfs/dbraw/zinc/06/83/97/273068397.db2.gz YYIRAUZEWNAUET-JTQLQIEISA-N 1 1 326.784 2.854 10 5 EFBEMO C[C@H](Nc1ccc2c(c1)C[N@H+](C)C2)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000194517777 273069872 /nfs/dbraw/zinc/06/98/72/273069872.db2.gz TXNMHPNXZHAFRI-LBPRGKRZSA-N 1 1 340.383 2.979 10 5 EFBEMO C[C@@H](Nc1ccc2c(c1)C[N@H+](C)C2)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000194517789 273069890 /nfs/dbraw/zinc/06/98/90/273069890.db2.gz TXNMHPNXZHAFRI-GFCCVEGCSA-N 1 1 340.383 2.979 10 5 EFBEMO Cc1ccc(NCCCNC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000279361709 273206811 /nfs/dbraw/zinc/20/68/11/273206811.db2.gz GDWRSMZTINAWDW-GJZGRUSLSA-N 1 1 348.447 2.552 10 5 EFBEMO O=C1C[C@]2(CC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)CN1 ZINC000279384511 273209480 /nfs/dbraw/zinc/20/94/80/273209480.db2.gz JNDZWGGZKZNDRC-GOSISDBHSA-N 1 1 341.367 2.567 10 5 EFBEMO O=C1C[C@@]2(CC[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)CN1 ZINC000279523614 273224290 /nfs/dbraw/zinc/22/42/90/273224290.db2.gz YOBVOHGSRNUJKD-SFHVURJKSA-N 1 1 341.367 2.567 10 5 EFBEMO Cc1nn(C)c(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c1[N+](=O)[O-] ZINC000282058750 273508528 /nfs/dbraw/zinc/50/85/28/273508528.db2.gz YGFHVFHTNYCNBU-ZDUSSCGKSA-N 1 1 344.419 2.554 10 5 EFBEMO C[C@@H]1CCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000154906771 274292821 /nfs/dbraw/zinc/29/28/21/274292821.db2.gz DNOAMBPDXJDSTM-GFCCVEGCSA-N 1 1 334.376 2.956 10 5 EFBEMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000419009600 274362984 /nfs/dbraw/zinc/36/29/84/274362984.db2.gz WIPJZUNBGRUFAC-GHMZBOCLSA-N 1 1 347.337 2.505 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[NH2+][C@H]1CCOc3ccccc31)OCO2 ZINC000095385681 275033963 /nfs/dbraw/zinc/03/39/63/275033963.db2.gz OBMPEYSUWRLSJV-ZDUSSCGKSA-N 1 1 328.324 2.937 10 5 EFBEMO CC(C)c1ccc(C[N@H+]2CC[C@H](N3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000121026269 276053143 /nfs/dbraw/zinc/05/31/43/276053143.db2.gz LBFYUHDDARFIHQ-INIZCTEOSA-N 1 1 333.432 2.625 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000184262762 276225546 /nfs/dbraw/zinc/22/55/46/276225546.db2.gz MVIVXIBHTRUGFP-DOMZBBRYSA-N 1 1 339.411 2.905 10 5 EFBEMO COc1cc(N2CCC[C@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1F ZINC000375949224 277381670 /nfs/dbraw/zinc/38/16/70/277381670.db2.gz SJKVPGDTBFOXEF-NSHDSACASA-N 1 1 334.351 2.860 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC2(CCOCC2)[C@H]1C ZINC000375240016 278157091 /nfs/dbraw/zinc/15/70/91/278157091.db2.gz HFSNIROPFXUPCR-ZIAGYGMSSA-N 1 1 347.415 2.813 10 5 EFBEMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000152708392 293345694 /nfs/dbraw/zinc/34/56/94/293345694.db2.gz BYYXZSISKAEZSQ-MRXNPFEDSA-N 1 1 334.420 2.514 10 5 EFBEMO Cc1cccc(OC[C@H](O)C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000153356842 293371827 /nfs/dbraw/zinc/37/18/27/293371827.db2.gz NNLOVFNZVKRVKW-MRXNPFEDSA-N 1 1 342.395 2.701 10 5 EFBEMO Cc1cccc(OC[C@H](O)C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000153356842 293371829 /nfs/dbraw/zinc/37/18/29/293371829.db2.gz NNLOVFNZVKRVKW-MRXNPFEDSA-N 1 1 342.395 2.701 10 5 EFBEMO CC(=O)N[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000153890294 293399056 /nfs/dbraw/zinc/39/90/56/293399056.db2.gz WICFXUGWROHNAJ-OAHLLOKOSA-N 1 1 343.383 2.955 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1OC(=O)[C@@]1(F)CC[N@@H+](C(C)(C)C)C1 ZINC000290623518 294138921 /nfs/dbraw/zinc/13/89/21/294138921.db2.gz XGJSWZFCZGOMSK-MRXNPFEDSA-N 1 1 340.351 2.721 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1OC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC000290623518 294138924 /nfs/dbraw/zinc/13/89/24/294138924.db2.gz XGJSWZFCZGOMSK-MRXNPFEDSA-N 1 1 340.351 2.721 10 5 EFBEMO Cn1cc([C@H](O)C[C@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])cn1 ZINC000378365014 294294824 /nfs/dbraw/zinc/29/48/24/294294824.db2.gz SSOQVZXPSPFGTN-NVXWUHKLSA-N 1 1 348.378 2.556 10 5 EFBEMO COc1ccc(NC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000291207275 294310283 /nfs/dbraw/zinc/31/02/83/294310283.db2.gz GSKHENSANLVGHG-MRXNPFEDSA-N 1 1 339.367 2.754 10 5 EFBEMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000291369416 294361369 /nfs/dbraw/zinc/36/13/69/294361369.db2.gz AGTAFMQOXHSEQQ-VIFPVBQESA-N 1 1 346.214 2.973 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCOC[C@@H](O)C2)s1 ZINC000294902643 295243487 /nfs/dbraw/zinc/24/34/87/295243487.db2.gz XJUBFXGZTWURHF-LBPRGKRZSA-N 1 1 334.397 2.516 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+](C2CC2)C[C@H](C)C1 ZINC000295765428 295372939 /nfs/dbraw/zinc/37/29/39/295372939.db2.gz WHWKDFHVCVSMAZ-AYYGCFCKSA-N 1 1 343.427 2.941 10 5 EFBEMO Cn1ccnc1[C@H]([NH2+][C@@H]1CCC[C@@H](CO)C1)c1cccc([N+](=O)[O-])c1 ZINC000414327069 303004707 /nfs/dbraw/zinc/00/47/07/303004707.db2.gz BCSIDWWLHDRTIP-FRFSOERESA-N 1 1 344.415 2.558 10 5 EFBEMO Cc1cc(Cl)c(C(=O)N2[C@@H](C)C[NH+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000296642440 310833200 /nfs/dbraw/zinc/83/32/00/310833200.db2.gz WSLQMTZJRHMCEU-QWRGUYRKSA-N 1 1 325.796 2.721 10 5 EFBEMO CCC[N@@H+](C)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000299409311 311081719 /nfs/dbraw/zinc/08/17/19/311081719.db2.gz OLWPUZYPHITGCM-UHFFFAOYSA-N 1 1 334.401 2.999 10 5 EFBEMO COCc1cc([N+](=O)[O-])ccc1N1C[C@@H]2C[N@H+]3CCCC[C@H]3[C@@H]2C1 ZINC000301472610 311139083 /nfs/dbraw/zinc/13/90/83/311139083.db2.gz LCHVRYNNILLLKV-LESCRADOSA-N 1 1 331.416 2.662 10 5 EFBEMO COc1cc(F)c([N+](=O)[O-])c(N2C[C@@H]3C[N@H+]4CCCC[C@H]4[C@@H]3C2)c1 ZINC000301477701 311139437 /nfs/dbraw/zinc/13/94/37/311139437.db2.gz PRFFHKAOEKAXGL-LNSITVRQSA-N 1 1 335.379 2.663 10 5 EFBEMO COc1cc(N2CCC[C@@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1F ZINC000301715304 311154374 /nfs/dbraw/zinc/15/43/74/311154374.db2.gz MPASHSPIIKSICL-LBPRGKRZSA-N 1 1 348.378 2.935 10 5 EFBEMO COC(=O)c1cc(N2CCC([N@H+]3CCC[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000301768973 311157391 /nfs/dbraw/zinc/15/73/91/311157391.db2.gz IIWFEIHPKHPEQX-ZDUSSCGKSA-N 1 1 347.415 2.835 10 5 EFBEMO Cc1ccc(N2CCCC[C@H](N3CC[NH+](C)CC3)C2)c([N+](=O)[O-])c1 ZINC000301805098 311159289 /nfs/dbraw/zinc/15/92/89/311159289.db2.gz DWCDCTKFMMCBOD-INIZCTEOSA-N 1 1 332.448 2.510 10 5 EFBEMO Cc1cc(N2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)ccc1[N+](=O)[O-] ZINC000301872115 311163946 /nfs/dbraw/zinc/16/39/46/311163946.db2.gz XAVHAZUJIQFFOX-BYICEURKSA-N 1 1 344.459 2.650 10 5 EFBEMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC000301923113 311167046 /nfs/dbraw/zinc/16/70/46/311167046.db2.gz LNRIBLDJDVQAER-CYBMUJFWSA-N 1 1 332.408 2.562 10 5 EFBEMO CCCC[N@H+]1CCCC[C@H]1CNc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000302002994 311171473 /nfs/dbraw/zinc/17/14/73/311171473.db2.gz REKOGGIBOZSPTO-ZDUSSCGKSA-N 1 1 332.408 2.704 10 5 EFBEMO C[C@@H](CNc1ccc2ncc([N+](=O)[O-])n2n1)[N@@H+](C)Cc1ccccc1 ZINC000302005955 311171713 /nfs/dbraw/zinc/17/17/13/311171713.db2.gz TWVYDOOWWVPZBB-ZDUSSCGKSA-N 1 1 340.387 2.570 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+](C(C)C)C2)c1 ZINC000302093760 311177362 /nfs/dbraw/zinc/17/73/62/311177362.db2.gz NBWFBWKOENSQML-ZDUSSCGKSA-N 1 1 335.404 2.914 10 5 EFBEMO CC[C@H]1CN(c2c(C)cc([N+](=O)[O-])cc2Cl)CC[N@@H+]1C[C@H](C)O ZINC000302688716 311196563 /nfs/dbraw/zinc/19/65/63/311196563.db2.gz RCGGTLPKMPCNKY-STQMWFEESA-N 1 1 341.839 2.838 10 5 EFBEMO CC[C@H]1CN(c2c(C)cc([N+](=O)[O-])cc2Cl)CC[N@H+]1C[C@H](C)O ZINC000302688716 311196564 /nfs/dbraw/zinc/19/65/64/311196564.db2.gz RCGGTLPKMPCNKY-STQMWFEESA-N 1 1 341.839 2.838 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c([N+](=O)[O-])cc1F ZINC000330924830 311344013 /nfs/dbraw/zinc/34/40/13/311344013.db2.gz UYNUATXEVGARCJ-SWLSCSKDSA-N 1 1 340.395 2.971 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c([N+](=O)[O-])cc1F ZINC000330924830 311344015 /nfs/dbraw/zinc/34/40/15/311344015.db2.gz UYNUATXEVGARCJ-SWLSCSKDSA-N 1 1 340.395 2.971 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c([N+](=O)[O-])cc1F ZINC000330924829 311344191 /nfs/dbraw/zinc/34/41/91/311344191.db2.gz UYNUATXEVGARCJ-IUODEOHRSA-N 1 1 340.395 2.971 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c([N+](=O)[O-])cc1F ZINC000330924829 311344193 /nfs/dbraw/zinc/34/41/93/311344193.db2.gz UYNUATXEVGARCJ-IUODEOHRSA-N 1 1 340.395 2.971 10 5 EFBEMO Cc1c(C[NH2+]Cc2cnnn2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000491385097 313741982 /nfs/dbraw/zinc/74/19/82/313741982.db2.gz FHMKJSNLIPDBLE-UHFFFAOYSA-N 1 1 337.383 2.833 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000493253044 314292592 /nfs/dbraw/zinc/29/25/92/314292592.db2.gz JGDWRGKDYAHDEK-XJKSGUPXSA-N 1 1 346.431 2.842 10 5 EFBEMO C[C@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)S(C)(=O)=O ZINC000541847489 317792192 /nfs/dbraw/zinc/79/21/92/317792192.db2.gz LKZCVGJXSVFUER-CXAGYDPISA-N 1 1 348.424 2.707 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)Cc1ccc(F)cc1)C2 ZINC000549921250 318184959 /nfs/dbraw/zinc/18/49/59/318184959.db2.gz UYLILOBROWMXTQ-INIZCTEOSA-N 1 1 330.359 2.696 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC[C@H]1C1(O)CC1 ZINC000567448110 319171943 /nfs/dbraw/zinc/17/19/43/319171943.db2.gz AERGUODBQJEFSX-INIZCTEOSA-N 1 1 347.415 2.611 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCC[N@H+](C)C1 ZINC000576905744 320059237 /nfs/dbraw/zinc/05/92/37/320059237.db2.gz RKXLZGUKAOQVBH-NSHDSACASA-N 1 1 325.796 2.628 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@H]1CCC[N@H+](C)C1 ZINC000576905743 320059263 /nfs/dbraw/zinc/05/92/63/320059263.db2.gz RKXLZGUKAOQVBH-LLVKDONJSA-N 1 1 325.796 2.628 10 5 EFBEMO COC[C@@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000181672845 323243445 /nfs/dbraw/zinc/24/34/45/323243445.db2.gz BQHWJQCUMUTWSN-QGZVFWFLSA-N 1 1 343.383 2.819 10 5 EFBEMO CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@@H+](CC)C1 ZINC000137587883 473209759 /nfs/dbraw/zinc/20/97/59/473209759.db2.gz RRMJGHPFKIZGAR-GFCCVEGCSA-N 1 1 337.445 2.778 10 5 EFBEMO C[C@@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1C ZINC000124514472 473254313 /nfs/dbraw/zinc/25/43/13/473254313.db2.gz CHCQVIIJJAZKRD-GHMZBOCLSA-N 1 1 325.796 2.803 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000176968224 473277199 /nfs/dbraw/zinc/27/71/99/473277199.db2.gz LDAWKEVCATZGNC-OAHLLOKOSA-N 1 1 346.431 2.725 10 5 EFBEMO C[N@H+](Cc1cccnc1)C[C@H]1CCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000190483614 473290649 /nfs/dbraw/zinc/29/06/49/473290649.db2.gz XXNPJIDVIBFOFB-GOSISDBHSA-N 1 1 340.427 2.944 10 5 EFBEMO CN(Cc1cccnc1)C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000190483614 473290657 /nfs/dbraw/zinc/29/06/57/473290657.db2.gz XXNPJIDVIBFOFB-GOSISDBHSA-N 1 1 340.427 2.944 10 5 EFBEMO Cn1nccc1C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000177034007 473290760 /nfs/dbraw/zinc/29/07/60/473290760.db2.gz DDWVNFIBYRRPPL-UHFFFAOYSA-N 1 1 341.371 2.849 10 5 EFBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1cccc([N+](=O)[O-])c1C ZINC000177212630 473333927 /nfs/dbraw/zinc/33/39/27/473333927.db2.gz UQSJMTKHAQXQMX-CQSZACIVSA-N 1 1 328.372 2.713 10 5 EFBEMO Cn1cc[nH+]c1CC1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000162716346 473374421 /nfs/dbraw/zinc/37/44/21/473374421.db2.gz SHGYQPIPVBMYNY-UHFFFAOYSA-N 1 1 343.387 2.815 10 5 EFBEMO COc1ccc(N2CC[NH+]([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)nc1 ZINC000452043489 476791745 /nfs/dbraw/zinc/79/17/45/476791745.db2.gz BAIWEBPXGHSHSE-AWEZNQCLSA-N 1 1 342.399 2.882 10 5 EFBEMO CC[NH+]1CCN(c2cc(N3CCCCC3)c(F)cc2[N+](=O)[O-])CC1 ZINC000004168659 471461745 /nfs/dbraw/zinc/46/17/45/471461745.db2.gz OGROOCGUOPWEFZ-UHFFFAOYSA-N 1 1 336.411 2.866 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(CN2CCOCC2)CC1 ZINC000067457273 472037168 /nfs/dbraw/zinc/03/71/68/472037168.db2.gz KNWIFSPYPOSFGU-HNNXBMFYSA-N 1 1 333.432 2.700 10 5 EFBEMO CC[N@H+]1CCC[C@H](Nc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000040713427 472039917 /nfs/dbraw/zinc/03/99/17/472039917.db2.gz LOZAQRUWZAEYGJ-JTQLQIEISA-N 1 1 329.198 2.649 10 5 EFBEMO CCN(CC)C(=O)[C@@H]1CCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000067652916 472066355 /nfs/dbraw/zinc/06/63/55/472066355.db2.gz JBAGWCBCGWLYOI-KRWDZBQOSA-N 1 1 349.431 2.697 10 5 EFBEMO COC(=O)/C=C/c1ccc(N[C@@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000069000652 472276934 /nfs/dbraw/zinc/27/69/34/472276934.db2.gz UAEVDVCYEVAFIA-HZRUHFOJSA-N 1 1 333.388 2.676 10 5 EFBEMO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000076120796 472278793 /nfs/dbraw/zinc/27/87/93/472278793.db2.gz AZSBLVYDBJHZPL-KCXAZCMYSA-N 1 1 348.403 2.527 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCNc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000076486772 472354304 /nfs/dbraw/zinc/35/43/04/472354304.db2.gz OIPFCRZJCWKAKF-GDBMZVCRSA-N 1 1 348.447 2.586 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(OCCCO)CC1 ZINC000154924641 472488023 /nfs/dbraw/zinc/48/80/23/472488023.db2.gz SNCVWNQYWRLFNS-UHFFFAOYSA-N 1 1 328.796 2.612 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1C[C@H]2CCC[N@@H+]2C[C@@H]1C ZINC000119886348 472596883 /nfs/dbraw/zinc/59/68/83/472596883.db2.gz RGJGXCQLSVHNLC-UONOGXRCSA-N 1 1 332.404 2.912 10 5 EFBEMO CCn1cnnc1[C@@H]1CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000103475342 472637107 /nfs/dbraw/zinc/63/71/07/472637107.db2.gz UTYKOFQHIYULSA-GFCCVEGCSA-N 1 1 333.367 2.725 10 5 EFBEMO CCn1cnnc1[C@@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000103475342 472637114 /nfs/dbraw/zinc/63/71/14/472637114.db2.gz UTYKOFQHIYULSA-GFCCVEGCSA-N 1 1 333.367 2.725 10 5 EFBEMO COC(=O)c1cc(N(C)CCCn2cc[nH+]c2C)cc(C)c1[N+](=O)[O-] ZINC000120174986 472643347 /nfs/dbraw/zinc/64/33/47/472643347.db2.gz OOOZWYVVZWFDRK-UHFFFAOYSA-N 1 1 346.387 2.721 10 5 EFBEMO C[C@@H]1C[N@H+](Cc2cccc(Nc3c([N+](=O)[O-])ncn3C)c2)C[C@H](C)O1 ZINC000077983147 472647299 /nfs/dbraw/zinc/64/72/99/472647299.db2.gz CYCZCNFLLULBAW-BETUJISGSA-N 1 1 345.403 2.681 10 5 EFBEMO COC(=O)c1cc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)cc(C)c1[N+](=O)[O-] ZINC000091479560 472771450 /nfs/dbraw/zinc/77/14/50/472771450.db2.gz NMIIWSCEENRGSG-GFCCVEGCSA-N 1 1 344.371 2.797 10 5 EFBEMO Cc1nc(C)n(C[C@H]2CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC000105884896 472797014 /nfs/dbraw/zinc/79/70/14/472797014.db2.gz AEFULJGIFGQZAF-HNNXBMFYSA-N 1 1 329.404 2.715 10 5 EFBEMO Cc1sc(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000063693533 472801160 /nfs/dbraw/zinc/80/11/60/472801160.db2.gz JSZFABAZBWMBJE-LBPRGKRZSA-N 1 1 325.434 2.815 10 5 EFBEMO CC[N@H+](CCc1nccs1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000121169280 472810362 /nfs/dbraw/zinc/81/03/62/472810362.db2.gz OKSZIGBHHSNMEL-GFCCVEGCSA-N 1 1 348.428 2.943 10 5 EFBEMO CC[N@@H+](CCc1nccs1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000121169280 472810365 /nfs/dbraw/zinc/81/03/65/472810365.db2.gz OKSZIGBHHSNMEL-GFCCVEGCSA-N 1 1 348.428 2.943 10 5 EFBEMO CCN(CC)C(=O)[C@H]1CCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000065297037 472923447 /nfs/dbraw/zinc/92/34/47/472923447.db2.gz JBAGWCBCGWLYOI-QGZVFWFLSA-N 1 1 349.431 2.697 10 5 EFBEMO CCC[C@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000121894650 472938938 /nfs/dbraw/zinc/93/89/38/472938938.db2.gz VXVAPDLUVPANBY-AWEZNQCLSA-N 1 1 327.450 2.589 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CCO[C@H](C)C2)CC1 ZINC000107316786 472941838 /nfs/dbraw/zinc/94/18/38/472941838.db2.gz MZQCCVFWFIFHNF-HUUCEWRRSA-N 1 1 333.432 2.841 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(N2CCO[C@H](C)C2)CC1 ZINC000107316786 472941842 /nfs/dbraw/zinc/94/18/42/472941842.db2.gz MZQCCVFWFIFHNF-HUUCEWRRSA-N 1 1 333.432 2.841 10 5 EFBEMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1 ZINC000080375792 473021055 /nfs/dbraw/zinc/02/10/55/473021055.db2.gz HGVGVOBGIPSMCA-LLVKDONJSA-N 1 1 339.355 2.908 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065867581 473021107 /nfs/dbraw/zinc/02/11/07/473021107.db2.gz NUGHSCDBFLZFDZ-AWEZNQCLSA-N 1 1 344.415 2.540 10 5 EFBEMO CCCCNC(=O)[C@@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000051058324 473021833 /nfs/dbraw/zinc/02/18/33/473021833.db2.gz BLFPQRJZAGNKQK-CYBMUJFWSA-N 1 1 325.434 2.785 10 5 EFBEMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000051058324 473021838 /nfs/dbraw/zinc/02/18/38/473021838.db2.gz BLFPQRJZAGNKQK-CYBMUJFWSA-N 1 1 325.434 2.785 10 5 EFBEMO Cc1ccc(C[N@H+]2CCCC[C@@H]2CN2CCOCC2)cc1[N+](=O)[O-] ZINC000093011400 473025887 /nfs/dbraw/zinc/02/58/87/473025887.db2.gz SUPJXMXZYDKUCM-QGZVFWFLSA-N 1 1 333.432 2.590 10 5 EFBEMO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cccc(F)c1 ZINC000051531241 473052675 /nfs/dbraw/zinc/05/26/75/473052675.db2.gz ZHCQVRFUKBTVHB-UHFFFAOYSA-N 1 1 347.346 2.683 10 5 EFBEMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cccc(F)c1 ZINC000051531241 473052682 /nfs/dbraw/zinc/05/26/82/473052682.db2.gz ZHCQVRFUKBTVHB-UHFFFAOYSA-N 1 1 347.346 2.683 10 5 EFBEMO Cc1c(CN2CCN(C[C@@H]3CCCC[N@@H+]3C)CC2)cccc1[N+](=O)[O-] ZINC000109751172 473117241 /nfs/dbraw/zinc/11/72/41/473117241.db2.gz ZYHVBMVMQJVVQI-SFHVURJKSA-N 1 1 346.475 2.505 10 5 EFBEMO C[C@H]1C[N@H+](Cc2cccc(CNc3ccncc3[N+](=O)[O-])c2)CCO1 ZINC000066810587 473156464 /nfs/dbraw/zinc/15/64/64/473156464.db2.gz KBWIBRASTIVMRJ-AWEZNQCLSA-N 1 1 342.399 2.823 10 5 EFBEMO C[C@H]1C[N@@H+](Cc2cccc(CNc3ccncc3[N+](=O)[O-])c2)CCO1 ZINC000066810587 473156471 /nfs/dbraw/zinc/15/64/71/473156471.db2.gz KBWIBRASTIVMRJ-AWEZNQCLSA-N 1 1 342.399 2.823 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H](CO)CC(C)C ZINC000185335253 473397905 /nfs/dbraw/zinc/39/79/05/473397905.db2.gz WHWQZIFLRFZNLV-OAHLLOKOSA-N 1 1 337.420 2.571 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177706524 473421135 /nfs/dbraw/zinc/42/11/35/473421135.db2.gz HDKDAJQEZMVCJQ-INIZCTEOSA-N 1 1 348.447 2.648 10 5 EFBEMO CCN1CCC[C@H]1C[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177706524 473421142 /nfs/dbraw/zinc/42/11/42/473421142.db2.gz HDKDAJQEZMVCJQ-INIZCTEOSA-N 1 1 348.447 2.648 10 5 EFBEMO CCN1CCC[C@H]1C[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177706524 473421148 /nfs/dbraw/zinc/42/11/48/473421148.db2.gz HDKDAJQEZMVCJQ-INIZCTEOSA-N 1 1 348.447 2.648 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177712877 473422629 /nfs/dbraw/zinc/42/26/29/473422629.db2.gz GXSPCJAXVARIGH-INIZCTEOSA-N 1 1 348.447 2.648 10 5 EFBEMO CCN1CCC[C@H]1C[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177712877 473422636 /nfs/dbraw/zinc/42/26/36/473422636.db2.gz GXSPCJAXVARIGH-INIZCTEOSA-N 1 1 348.447 2.648 10 5 EFBEMO CCN1CCC[C@H]1C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177712877 473422643 /nfs/dbraw/zinc/42/26/43/473422643.db2.gz GXSPCJAXVARIGH-INIZCTEOSA-N 1 1 348.447 2.648 10 5 EFBEMO CC[C@H](NC(=O)CCCC[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000177783716 473434303 /nfs/dbraw/zinc/43/43/03/473434303.db2.gz MWCNDWDIQBLTJF-KRWDZBQOSA-N 1 1 349.431 2.665 10 5 EFBEMO CCC[C@@H]([NH2+]C[C@H](O)CN1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000151300309 473440522 /nfs/dbraw/zinc/44/05/22/473440522.db2.gz YPHNVVDQEQZIOB-ZWKOTPCHSA-N 1 1 335.448 2.872 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1[C@H](C)C[N@H+](C)C[C@@H]1C ZINC000185544447 473453514 /nfs/dbraw/zinc/45/35/14/473453514.db2.gz HHIXJMBJJARPKS-LZWOXQAQSA-N 1 1 333.432 2.715 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](C(=O)OC(C)(C)C)C1 ZINC000178521589 473525206 /nfs/dbraw/zinc/52/52/06/473525206.db2.gz BJJYFDKWIKQNDA-GFCCVEGCSA-N 1 1 336.388 2.767 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(=O)OC(C)(C)C)C1 ZINC000178521589 473525212 /nfs/dbraw/zinc/52/52/12/473525212.db2.gz BJJYFDKWIKQNDA-GFCCVEGCSA-N 1 1 336.388 2.767 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000126562742 473528117 /nfs/dbraw/zinc/52/81/17/473528117.db2.gz KVQHICAIYHALSV-HZPDHXFCSA-N 1 1 331.416 2.531 10 5 EFBEMO 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CC(C)[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCOC1 ZINC000291768730 474678193 /nfs/dbraw/zinc/67/81/93/474678193.db2.gz LQCVIOYSQQXYDH-CQSZACIVSA-N 1 1 332.360 2.644 10 5 EFBEMO CC(C)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCOC1 ZINC000291768730 474678196 /nfs/dbraw/zinc/67/81/96/474678196.db2.gz LQCVIOYSQQXYDH-CQSZACIVSA-N 1 1 332.360 2.644 10 5 EFBEMO CCc1ccc(NC(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000252511602 474688567 /nfs/dbraw/zinc/68/85/67/474688567.db2.gz IONWCFWAQFLRBK-IUODEOHRSA-N 1 1 334.420 2.961 10 5 EFBEMO O=[N+]([O-])c1cc(CN2CC[N@H+]3CCC[C@H]3C2)ccc1Br ZINC000252704892 474710090 /nfs/dbraw/zinc/71/00/90/474710090.db2.gz OQVHNLULCROPLZ-LBPRGKRZSA-N 1 1 340.221 2.637 10 5 EFBEMO Cc1ccc(OC[C@H](O)C[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000305286388 474728191 /nfs/dbraw/zinc/72/81/91/474728191.db2.gz DRKDIUXUMONSAS-QGZVFWFLSA-N 1 1 342.395 2.701 10 5 EFBEMO CC(C)[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000291885746 474735177 /nfs/dbraw/zinc/73/51/77/474735177.db2.gz QMCHSHVZLAHRBD-GFCCVEGCSA-N 1 1 341.795 2.686 10 5 EFBEMO CC(C)[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000291885746 474735181 /nfs/dbraw/zinc/73/51/81/474735181.db2.gz QMCHSHVZLAHRBD-GFCCVEGCSA-N 1 1 341.795 2.686 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@@H]3COC[C@H](C2)O3)s1 ZINC000338964859 474783197 /nfs/dbraw/zinc/78/31/97/474783197.db2.gz BQRVGBZCCHMLKZ-BETUJISGSA-N 1 1 346.408 2.923 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@@H]3COC[C@H](C2)O3)s1 ZINC000338964859 474783207 /nfs/dbraw/zinc/78/32/07/474783207.db2.gz BQRVGBZCCHMLKZ-BETUJISGSA-N 1 1 346.408 2.923 10 5 EFBEMO CCN(CC)C(=O)[C@H]1CCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255405211 474851284 /nfs/dbraw/zinc/85/12/84/474851284.db2.gz OCVXZRZJHSWPPI-CGQZWFTASA-N 1 1 331.416 2.941 10 5 EFBEMO CCN(CC)C(=O)[C@H]1CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255405211 474851294 /nfs/dbraw/zinc/85/12/94/474851294.db2.gz OCVXZRZJHSWPPI-CGQZWFTASA-N 1 1 331.416 2.941 10 5 EFBEMO CC(C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCOCC1 ZINC000337326926 474899963 /nfs/dbraw/zinc/89/99/63/474899963.db2.gz WQEDIXILXUWEFP-UHFFFAOYSA-N 1 1 335.404 2.813 10 5 EFBEMO C[N@H+]1CCO[C@@H]2CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C[C@H]21 ZINC000285170730 474913943 /nfs/dbraw/zinc/91/39/43/474913943.db2.gz UWXZGLUNFBBXDP-ZIAGYGMSSA-N 1 1 345.321 2.523 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000292232210 474916557 /nfs/dbraw/zinc/91/65/57/474916557.db2.gz VYKKGTHJTMYNFU-GOSISDBHSA-N 1 1 333.432 2.910 10 5 EFBEMO CC(C)[NH+]1CCC(O)(CNCc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000268454034 474987541 /nfs/dbraw/zinc/98/75/41/474987541.db2.gz WVEZSTPTSHNORX-UHFFFAOYSA-N 1 1 341.839 2.573 10 5 EFBEMO CC(C)[N@H+]1CC[C@@H](Nc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000268479377 475005249 /nfs/dbraw/zinc/00/52/49/475005249.db2.gz KLKNEGHTWDKTLW-SNVBAGLBSA-N 1 1 329.198 2.647 10 5 EFBEMO CCCC[N@@H+](C)C[C@H](C)Nc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-] ZINC000341127610 475005298 /nfs/dbraw/zinc/00/52/98/475005298.db2.gz TXDNGBKYFTXTJF-LBPRGKRZSA-N 1 1 338.408 2.617 10 5 EFBEMO C[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cn2)[C@@H]1c1ccc(F)c(F)c1 ZINC000273936929 475126930 /nfs/dbraw/zinc/12/69/30/475126930.db2.gz LFRRUMHYLMCHLY-KBPBESRZSA-N 1 1 335.314 2.520 10 5 EFBEMO C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cn2)[C@@H]1c1ccc(F)c(F)c1 ZINC000273936929 475126936 /nfs/dbraw/zinc/12/69/36/475126936.db2.gz LFRRUMHYLMCHLY-KBPBESRZSA-N 1 1 335.314 2.520 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H]1CN1CCOCC1 ZINC000347354073 475259123 /nfs/dbraw/zinc/25/91/23/475259123.db2.gz GECHJGJEGCRUBI-UIRWJGRMSA-N 1 1 345.443 2.795 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H](CO)C2)ccc1[N+](=O)[O-] ZINC000352687282 475530942 /nfs/dbraw/zinc/53/09/42/475530942.db2.gz VNQSNORXIWGONY-NEPJUHHUSA-N 1 1 348.321 2.596 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H](CO)C2)ccc1[N+](=O)[O-] ZINC000352687282 475530947 /nfs/dbraw/zinc/53/09/47/475530947.db2.gz VNQSNORXIWGONY-NEPJUHHUSA-N 1 1 348.321 2.596 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCCCC[C@@H]3CCO)o2)cc1 ZINC000342063840 475542103 /nfs/dbraw/zinc/54/21/03/475542103.db2.gz PAWHQGJTKQRIBR-CQSZACIVSA-N 1 1 346.387 2.772 10 5 EFBEMO CCNC(=O)[C@@H](C)[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000352702254 475546634 /nfs/dbraw/zinc/54/66/34/475546634.db2.gz USDQOIUQGWAFNY-CXAGYDPISA-N 1 1 327.384 2.798 10 5 EFBEMO CN(C)c1cc[nH+]c(NCc2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000361614629 475600283 /nfs/dbraw/zinc/60/02/83/475600283.db2.gz DRXQOVCRLQYOSA-UHFFFAOYSA-N 1 1 339.302 2.664 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c2c(c1)COCO2 ZINC000355207486 475744097 /nfs/dbraw/zinc/74/40/97/475744097.db2.gz OCUFMGPFEZZYKO-ZIAGYGMSSA-N 1 1 348.399 2.710 10 5 EFBEMO CN(C(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000355281496 475797264 /nfs/dbraw/zinc/79/72/64/475797264.db2.gz WOSSPCDGIVFVHI-SFHVURJKSA-N 1 1 339.395 2.941 10 5 EFBEMO COc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000358682261 475856770 /nfs/dbraw/zinc/85/67/70/475856770.db2.gz OELPFNXSDQVOSN-LLVKDONJSA-N 1 1 329.356 2.553 10 5 EFBEMO CCOc1ccc(C(=O)Nc2cc[nH+]c(N(C)C)c2)cc1[N+](=O)[O-] ZINC000346938384 475975942 /nfs/dbraw/zinc/97/59/42/475975942.db2.gz TVIIHHWOPAIJNP-UHFFFAOYSA-N 1 1 330.344 2.707 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000340375657 475991293 /nfs/dbraw/zinc/99/12/93/475991293.db2.gz SZFKNBXNEYRSBI-IAGOWNOFSA-N 1 1 343.358 2.909 10 5 EFBEMO C[C@]12CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C[C@H]1C2(F)F ZINC000298221697 476025026 /nfs/dbraw/zinc/02/50/26/476025026.db2.gz GDGPAVDGLYIWKR-HIFRSBDPSA-N 1 1 339.342 2.901 10 5 EFBEMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000358996391 476099599 /nfs/dbraw/zinc/09/95/99/476099599.db2.gz WXXRGYFZSFIODB-JTQLQIEISA-N 1 1 345.346 2.656 10 5 EFBEMO 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476235619 /nfs/dbraw/zinc/23/56/19/476235619.db2.gz CFNKSBQUWUTBNH-GOSISDBHSA-N 1 1 348.399 2.854 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(c2cccnn2)CC1 ZINC000347313871 476252611 /nfs/dbraw/zinc/25/26/11/476252611.db2.gz JOPDCWQWEQLTCG-QINSGFPZSA-N 1 1 339.399 2.610 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H]4COCC[C@H]43)n2)c1 ZINC000362453262 476262450 /nfs/dbraw/zinc/26/24/50/476262450.db2.gz WWVNWVYNXRVRIW-UKRRQHHQSA-N 1 1 344.371 2.646 10 5 EFBEMO C[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1cccs1 ZINC000357219236 476294358 /nfs/dbraw/zinc/29/43/58/476294358.db2.gz JOZVDXKZOPMZTQ-XHDPSFHLSA-N 1 1 348.428 2.797 10 5 EFBEMO CSc1cccc(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-] ZINC000362764092 476395225 /nfs/dbraw/zinc/39/52/25/476395225.db2.gz YYLHZLAZUYZJMA-GFCCVEGCSA-N 1 1 335.429 2.625 10 5 EFBEMO CSc1cccc(C(=O)NCC[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000362840346 476435118 /nfs/dbraw/zinc/43/51/18/476435118.db2.gz 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C[C@H]1c2ccccc2C[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000361085733 476590659 /nfs/dbraw/zinc/59/06/59/476590659.db2.gz GLRQYNHPPKOBAA-BBRMVZONSA-N 1 1 328.368 2.911 10 5 EFBEMO C[C@@H]1c2ccccc2C[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000361085735 476591006 /nfs/dbraw/zinc/59/10/06/476591006.db2.gz GLRQYNHPPKOBAA-CZUORRHYSA-N 1 1 328.368 2.911 10 5 EFBEMO C[C@@H]1c2ccccc2C[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000361085735 476591010 /nfs/dbraw/zinc/59/10/10/476591010.db2.gz GLRQYNHPPKOBAA-CZUORRHYSA-N 1 1 328.368 2.911 10 5 EFBEMO C[C@H](C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc([N+](=O)[O-])cc1F ZINC000374964771 476613778 /nfs/dbraw/zinc/61/37/78/476613778.db2.gz RGVJXFMPPAZKPH-FUDCBSFHSA-N 1 1 349.406 2.969 10 5 EFBEMO COc1ccc(OC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000377947332 476651410 /nfs/dbraw/zinc/65/14/10/476651410.db2.gz JQCQLEUWQHJHKI-MRXNPFEDSA-N 1 1 340.351 2.721 10 5 EFBEMO 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ZINC000375160291 476695813 /nfs/dbraw/zinc/69/58/13/476695813.db2.gz OIUBIVWLIWGKRJ-MRXNPFEDSA-N 1 1 331.372 2.991 10 5 EFBEMO C[C@H](NC(=O)NCc1c[nH+]c2n1CCCC2)c1ccccc1[N+](=O)[O-] ZINC000375177879 476704709 /nfs/dbraw/zinc/70/47/09/476704709.db2.gz CSNIPUFXUVTUDQ-LBPRGKRZSA-N 1 1 343.387 2.688 10 5 EFBEMO COC[C@H]1CCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000452076942 476808217 /nfs/dbraw/zinc/80/82/17/476808217.db2.gz CBOTWSCVWJVGBB-HNNXBMFYSA-N 1 1 349.431 2.980 10 5 EFBEMO COC[C@H]1CCC[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000452079470 476810266 /nfs/dbraw/zinc/81/02/66/476810266.db2.gz HYRNGNSWHCVBHX-AWEZNQCLSA-N 1 1 335.404 2.590 10 5 EFBEMO COC[C@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000452083161 476811841 /nfs/dbraw/zinc/81/18/41/476811841.db2.gz LQBNOLCJAWCHIG-ZDUSSCGKSA-N 1 1 346.387 2.893 10 5 EFBEMO Cc1cc(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000456991182 476820699 /nfs/dbraw/zinc/82/06/99/476820699.db2.gz LYKGIWBMLKCKEB-KRWDZBQOSA-N 1 1 325.368 2.690 10 5 EFBEMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000446070543 476821091 /nfs/dbraw/zinc/82/10/91/476821091.db2.gz HKKUIKXMLXEOHZ-FPMFFAJLSA-N 1 1 335.404 2.730 10 5 EFBEMO COC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000452096281 476821505 /nfs/dbraw/zinc/82/15/05/476821505.db2.gz YBKOCKIWUYBLFQ-ZIAGYGMSSA-N 1 1 335.404 2.670 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)O[C@H](C)[C@H]1C ZINC000446075453 476822252 /nfs/dbraw/zinc/82/22/52/476822252.db2.gz YQQXGEDGTIAKQH-BFHYXJOUSA-N 1 1 335.404 2.730 10 5 EFBEMO COC[C@@H]1CCC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000452098813 476823149 /nfs/dbraw/zinc/82/31/49/476823149.db2.gz GAESCQAGWFRVTC-GFCCVEGCSA-N 1 1 326.368 2.991 10 5 EFBEMO O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000457021540 476833838 /nfs/dbraw/zinc/83/38/38/476833838.db2.gz MNUQKFDBZNXFTF-SFHVURJKSA-N 1 1 339.395 2.701 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1C[C@H](C)[N@@H+](C)C[C@H]1C ZINC000446301461 476858910 /nfs/dbraw/zinc/85/89/10/476858910.db2.gz YWFMNWCJQMNVAM-WDEREUQCSA-N 1 1 325.796 2.721 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000446301461 476858916 /nfs/dbraw/zinc/85/89/16/476858916.db2.gz YWFMNWCJQMNVAM-WDEREUQCSA-N 1 1 325.796 2.721 10 5 EFBEMO NC1(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)CCCCCC1 ZINC000423208099 476963366 /nfs/dbraw/zinc/96/33/66/476963366.db2.gz YVKKPNZHXRLJTI-HUUCEWRRSA-N 1 1 335.452 2.916 10 5 EFBEMO O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC(c2cnc[nH]2)CC1 ZINC000371172810 477162028 /nfs/dbraw/zinc/16/20/28/477162028.db2.gz CNIJIRGMJGEMFQ-UHFFFAOYSA-N 1 1 334.763 2.991 10 5 EFBEMO CC(C)[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])c3c2CCCN3)no1 ZINC000453243478 477194816 /nfs/dbraw/zinc/19/48/16/477194816.db2.gz XWEUXHNEIVAIQB-UHFFFAOYSA-N 1 1 331.376 2.843 10 5 EFBEMO CC(C)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])c3c2CCCN3)no1 ZINC000453243478 477194828 /nfs/dbraw/zinc/19/48/28/477194828.db2.gz XWEUXHNEIVAIQB-UHFFFAOYSA-N 1 1 331.376 2.843 10 5 EFBEMO C[N@@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC000366858073 477224684 /nfs/dbraw/zinc/22/46/84/477224684.db2.gz WACWNYONGBXRCE-DLBZAZTESA-N 1 1 343.358 2.909 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC000366858073 477224688 /nfs/dbraw/zinc/22/46/88/477224688.db2.gz WACWNYONGBXRCE-DLBZAZTESA-N 1 1 343.358 2.909 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC000366858676 477225552 /nfs/dbraw/zinc/22/55/52/477225552.db2.gz WACWNYONGBXRCE-SJORKVTESA-N 1 1 343.358 2.909 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC000366858676 477225553 /nfs/dbraw/zinc/22/55/53/477225553.db2.gz WACWNYONGBXRCE-SJORKVTESA-N 1 1 343.358 2.909 10 5 EFBEMO CC[N@H+]1CCC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000448914198 477338351 /nfs/dbraw/zinc/33/83/51/477338351.db2.gz AXLSMZQRJPSSRI-NSHDSACASA-N 1 1 345.321 2.828 10 5 EFBEMO CN(c1ncc([N+](=O)[O-])cc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000413193268 477563964 /nfs/dbraw/zinc/56/39/64/477563964.db2.gz HDHOPOZHWHZGCN-CQSZACIVSA-N 1 1 330.363 2.840 10 5 EFBEMO CO[C@@H](Cc1ccccc1)C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000450690095 477683524 /nfs/dbraw/zinc/68/35/24/477683524.db2.gz GEVWMKBDZSUCLC-KRWDZBQOSA-N 1 1 327.384 2.606 10 5 EFBEMO CO[C@@H](Cc1ccccc1)C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000450690095 477683530 /nfs/dbraw/zinc/68/35/30/477683530.db2.gz GEVWMKBDZSUCLC-KRWDZBQOSA-N 1 1 327.384 2.606 10 5 EFBEMO CC(C)[C@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000438484629 477850260 /nfs/dbraw/zinc/85/02/60/477850260.db2.gz RPIZMFZSKIBGRR-ZDUSSCGKSA-N 1 1 333.388 2.871 10 5 EFBEMO O=C(C[NH+]1CCC2(CCC(O)CC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000451154075 477850365 /nfs/dbraw/zinc/85/03/65/477850365.db2.gz KYNVGLCNSAZSNM-UHFFFAOYSA-N 1 1 347.415 2.550 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](C(C)C)C1 ZINC000438509103 477855861 /nfs/dbraw/zinc/85/58/61/477855861.db2.gz XRZWUKZUKVXYOT-ZDUSSCGKSA-N 1 1 335.404 2.910 10 5 EFBEMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000456354389 477882034 /nfs/dbraw/zinc/88/20/34/477882034.db2.gz PDWHPWCSTVJZRF-GFCCVEGCSA-N 1 1 330.388 2.632 10 5 EFBEMO CC[N@H+]1CCCC[C@@H]1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000558576592 477889447 /nfs/dbraw/zinc/88/94/47/477889447.db2.gz JMLAJXQKWKRZMY-QGZVFWFLSA-N 1 1 344.415 2.609 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000438932141 477906521 /nfs/dbraw/zinc/90/65/21/477906521.db2.gz BEUIDOWBEDELNP-OLZOCXBDSA-N 1 1 337.807 2.913 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000439093743 477927963 /nfs/dbraw/zinc/92/79/63/477927963.db2.gz AISRYXDEYQGUOI-ZDUSSCGKSA-N 1 1 337.807 2.865 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@H](O)C[C@@H]1[C@@H]1CCCOC1 ZINC000451299927 477939658 /nfs/dbraw/zinc/93/96/58/477939658.db2.gz KVKIXXHQMCLRGM-BPLDGKMQSA-N 1 1 340.807 2.610 10 5 EFBEMO O=C(C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O)Nc1ccccc1[N+](=O)[O-] ZINC000451350867 477968841 /nfs/dbraw/zinc/96/88/41/477968841.db2.gz ZYHNTRPWCKILSG-YSVLISHTSA-N 1 1 347.415 2.549 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCCC[C@@H]2C2(O)CC2)cccc1[N+](=O)[O-] ZINC000516955973 478021637 /nfs/dbraw/zinc/02/16/37/478021637.db2.gz WSUMACZOKUUFGE-MRXNPFEDSA-N 1 1 347.415 2.611 10 5 EFBEMO COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000533242072 478055493 /nfs/dbraw/zinc/05/54/93/478055493.db2.gz KVKAZULVXRRDMH-DZKIICNBSA-N 1 1 348.399 2.780 10 5 EFBEMO COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000533242072 478055497 /nfs/dbraw/zinc/05/54/97/478055497.db2.gz KVKAZULVXRRDMH-DZKIICNBSA-N 1 1 348.399 2.780 10 5 EFBEMO CNC(=O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000421371862 478059425 /nfs/dbraw/zinc/05/94/25/478059425.db2.gz DBBVDLGJCHMUDQ-CYBMUJFWSA-N 1 1 345.424 2.891 10 5 EFBEMO CC[C@@H]1C[C@@H]([NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CCO1 ZINC000421370577 478059619 /nfs/dbraw/zinc/05/96/19/478059619.db2.gz BXFDRRPHORSFLT-UAGQMJEPSA-N 1 1 344.415 2.965 10 5 EFBEMO CNC(=O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000421377730 478064467 /nfs/dbraw/zinc/06/44/67/478064467.db2.gz HZWPYLQWSQCVMT-LBPRGKRZSA-N 1 1 345.424 2.891 10 5 EFBEMO Cc1cc(F)ccc1C[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000488051621 478111835 /nfs/dbraw/zinc/11/18/35/478111835.db2.gz MDVBGLIVZKJQSE-MRXNPFEDSA-N 1 1 348.374 2.914 10 5 EFBEMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000495062348 478114556 /nfs/dbraw/zinc/11/45/56/478114556.db2.gz FFVWSJSZNNYCKS-ZDUSSCGKSA-N 1 1 336.388 2.637 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@H+](C3CCC3)C[C@@H](C)C2)c1 ZINC000488753603 478180608 /nfs/dbraw/zinc/18/06/08/478180608.db2.gz RQFMXFFOJAWTBL-CYBMUJFWSA-N 1 1 347.415 2.692 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)n1 ZINC000561425114 478183815 /nfs/dbraw/zinc/18/38/15/478183815.db2.gz DNFFWVNBEWWKEA-KRWDZBQOSA-N 1 1 340.427 2.970 10 5 EFBEMO C[C@@H]([NH2+][C@@H]1COCC1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000451812787 478212866 /nfs/dbraw/zinc/21/28/66/478212866.db2.gz UKZNQTCETWDVTO-ZWNOBZJWSA-N 1 1 332.360 2.720 10 5 EFBEMO CC1(N2CCOCC2)CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000600201318 478278882 /nfs/dbraw/zinc/27/88/82/478278882.db2.gz HIAKMJNJNWVTSV-GQCTYLIASA-N 1 1 345.443 2.795 10 5 EFBEMO CC1(N2CCOCC2)CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000600201319 478279337 /nfs/dbraw/zinc/27/93/37/478279337.db2.gz HIAKMJNJNWVTSV-XQRVVYSFSA-N 1 1 345.443 2.795 10 5 EFBEMO COC[C@@H]1CCC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1 ZINC000590663905 478280317 /nfs/dbraw/zinc/28/03/17/478280317.db2.gz YVWNBQSAHUZHBZ-CYBMUJFWSA-N 1 1 336.388 2.630 10 5 EFBEMO C[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1(C)CCCC1 ZINC000489874473 478282627 /nfs/dbraw/zinc/28/26/27/478282627.db2.gz LVIGIXHVSFFMJJ-UHFFFAOYSA-N 1 1 335.360 2.527 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2CCCC3(CC3)CC2)cc1[N+](=O)[O-] ZINC000600214553 478290237 /nfs/dbraw/zinc/29/02/37/478290237.db2.gz ATEKJPDRFWZJFY-UHFFFAOYSA-N 1 1 348.399 2.913 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000600227358 478297516 /nfs/dbraw/zinc/29/75/16/478297516.db2.gz AUOADJMWVZUFAP-HNNXBMFYSA-N 1 1 335.379 2.871 10 5 EFBEMO C[C@H](C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000600472485 478382313 /nfs/dbraw/zinc/38/23/13/478382313.db2.gz ZNYSRDLASZDAAT-GUYCJALGSA-N 1 1 331.416 2.831 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000600473126 478383685 /nfs/dbraw/zinc/38/36/85/478383685.db2.gz QZYWHYCOYNNXSN-ZDUSSCGKSA-N 1 1 342.399 2.823 10 5 EFBEMO CC[C@@H](NC(=O)N1CC[N@@H+](C)C[C@@H]1CC)c1cccc([N+](=O)[O-])c1 ZINC000590928050 478401600 /nfs/dbraw/zinc/40/16/00/478401600.db2.gz OZRKNBQAZPHNFC-GOEBONIOSA-N 1 1 334.420 2.782 10 5 EFBEMO CC(C)(C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000597581827 478420357 /nfs/dbraw/zinc/42/03/57/478420357.db2.gz RKDYZJKWBVLYRH-JKSUJKDBSA-N 1 1 349.406 2.517 10 5 EFBEMO CC(C)(C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1)c1ccccc1[N+](=O)[O-] ZINC000597581835 478420418 /nfs/dbraw/zinc/42/04/18/478420418.db2.gz RMXIMCZJUCXFRV-GOEBONIOSA-N 1 1 349.406 2.517 10 5 EFBEMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000591004695 478429788 /nfs/dbraw/zinc/42/97/88/478429788.db2.gz PVYKZSBTVWKHGO-LBPRGKRZSA-N 1 1 325.796 2.723 10 5 EFBEMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000591004695 478429791 /nfs/dbraw/zinc/42/97/91/478429791.db2.gz PVYKZSBTVWKHGO-LBPRGKRZSA-N 1 1 325.796 2.723 10 5 EFBEMO CCOc1cc(NC[C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000594591821 478451780 /nfs/dbraw/zinc/45/17/80/478451780.db2.gz MKFDGTVOKHRNLP-MCIONIFRSA-N 1 1 337.420 2.903 10 5 EFBEMO CCOc1cc(NC[C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000594591821 478451786 /nfs/dbraw/zinc/45/17/86/478451786.db2.gz MKFDGTVOKHRNLP-MCIONIFRSA-N 1 1 337.420 2.903 10 5 EFBEMO COCc1cc([N+](=O)[O-])ccc1NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594591763 478452262 /nfs/dbraw/zinc/45/22/62/478452262.db2.gz JONAUCXRORIOEK-MELADBBJSA-N 1 1 337.420 2.651 10 5 EFBEMO COCc1cc([N+](=O)[O-])ccc1NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594591763 478452271 /nfs/dbraw/zinc/45/22/71/478452271.db2.gz JONAUCXRORIOEK-MELADBBJSA-N 1 1 337.420 2.651 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1 ZINC000594596551 478455112 /nfs/dbraw/zinc/45/51/12/478455112.db2.gz AOCVVFYDKBPKJJ-UKRRQHHQSA-N 1 1 333.388 2.810 10 5 EFBEMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)Nc1ccc([N+](=O)[O-])cc1F ZINC000600701328 478475182 /nfs/dbraw/zinc/47/51/82/478475182.db2.gz OOYRCOXCZHROKK-CYBMUJFWSA-N 1 1 336.367 2.872 10 5 EFBEMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1c[nH]c3ccc([N+](=O)[O-])cc13)C2 ZINC000597717106 478476879 /nfs/dbraw/zinc/47/68/79/478476879.db2.gz ZAERLVJEJBVLMW-GOSISDBHSA-N 1 1 342.399 2.634 10 5 EFBEMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1c[nH]c3ccc([N+](=O)[O-])cc13)C2 ZINC000597717107 478478156 /nfs/dbraw/zinc/47/81/56/478478156.db2.gz ZAERLVJEJBVLMW-SFHVURJKSA-N 1 1 342.399 2.634 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000597856860 478542068 /nfs/dbraw/zinc/54/20/68/478542068.db2.gz BNBBYVIZPRNYQG-ZDUSSCGKSA-N 1 1 339.823 2.780 10 5 EFBEMO C[C@@H](C(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C)c1ccc([N+](=O)[O-])cc1F ZINC000597856847 478542928 /nfs/dbraw/zinc/54/29/28/478542928.db2.gz BFUINLXGWMESLG-YPMHNXCESA-N 1 1 337.395 2.826 10 5 EFBEMO CSc1ccc(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000597858741 478543677 /nfs/dbraw/zinc/54/36/77/478543677.db2.gz OQYGAIQDUOHZHD-GFCCVEGCSA-N 1 1 337.445 2.919 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000597858100 478543898 /nfs/dbraw/zinc/54/38/98/478543898.db2.gz JJAHMAZSZKVXKI-SNVBAGLBSA-N 1 1 325.796 2.851 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)c1 ZINC000597857310 478544366 /nfs/dbraw/zinc/54/43/66/478544366.db2.gz CYIITKFGQYZQKX-LLVKDONJSA-N 1 1 337.445 2.919 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000597858160 478544874 /nfs/dbraw/zinc/54/48/74/478544874.db2.gz KWHMUMQAOOEIJM-CQSZACIVSA-N 1 1 346.431 2.772 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000597859695 478546776 /nfs/dbraw/zinc/54/67/76/478546776.db2.gz FUAQATMSUDXXGV-HRCADAONSA-N 1 1 331.416 2.687 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000597860204 478546959 /nfs/dbraw/zinc/54/69/59/478546959.db2.gz LVJUCRPAYPOROL-ZDUSSCGKSA-N 1 1 333.432 2.861 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1c(C2CCC2)cnn1C ZINC000594923601 478586699 /nfs/dbraw/zinc/58/66/99/478586699.db2.gz ZWBPPZFQQHXZAI-UHFFFAOYSA-N 1 1 330.388 2.894 10 5 EFBEMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000600999477 478606378 /nfs/dbraw/zinc/60/63/78/478606378.db2.gz CIJJEYKVYPKDSP-RDJZCZTQSA-N 1 1 343.427 2.760 10 5 EFBEMO O=[N+]([O-])c1cc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cs1 ZINC000594973586 478613595 /nfs/dbraw/zinc/61/35/95/478613595.db2.gz GOTZGLMQPCLHHQ-INIZCTEOSA-N 1 1 347.440 2.513 10 5 EFBEMO CC(C)[N@H+]1CCCN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)CC1 ZINC000601034843 478624685 /nfs/dbraw/zinc/62/46/85/478624685.db2.gz MVQCZMLGLJIYEE-UHFFFAOYSA-N 1 1 345.443 2.959 10 5 EFBEMO CCN(C(=O)CCOc1cc(C)ccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1 ZINC000598039866 478626808 /nfs/dbraw/zinc/62/68/08/478626808.db2.gz AWASTIAUHXGOJW-OAHLLOKOSA-N 1 1 349.431 2.615 10 5 EFBEMO CCN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1 ZINC000598041816 478628625 /nfs/dbraw/zinc/62/86/25/478628625.db2.gz NJNKKFCSIUOBBV-HNNXBMFYSA-N 1 1 346.431 2.725 10 5 EFBEMO CCN(C(=O)CSc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](CC)C1 ZINC000598041266 478628775 /nfs/dbraw/zinc/62/87/75/478628775.db2.gz KTJVRNDXODSVNE-AWEZNQCLSA-N 1 1 337.445 2.630 10 5 EFBEMO CCN(C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CC[N@@H+](CC)C1 ZINC000598044162 478630969 /nfs/dbraw/zinc/63/09/69/478630969.db2.gz YVIREOPUTDZZGE-CYBMUJFWSA-N 1 1 330.388 2.632 10 5 EFBEMO CC(C)[N@H+]1CCC[C@@H](CNc2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC000601109755 478662529 /nfs/dbraw/zinc/66/25/29/478662529.db2.gz YAXXBLOKOLJWIU-JTQLQIEISA-N 1 1 349.357 2.879 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)[C@@H](C)C1 ZINC000601119820 478667895 /nfs/dbraw/zinc/66/78/95/478667895.db2.gz WSLJQEFEVXAIJK-VHSXEESVSA-N 1 1 349.357 2.514 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC(OCCCO)CC3)c2c1 ZINC000601129958 478676401 /nfs/dbraw/zinc/67/64/01/478676401.db2.gz YCSUUZWNARQGIS-UHFFFAOYSA-N 1 1 331.372 2.511 10 5 EFBEMO Cc1cccc2ncc(C[NH2+][C@](C)(CO)c3cccc([N+](=O)[O-])c3)n21 ZINC000601150278 478690218 /nfs/dbraw/zinc/69/02/18/478690218.db2.gz UXMYRKKSHFWIKJ-GOSISDBHSA-N 1 1 340.383 2.548 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1 ZINC000601171956 478704418 /nfs/dbraw/zinc/70/44/18/478704418.db2.gz SWVBKKQHUPCFSM-OTYXRUKQSA-N 1 1 341.289 2.893 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NCC[N@H+]1CCCC1(C)C ZINC000601173109 478706047 /nfs/dbraw/zinc/70/60/47/478706047.db2.gz QYQGCRPKTXIFRH-UHFFFAOYSA-N 1 1 335.330 2.633 10 5 EFBEMO C[N@H+]1CCC[C@H]2CN(c3nc4c(cc3[N+](=O)[O-])CCCC4)CC[C@H]21 ZINC000591923333 478709467 /nfs/dbraw/zinc/70/94/67/478709467.db2.gz LORWMJHRBJNPHO-GOEBONIOSA-N 1 1 330.432 2.789 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000601190462 478714781 /nfs/dbraw/zinc/71/47/81/478714781.db2.gz ZGLSPESHTJSUOD-NXEZZACHSA-N 1 1 347.341 2.776 10 5 EFBEMO CO[C@@H]1CCC[C@@H]([C@@H](CO)Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1 ZINC000601191854 478715754 /nfs/dbraw/zinc/71/57/54/478715754.db2.gz QXXNZQADYIJIEB-RVZJWNSFSA-N 1 1 345.399 2.543 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NC[C@@H]1CC[N@H+](C(C)(C)C)C1 ZINC000601191171 478716344 /nfs/dbraw/zinc/71/63/44/478716344.db2.gz JGVAGAPWLMYPBW-VIFPVBQESA-N 1 1 349.357 2.879 10 5 EFBEMO O=C([C@H]1CCC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1)N1CCCC1 ZINC000595316453 478729094 /nfs/dbraw/zinc/72/90/94/478729094.db2.gz FQSDPAUECXUENP-AWEZNQCLSA-N 1 1 335.379 2.568 10 5 EFBEMO C[C@H]1C[C@H](NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)CC[N@H+]1C ZINC000601233231 478739337 /nfs/dbraw/zinc/73/93/37/478739337.db2.gz ZTGLTOWXSOGZMY-DZGCQCFKSA-N 1 1 331.416 2.615 10 5 EFBEMO CC[N@H+]1CCC[C@H](CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000543578599 478753790 /nfs/dbraw/zinc/75/37/90/478753790.db2.gz PHVMSTLYHYZOOR-LLVKDONJSA-N 1 1 325.796 2.710 10 5 EFBEMO CC[C@@H]1[C@@H](C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CC[N@H+]1C ZINC000601344104 478796197 /nfs/dbraw/zinc/79/61/97/478796197.db2.gz WDFCYYWNTLRCQN-DLBZAZTESA-N 1 1 331.416 2.816 10 5 EFBEMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000592185581 478817165 /nfs/dbraw/zinc/81/71/65/478817165.db2.gz ZXOLEDZEWLDKTE-QMTHXVAHSA-N 1 1 345.321 2.656 10 5 EFBEMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000592185580 478817735 /nfs/dbraw/zinc/81/77/35/478817735.db2.gz ZXOLEDZEWLDKTE-IINYFYTJSA-N 1 1 345.321 2.656 10 5 EFBEMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601402777 478819881 /nfs/dbraw/zinc/81/98/81/478819881.db2.gz WCLAPABXTVZSMB-KBPBESRZSA-N 1 1 331.416 2.568 10 5 EFBEMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601402777 478819889 /nfs/dbraw/zinc/81/98/89/478819889.db2.gz WCLAPABXTVZSMB-KBPBESRZSA-N 1 1 331.416 2.568 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000598466803 478837961 /nfs/dbraw/zinc/83/79/61/478837961.db2.gz WAGBXONCKDSEOR-UHFFFAOYSA-N 1 1 337.420 2.844 10 5 EFBEMO Cc1noc(C[N@H+]2CCC[C@@H](O)[C@@H]2CCc2ccccc2)c1[N+](=O)[O-] ZINC000595556757 478852486 /nfs/dbraw/zinc/85/24/86/478852486.db2.gz FTWBWUDLNNOANX-JKSUJKDBSA-N 1 1 345.399 2.849 10 5 EFBEMO COc1ccc(C2CC[NH+](Cc3onc(C)c3[N+](=O)[O-])CC2)nc1 ZINC000595566528 478859581 /nfs/dbraw/zinc/85/95/81/478859581.db2.gz GYILKFBUWGYFQX-UHFFFAOYSA-N 1 1 332.360 2.674 10 5 EFBEMO C[N@H+]1CCC[C@H](CCNC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000601633055 478918327 /nfs/dbraw/zinc/91/83/27/478918327.db2.gz OJKPRMRVKSMWNL-OAHLLOKOSA-N 1 1 345.443 2.865 10 5 EFBEMO COc1ncncc1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000592514189 478924737 /nfs/dbraw/zinc/92/47/37/478924737.db2.gz DCFGKUGOVAURMI-CQSZACIVSA-N 1 1 328.372 2.773 10 5 EFBEMO COc1ncncc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000592514189 478924742 /nfs/dbraw/zinc/92/47/42/478924742.db2.gz DCFGKUGOVAURMI-CQSZACIVSA-N 1 1 328.372 2.773 10 5 EFBEMO C[C@@]12COC[C@]1(C)C[N@@H+](Cc1nc(-c3ccc([N+](=O)[O-])cc3)no1)C2 ZINC000595691105 478938718 /nfs/dbraw/zinc/93/87/18/478938718.db2.gz YXIYOROHTFUZAT-CALCHBBNSA-N 1 1 344.371 2.503 10 5 EFBEMO C[C@@]12COC[C@]1(C)C[N@H+](Cc1nc(-c3ccc([N+](=O)[O-])cc3)no1)C2 ZINC000595691105 478938728 /nfs/dbraw/zinc/93/87/28/478938728.db2.gz YXIYOROHTFUZAT-CALCHBBNSA-N 1 1 344.371 2.503 10 5 EFBEMO O=C1[C@H]([N@H+]2CCC[C@H](CCF)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595756300 478978749 /nfs/dbraw/zinc/97/87/49/478978749.db2.gz SMROFWORNSVOSY-CZUORRHYSA-N 1 1 335.379 2.772 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000595781471 478994311 /nfs/dbraw/zinc/99/43/11/478994311.db2.gz UKCUXFXDIKZPGD-DYEKYZERSA-N 1 1 335.404 2.730 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000595781471 478994314 /nfs/dbraw/zinc/99/43/14/478994314.db2.gz UKCUXFXDIKZPGD-DYEKYZERSA-N 1 1 335.404 2.730 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H]2COC[C@@H]2C1 ZINC000595826965 479020588 /nfs/dbraw/zinc/02/05/88/479020588.db2.gz BMKKQIPVDUBGNC-BNOWGMLFSA-N 1 1 344.371 2.674 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000592747224 479024115 /nfs/dbraw/zinc/02/41/15/479024115.db2.gz PRLHRUICVJNQFJ-ZDUSSCGKSA-N 1 1 345.403 2.533 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000592748651 479024908 /nfs/dbraw/zinc/02/49/08/479024908.db2.gz OQHSKWWZSPUANK-GFCCVEGCSA-N 1 1 328.372 2.894 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000592755803 479029302 /nfs/dbraw/zinc/02/93/02/479029302.db2.gz ZLEVFHQAOJSBAX-ZDUSSCGKSA-N 1 1 330.388 2.664 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000592780974 479040642 /nfs/dbraw/zinc/04/06/42/479040642.db2.gz SPALPFHMYAPKNG-SNVBAGLBSA-N 1 1 342.359 2.820 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000595874030 479044783 /nfs/dbraw/zinc/04/47/83/479044783.db2.gz REHYXYBEXBDUGC-UHFFFAOYSA-N 1 1 336.436 2.552 10 5 EFBEMO C[N@H+]1C[C@@H](CNC(=O)c2csc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000592883190 479088620 /nfs/dbraw/zinc/08/86/20/479088620.db2.gz YUKBGXFBMPPIEC-CABCVRRESA-N 1 1 345.424 2.732 10 5 EFBEMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCO[C@H](C(F)F)CC2)cc1 ZINC000601976334 479105173 /nfs/dbraw/zinc/10/51/73/479105173.db2.gz POQRHWLRZDRASK-AWEZNQCLSA-N 1 1 330.331 2.720 10 5 EFBEMO COc1cc(CNC[C@H]2CC[N@H+]2C2CCCC2)c([N+](=O)[O-])cc1OC ZINC000598999125 479120926 /nfs/dbraw/zinc/12/09/26/479120926.db2.gz JRENTJVVRBTMEG-OAHLLOKOSA-N 1 1 349.431 2.719 10 5 EFBEMO COc1cc(C[NH2+]C[C@H]2CCN2C2CCCC2)c([N+](=O)[O-])cc1OC ZINC000598999125 479120931 /nfs/dbraw/zinc/12/09/31/479120931.db2.gz JRENTJVVRBTMEG-OAHLLOKOSA-N 1 1 349.431 2.719 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C(C)C)C2CCOCC2)c1 ZINC000593018067 479126989 /nfs/dbraw/zinc/12/69/89/479126989.db2.gz JWBWTDSEJVDASA-UHFFFAOYSA-N 1 1 336.388 2.771 10 5 EFBEMO COC[C@H]([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1ccccc1 ZINC000593019669 479129325 /nfs/dbraw/zinc/12/93/25/479129325.db2.gz IKUWVBCCUHNENI-INIZCTEOSA-N 1 1 344.367 2.859 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c1 ZINC000593030031 479132905 /nfs/dbraw/zinc/13/29/05/479132905.db2.gz HVERUNFCONXGAQ-UAGQMJEPSA-N 1 1 348.399 2.507 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCCC[C@@H]2CCO)c1 ZINC000593030916 479133524 /nfs/dbraw/zinc/13/35/24/479133524.db2.gz QEVNKMIOEPYILR-OAHLLOKOSA-N 1 1 336.388 2.508 10 5 EFBEMO COCC[N@H+]1CCC[C@@H]1CNc1ccc2cnccc2c1[N+](=O)[O-] ZINC000599040573 479135007 /nfs/dbraw/zinc/13/50/07/479135007.db2.gz KEKZSSQNKSJIRD-CQSZACIVSA-N 1 1 330.388 2.666 10 5 EFBEMO C[N@H+]1CCC[C@@H]1CN(Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000593036268 479136164 /nfs/dbraw/zinc/13/61/64/479136164.db2.gz WUKYLFMJULGIMG-KZNAEPCWSA-N 1 1 347.459 2.795 10 5 EFBEMO CN1CCC[C@@H]1C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000593036268 479136170 /nfs/dbraw/zinc/13/61/70/479136170.db2.gz WUKYLFMJULGIMG-KZNAEPCWSA-N 1 1 347.459 2.795 10 5 EFBEMO CN1CCC[C@@H]1C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000593036268 479136172 /nfs/dbraw/zinc/13/61/72/479136172.db2.gz WUKYLFMJULGIMG-KZNAEPCWSA-N 1 1 347.459 2.795 10 5 EFBEMO Cc1cn2c([nH+]1)C[C@H](c1nc(Cc3ccccc3[N+](=O)[O-])no1)CC2 ZINC000599114075 479165015 /nfs/dbraw/zinc/16/50/15/479165015.db2.gz UKEZVZHTHSWRRU-CYBMUJFWSA-N 1 1 339.355 2.804 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)OCC12CCC2 ZINC000593093020 479170960 /nfs/dbraw/zinc/17/09/60/479170960.db2.gz QVKZURGYBSZCNM-AWEZNQCLSA-N 1 1 347.415 2.875 10 5 EFBEMO COC(=O)c1c(Cl)c(N2C[C@@H](C)[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000596180027 479183015 /nfs/dbraw/zinc/18/30/15/479183015.db2.gz WSAPUXZSDLQIQH-NXEZZACHSA-N 1 1 341.795 2.564 10 5 EFBEMO COC(=O)c1c(Cl)c(N2C[C@@H](C)[N@@H+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000596180027 479183019 /nfs/dbraw/zinc/18/30/19/479183019.db2.gz WSAPUXZSDLQIQH-NXEZZACHSA-N 1 1 341.795 2.564 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c2c(c1)COCO2 ZINC000593116641 479184570 /nfs/dbraw/zinc/18/45/70/479184570.db2.gz NCBUUOYVFZNKRT-CQSZACIVSA-N 1 1 326.299 2.692 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c2c(c1)COCO2 ZINC000593116641 479184577 /nfs/dbraw/zinc/18/45/77/479184577.db2.gz NCBUUOYVFZNKRT-CQSZACIVSA-N 1 1 326.299 2.692 10 5 EFBEMO COC(=O)c1c(Cl)c(N2CC[N@H+](C)[C@@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000596181935 479185443 /nfs/dbraw/zinc/18/54/43/479185443.db2.gz HWTQKALXKODYDV-UWVGGRQHSA-N 1 1 341.795 2.564 10 5 EFBEMO COc1ccc(OCC[N@H+]2CC[C@@]3(CC3(F)F)C2)c([N+](=O)[O-])c1 ZINC000593117114 479185547 /nfs/dbraw/zinc/18/55/47/479185547.db2.gz OWBOMIIIASCHFV-CQSZACIVSA-N 1 1 328.315 2.713 10 5 EFBEMO COC(=O)c1c(Cl)c(N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000596181935 479185454 /nfs/dbraw/zinc/18/54/54/479185454.db2.gz HWTQKALXKODYDV-UWVGGRQHSA-N 1 1 341.795 2.564 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593119349 479187569 /nfs/dbraw/zinc/18/75/69/479187569.db2.gz WFECGTQVGTXBOQ-YGRLFVJLSA-N 1 1 325.315 2.653 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593119349 479187574 /nfs/dbraw/zinc/18/75/74/479187574.db2.gz WFECGTQVGTXBOQ-YGRLFVJLSA-N 1 1 325.315 2.653 10 5 EFBEMO O=C1CCc2cc([N+](=O)[O-])c(NC[C@H]3CC[N@H+]3C3CCCC3)cc2N1 ZINC000599165256 479189887 /nfs/dbraw/zinc/18/98/87/479189887.db2.gz PEJWIAGOTWXYPX-CQSZACIVSA-N 1 1 344.415 2.908 10 5 EFBEMO CC1(C)CC(C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)C1 ZINC000599266622 479227508 /nfs/dbraw/zinc/22/75/08/479227508.db2.gz KOXUYKAMDXZDIF-UHFFFAOYSA-N 1 1 337.445 2.850 10 5 EFBEMO CCOc1cccc(N2CCC([N@H+]3CCCOCC3)CC2)c1[N+](=O)[O-] ZINC000596267969 479232772 /nfs/dbraw/zinc/23/27/72/479232772.db2.gz DSTIFCGUMVSNDF-UHFFFAOYSA-N 1 1 349.431 2.685 10 5 EFBEMO C[C@@H]1CCC[C@@H](C)[NH+]1CCNCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000574191856 479237838 /nfs/dbraw/zinc/23/78/38/479237838.db2.gz KBWNNFFMUKGBPI-HUUCEWRRSA-N 1 1 348.447 2.776 10 5 EFBEMO COC(=O)c1cc(NC[C@@H]2CC[N@H+]2C(C)(C)C)cc(C)c1[N+](=O)[O-] ZINC000596309361 479247776 /nfs/dbraw/zinc/24/77/76/479247776.db2.gz ZKORQDOHQKXOLT-ZDUSSCGKSA-N 1 1 335.404 2.975 10 5 EFBEMO CCN(C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](C)C1 ZINC000596358244 479265225 /nfs/dbraw/zinc/26/52/25/479265225.db2.gz ZDSWZTWFSTXUNL-QGZVFWFLSA-N 1 1 348.447 2.653 10 5 EFBEMO C[N@H+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@@H]1C(C)(C)C ZINC000603144073 479272361 /nfs/dbraw/zinc/27/23/61/479272361.db2.gz VQXKEHREMIAGMZ-MRXNPFEDSA-N 1 1 333.432 2.716 10 5 EFBEMO C[C@H]1C[C@H]1C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000599370497 479273733 /nfs/dbraw/zinc/27/37/33/479273733.db2.gz IXZRMFFUJLBFKK-STQMWFEESA-N 1 1 329.404 2.639 10 5 EFBEMO O=[N+]([O-])c1ccc(NCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c(F)c1 ZINC000596424606 479288543 /nfs/dbraw/zinc/28/85/43/479288543.db2.gz UAQRPXRAMKIVGC-INIZCTEOSA-N 1 1 345.374 2.913 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](C(F)F)C2)cccc1[N+](=O)[O-] ZINC000611179384 479303212 /nfs/dbraw/zinc/30/32/12/479303212.db2.gz CADRALRXBDZFBM-NSHDSACASA-N 1 1 327.331 2.819 10 5 EFBEMO Cc1ccc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c([N+](=O)[O-])c1 ZINC000596514095 479323043 /nfs/dbraw/zinc/32/30/43/479323043.db2.gz HUTKDVOMJKHLSL-IAGOWNOFSA-N 1 1 331.416 2.959 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599552423 479329621 /nfs/dbraw/zinc/32/96/21/479329621.db2.gz CAAYZUCQAPVIHD-KGLIPLIRSA-N 1 1 335.429 2.812 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599552423 479329626 /nfs/dbraw/zinc/32/96/26/479329626.db2.gz CAAYZUCQAPVIHD-KGLIPLIRSA-N 1 1 335.429 2.812 10 5 EFBEMO O=C1[C@H]([N@H+]2CC[C@H]3CC[C@@H](C2)S3)CCN1c1cccc([N+](=O)[O-])c1 ZINC000599552805 479331895 /nfs/dbraw/zinc/33/18/95/479331895.db2.gz IYRIWPKQSDTYDT-OWCLPIDISA-N 1 1 347.440 2.670 10 5 EFBEMO CC1(C)Cc2n[nH]cc2C[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000596598446 479353416 /nfs/dbraw/zinc/35/34/16/479353416.db2.gz GIHRQYDCIUIOPH-UHFFFAOYSA-N 1 1 330.388 2.781 10 5 EFBEMO CC1(C)Cc2n[nH]cc2C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000596598374 479353439 /nfs/dbraw/zinc/35/34/39/479353439.db2.gz DIZZVTBVXDXMQS-UHFFFAOYSA-N 1 1 330.388 2.781 10 5 EFBEMO CN(CC[N@H+]1CCOC(C)(C)C1)c1ccnc2cc([N+](=O)[O-])ccc21 ZINC000593469152 479355734 /nfs/dbraw/zinc/35/57/34/479355734.db2.gz MGZWADNCKRTZGK-UHFFFAOYSA-N 1 1 344.415 2.690 10 5 EFBEMO C[N@@H+]1CCCC[C@@H]1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000586835981 479361965 /nfs/dbraw/zinc/36/19/65/479361965.db2.gz UDFCMKBHJIYZDB-GFCCVEGCSA-N 1 1 342.193 2.780 10 5 EFBEMO C[N@H+]1CCCC[C@@H]1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000586835981 479361968 /nfs/dbraw/zinc/36/19/68/479361968.db2.gz UDFCMKBHJIYZDB-GFCCVEGCSA-N 1 1 342.193 2.780 10 5 EFBEMO CCN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC)[C@@H]1CC[N@@H+](CC)C1 ZINC000596624134 479362752 /nfs/dbraw/zinc/36/27/52/479362752.db2.gz FJDZRTAUGCVCRS-CYBMUJFWSA-N 1 1 336.392 2.551 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)[C@@H]2CCC[C@@H]21 ZINC000599651467 479369624 /nfs/dbraw/zinc/36/96/24/479369624.db2.gz BTZSVEFYIFFBPZ-RBSFLKMASA-N 1 1 348.399 2.767 10 5 EFBEMO C[C@H]1CCC[N@@H+](CCCCNc2cc(N)c([N+](=O)[O-])c(CO)c2)C1 ZINC000587240128 479370427 /nfs/dbraw/zinc/37/04/27/479370427.db2.gz ODQQWIHSAAPPPX-ZDUSSCGKSA-N 1 1 336.436 2.593 10 5 EFBEMO CCCC[N@H+]1CCCC[C@@H]1CNc1cc(N)c([N+](=O)[O-])c(CO)c1 ZINC000587626452 479373064 /nfs/dbraw/zinc/37/30/64/479373064.db2.gz ULWUHXLDSPZWTF-OAHLLOKOSA-N 1 1 336.436 2.736 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@@H]2CCC[C@@H]21 ZINC000599661166 479376601 /nfs/dbraw/zinc/37/66/01/479376601.db2.gz SKWYYFYTBXWVPY-RBSFLKMASA-N 1 1 348.399 2.767 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H]2CCC[C@H]21 ZINC000599661100 479377286 /nfs/dbraw/zinc/37/72/86/479377286.db2.gz SCWOOSQOUZYVOS-BBWFWOEESA-N 1 1 348.399 2.637 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H]2CCC[C@@H]21 ZINC000599661103 479377496 /nfs/dbraw/zinc/37/74/96/479377496.db2.gz SCWOOSQOUZYVOS-BRWVUGGUSA-N 1 1 348.399 2.637 10 5 EFBEMO C[N@H+]1CC[C@@H](Nc2cc(N)c([N+](=O)[O-])c(CO)c2)[C@H]1c1ccccc1 ZINC000588007911 479382910 /nfs/dbraw/zinc/38/29/10/479382910.db2.gz MKEXCIORZODVHB-SJLPKXTDSA-N 1 1 342.399 2.527 10 5 EFBEMO C[N@H+]1CC[C@@H](Nc2cc(N)c([N+](=O)[O-])c(CO)c2)[C@@H]1c1ccccc1 ZINC000588007909 479383118 /nfs/dbraw/zinc/38/31/18/479383118.db2.gz MKEXCIORZODVHB-AEFFLSMTSA-N 1 1 342.399 2.527 10 5 EFBEMO C[C@]12CCCC[C@H]1C[N@H+]2CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000599675571 479385524 /nfs/dbraw/zinc/38/55/24/479385524.db2.gz RYCKAZFTXAUNMK-KSSFIOAISA-N 1 1 329.400 2.748 10 5 EFBEMO COc1ccc(NC(=O)C[N@@H+]2C[C@@H]3CCCC[C@@]32C)c([N+](=O)[O-])c1 ZINC000599675621 479385842 /nfs/dbraw/zinc/38/58/42/479385842.db2.gz SUHFHTOYYPXQIA-SJCJKPOMSA-N 1 1 333.388 2.806 10 5 EFBEMO COc1ccc(NC(=O)C[N@H+]2C[C@@H]3CCCC[C@@]32C)c([N+](=O)[O-])c1 ZINC000599675621 479385848 /nfs/dbraw/zinc/38/58/48/479385848.db2.gz SUHFHTOYYPXQIA-SJCJKPOMSA-N 1 1 333.388 2.806 10 5 EFBEMO Cc1noc([C@@H]2OCC[C@@H]2[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000599684914 479390409 /nfs/dbraw/zinc/39/04/09/479390409.db2.gz JKCFEUFSAKYGFD-WCQYABFASA-N 1 1 338.751 2.559 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@@H](c3ccncn3)C2)ccc1[N+](=O)[O-] ZINC000611515337 479402486 /nfs/dbraw/zinc/40/24/86/479402486.db2.gz JYGDNIZYKOYBQJ-CQSZACIVSA-N 1 1 328.372 2.773 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000593615186 479402948 /nfs/dbraw/zinc/40/29/48/479402948.db2.gz NEMSQBVSOFGLQK-UHFFFAOYSA-N 1 1 346.362 2.645 10 5 EFBEMO COc1ccc(NC(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599769853 479419526 /nfs/dbraw/zinc/41/95/26/479419526.db2.gz BYXOUTGRVSPHML-CQSZACIVSA-N 1 1 348.403 2.742 10 5 EFBEMO CC(C)C[N@@H+](C)CCC[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000593717012 479432742 /nfs/dbraw/zinc/43/27/42/479432742.db2.gz XARUPGCEULQOOT-HZPDHXFCSA-N 1 1 337.468 2.843 10 5 EFBEMO C[C@H]1C[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)CC[N@H+]1C ZINC000599832241 479443434 /nfs/dbraw/zinc/44/34/34/479443434.db2.gz TYGBZTVHQACPKJ-RYUDHWBXSA-N 1 1 343.387 2.747 10 5 EFBEMO CC(C)c1ccc(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)cc1[N+](=O)[O-] ZINC000588816537 479443878 /nfs/dbraw/zinc/44/38/78/479443878.db2.gz WQALVOZAHPNLMF-CVEARBPZSA-N 1 1 349.406 2.977 10 5 EFBEMO CCC[N@H+]1CC[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599834927 479445439 /nfs/dbraw/zinc/44/54/39/479445439.db2.gz PJSJRZSGFZLEFP-GFCCVEGCSA-N 1 1 343.387 2.749 10 5 EFBEMO Cn1cc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)nn1 ZINC000611931197 479525371 /nfs/dbraw/zinc/52/53/71/479525371.db2.gz IZWNZUSNVOXRDZ-UHFFFAOYSA-N 1 1 329.385 2.742 10 5 EFBEMO CCOC[C@H]1CCC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC000589500011 479533858 /nfs/dbraw/zinc/53/38/58/479533858.db2.gz OYOXBTJPICYFQM-ZDUSSCGKSA-N 1 1 336.388 2.630 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000589502202 479534104 /nfs/dbraw/zinc/53/41/04/479534104.db2.gz OOIRZGHVAFAALA-BBRMVZONSA-N 1 1 349.431 2.686 10 5 EFBEMO CC[C@H](C)[N@@H+](C)CCNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597091665 479568968 /nfs/dbraw/zinc/56/89/68/479568968.db2.gz BXXNQDLACYGDOJ-VIFPVBQESA-N 1 1 343.815 2.682 10 5 EFBEMO C[N@H+]1C[C@H]2CCN(Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)[C@H]2C1 ZINC000590052936 479596835 /nfs/dbraw/zinc/59/68/35/479596835.db2.gz QRWBQCKEUGZGRP-CJNGLKHVSA-N 1 1 344.440 2.854 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](Cn2ccnn2)C1 ZINC000597172761 479605209 /nfs/dbraw/zinc/60/52/09/479605209.db2.gz CCBPAYLHHATVRL-MBSJSRAVSA-N 1 1 327.388 2.612 10 5 EFBEMO 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327.384 2.698 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCO[C@H](C3CCCCC3)C2)cc1 ZINC000755306911 575572851 /nfs/dbraw/zinc/57/28/51/575572851.db2.gz KKPMUFXZYULXBM-ROUUACIJSA-N 1 1 334.416 2.909 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCO[C@H](C3CCCCC3)C2)cc1 ZINC000755306911 575572853 /nfs/dbraw/zinc/57/28/53/575572853.db2.gz KKPMUFXZYULXBM-ROUUACIJSA-N 1 1 334.416 2.909 10 5 EFBEMO CCC[N@H+]1CCC[C@H]1C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000756993385 575808632 /nfs/dbraw/zinc/80/86/32/575808632.db2.gz SMPKKFOIBVVRPS-AWEZNQCLSA-N 1 1 325.796 2.739 10 5 EFBEMO CCC[N@H+]1CCC[C@@H]1C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000756993386 575808702 /nfs/dbraw/zinc/80/87/02/575808702.db2.gz SMPKKFOIBVVRPS-CQSZACIVSA-N 1 1 325.796 2.739 10 5 EFBEMO O=C1C[C@H]([C@@H]2CCCC[N@@H+]2Cc2cc(Cl)ccc2[N+](=O)[O-])CN1 ZINC000764466765 576461075 /nfs/dbraw/zinc/46/10/75/576461075.db2.gz QTAZDZDUAPMSCM-FZMZJTMJSA-N 1 1 337.807 2.739 10 5 EFBEMO CCOc1ccc(C(=O)OCCCn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000767540610 577212540 /nfs/dbraw/zinc/21/25/40/577212540.db2.gz DJUTWJQFRYTVQO-UHFFFAOYSA-N 1 1 333.344 2.746 10 5 EFBEMO C[C@@](CO)([NH2+]Cc1ccnn1C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000922308228 1265438449 /nfs/dbraw/zinc/43/84/49/1265438449.db2.gz WKWCXORFUPRYCO-KRWDZBQOSA-N 1 1 330.388 2.514 10 5 EFBEMO CCC[N@@H+](CCNC(=O)[C@H]1C[C@H]2C[C@H]2C1)Cc1cccc([N+](=O)[O-])c1 ZINC001691188953 1248519297 /nfs/dbraw/zinc/51/92/97/1248519297.db2.gz KRPXZELOAYDNKE-FVQHAEBGSA-N 1 1 345.443 2.969 10 5 EFBEMO O=[N+]([O-])c1cccc(Br)c1C[NH2+][C@@H]1C[C@H](O)C12CCC2 ZINC000850388129 1250459901 /nfs/dbraw/zinc/45/99/01/1250459901.db2.gz IGBTXWAYFYLZTA-OLZOCXBDSA-N 1 1 341.205 2.750 10 5 EFBEMO CCOP(=O)(OCC)[C@@H](O)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000851715492 1251217460 /nfs/dbraw/zinc/21/74/60/1251217460.db2.gz WJYXBQIWZXBTGE-CQSZACIVSA-N 1 1 346.320 2.611 10 5 EFBEMO C[C@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc(NC(=O)C2CC2)cc1 ZINC001168581267 1258035713 /nfs/dbraw/zinc/03/57/13/1258035713.db2.gz SZXSULRHUKWWSD-NSHDSACASA-N 1 1 343.387 2.528 10 5 EFBEMO C[C@H]1[C@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[N@H+]1C ZINC000922557332 1266253579 /nfs/dbraw/zinc/25/35/79/1266253579.db2.gz OEHUDWNIUGSRKS-XHDPSFHLSA-N 1 1 332.429 2.901 10 5 EFBEMO C[C@H]1[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCN1C ZINC000922557332 1266253586 /nfs/dbraw/zinc/25/35/86/1266253586.db2.gz OEHUDWNIUGSRKS-XHDPSFHLSA-N 1 1 332.429 2.901 10 5 EFBEMO CC(C)CC(=O)NCC1=CC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001486503253 1263251378 /nfs/dbraw/zinc/25/13/78/1263251378.db2.gz WNGSHHOIHYIYRD-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO CC(C)CC(=O)NCC1=CC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001486503253 1263251386 /nfs/dbraw/zinc/25/13/86/1263251386.db2.gz WNGSHHOIHYIYRD-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)cc1Cl ZINC000824655848 1278222460 /nfs/dbraw/zinc/22/24/60/1278222460.db2.gz ZZFJNYFVYNJYOM-XJKCOSOUSA-N 1 1 340.807 2.610 10 5 EFBEMO CCOc1cc(NC(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000823366337 1265317764 /nfs/dbraw/zinc/31/77/64/1265317764.db2.gz HMIYBPCQLKBHDC-RYUDHWBXSA-N 1 1 336.392 2.550 10 5 EFBEMO Nc1ccc(NCc2ccc(C[NH+]3CCOCC3)cc2)c([N+](=O)[O-])c1 ZINC000804332174 1273024853 /nfs/dbraw/zinc/02/48/53/1273024853.db2.gz YOOIVCWPDYBFLJ-UHFFFAOYSA-N 1 1 342.399 2.621 10 5 EFBEMO C[C@H]1[C@H](CO)CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC001169812152 1273178539 /nfs/dbraw/zinc/17/85/39/1273178539.db2.gz QZBKVGDLASFFCL-UWVGGRQHSA-N 1 1 329.194 2.560 10 5 EFBEMO C[C@H]1[C@H](CO)CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC001169812152 1273178545 /nfs/dbraw/zinc/17/85/45/1273178545.db2.gz QZBKVGDLASFFCL-UWVGGRQHSA-N 1 1 329.194 2.560 10 5 EFBEMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CN(C2CC2)C(=O)O1 ZINC000844282976 1278861978 /nfs/dbraw/zinc/86/19/78/1278861978.db2.gz YDBZQFLAZCSPAP-MRXNPFEDSA-N 1 1 333.388 2.788 10 5 EFBEMO O=C1O[C@H](C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CN1C1CC1 ZINC000844338536 1278896671 /nfs/dbraw/zinc/89/66/71/1278896671.db2.gz QLUVDNPREBYHNY-RHSMWYFYSA-N 1 1 345.399 2.757 10 5 EFBEMO O=C1O[C@H](C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CN1C1CC1 ZINC000844338538 1278896824 /nfs/dbraw/zinc/89/68/24/1278896824.db2.gz QLUVDNPREBYHNY-WMLDXEAASA-N 1 1 345.399 2.757 10 5 EFBEMO CCc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)nc1 ZINC000815010165 1287246054 /nfs/dbraw/zinc/24/60/54/1287246054.db2.gz UMEJUFAAWFTXGG-UHFFFAOYSA-N 1 1 326.400 2.874 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1c[nH+]c2n1CCCC2 ZINC000791387756 1278077076 /nfs/dbraw/zinc/07/70/76/1278077076.db2.gz DDVGDFUIYWKOEY-RAXLEYEMSA-N 1 1 340.383 2.847 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000844655510 1279139966 /nfs/dbraw/zinc/13/99/66/1279139966.db2.gz FGIJSCNPHUNJNA-UHFFFAOYSA-N 1 1 329.347 2.581 10 5 EFBEMO CCOc1cc(N2CC[NH+](Cc3ccoc3)CC2)ccc1[N+](=O)[O-] ZINC000793302811 1279515008 /nfs/dbraw/zinc/51/50/08/1279515008.db2.gz OCYIUUPPSWDJCT-UHFFFAOYSA-N 1 1 331.372 2.909 10 5 EFBEMO C[C@@H]([NH2+][C@@H]1CCCc2c1cnn2CCO)c1c(F)cccc1[N+](=O)[O-] ZINC000872026762 1287404418 /nfs/dbraw/zinc/40/44/18/1287404418.db2.gz HIXXEJARXOMXEM-BXUZGUMPSA-N 1 1 348.378 2.651 10 5 EFBEMO C[C@@H](NCCCC[N@@H+]1CCC[C@@H]1CO)c1c(F)cccc1[N+](=O)[O-] ZINC000872035006 1287407924 /nfs/dbraw/zinc/40/79/24/1287407924.db2.gz JMZGIJCDINKCJI-ZIAGYGMSSA-N 1 1 339.411 2.621 10 5 EFBEMO C[C@@H](NCCCC[N@H+]1CCC[C@@H]1CO)c1c(F)cccc1[N+](=O)[O-] ZINC000872035006 1287407930 /nfs/dbraw/zinc/40/79/30/1287407930.db2.gz JMZGIJCDINKCJI-ZIAGYGMSSA-N 1 1 339.411 2.621 10 5 EFBEMO C[C@@H](NCCC[N@H+]1CCCO[C@H](C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872065565 1287417333 /nfs/dbraw/zinc/41/73/33/1287417333.db2.gz DNRUMIXCJJTFDS-ZIAGYGMSSA-N 1 1 339.411 2.885 10 5 EFBEMO CCOC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872064359 1287417595 /nfs/dbraw/zinc/41/75/95/1287417595.db2.gz YCYADNODMIPSMZ-WDEREUQCSA-N 1 1 325.340 2.615 10 5 EFBEMO C[C@H]([NH2+][C@H](CO)C[C@H](O)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872070646 1287419478 /nfs/dbraw/zinc/41/94/78/1287419478.db2.gz VTSVRWBOJWAOBX-MJVIPROJSA-N 1 1 328.384 2.543 10 5 EFBEMO CCC[C@H](C)C(=O)NCC[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872073519 1287420597 /nfs/dbraw/zinc/42/05/97/1287420597.db2.gz QHSQALIFBWHXRS-RYUDHWBXSA-N 1 1 325.384 2.937 10 5 EFBEMO CSCC[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)N(C)C ZINC000872072687 1287420643 /nfs/dbraw/zinc/42/06/43/1287420643.db2.gz IXQSDXXXKLJVKB-JQWIXIFHSA-N 1 1 343.424 2.594 10 5 EFBEMO Cc1ccnc([C@@H]2CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000846972658 1280640229 /nfs/dbraw/zinc/64/02/29/1280640229.db2.gz XLZHWWSTGZSPNT-QAPCUYQASA-N 1 1 327.384 2.821 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@@H](C4CC4)C3)n2)c1 ZINC000808230020 1281598929 /nfs/dbraw/zinc/59/89/29/1281598929.db2.gz FQOCQFMGFSBCIC-OAHLLOKOSA-N 1 1 327.388 2.933 10 5 EFBEMO C[C@@H]1OCC[C@@H]1[N@H+](CCO)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809997927 1282733426 /nfs/dbraw/zinc/73/34/26/1282733426.db2.gz IZKJEYYXCDKPSE-ZANVPECISA-N 1 1 349.214 2.873 10 5 EFBEMO C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809997927 1282733433 /nfs/dbraw/zinc/73/34/33/1282733433.db2.gz IZKJEYYXCDKPSE-ZANVPECISA-N 1 1 349.214 2.873 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@]3(c4ccccc4)C[C@@H](O)C3)nc2c1 ZINC001175955016 1287645634 /nfs/dbraw/zinc/64/56/34/1287645634.db2.gz HBLWMROLHQHZEG-UJKQEGAGSA-N 1 1 338.367 2.611 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](c3ccccn3)C2)c1 ZINC000811500747 1284382817 /nfs/dbraw/zinc/38/28/17/1284382817.db2.gz MDTJWRZUYKCIKP-AWEZNQCLSA-N 1 1 341.367 2.766 10 5 EFBEMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@H]([C@H]4CCOC4)C3)c2c1 ZINC000747828702 1285552574 /nfs/dbraw/zinc/55/25/74/1285552574.db2.gz HPGFWKCZLQXIGS-GJZGRUSLSA-N 1 1 330.388 2.651 10 5 EFBEMO CSC[C@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172659 1285703081 /nfs/dbraw/zinc/70/30/81/1285703081.db2.gz PSODNGKNKKYBCD-WFASDCNBSA-N 1 1 338.429 2.711 10 5 EFBEMO CSC[C@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172659 1285703086 /nfs/dbraw/zinc/70/30/86/1285703086.db2.gz PSODNGKNKKYBCD-WFASDCNBSA-N 1 1 338.429 2.711 10 5 EFBEMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CC(F)(F)C1 ZINC000813172827 1285703244 /nfs/dbraw/zinc/70/32/44/1285703244.db2.gz OLSRMSCVXYAPGE-AWEZNQCLSA-N 1 1 340.326 2.758 10 5 EFBEMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CC(F)(F)C1 ZINC000813172827 1285703248 /nfs/dbraw/zinc/70/32/48/1285703248.db2.gz OLSRMSCVXYAPGE-AWEZNQCLSA-N 1 1 340.326 2.758 10 5 EFBEMO COCCCCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174145 1285703501 /nfs/dbraw/zinc/70/35/01/1285703501.db2.gz QPOYIVMGCFAHNR-INIZCTEOSA-N 1 1 336.388 2.529 10 5 EFBEMO COCCCCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174145 1285703506 /nfs/dbraw/zinc/70/35/06/1285703506.db2.gz QPOYIVMGCFAHNR-INIZCTEOSA-N 1 1 336.388 2.529 10 5 EFBEMO CC(C)[N@H+]1CCC[C@@H](C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC001179398718 1289121908 /nfs/dbraw/zinc/12/19/08/1289121908.db2.gz MDWGXVWXXGOKJV-LSDHHAIUSA-N 1 1 333.432 2.935 10 5 EFBEMO O=C(CC[N@H+]1CCCC[C@H]1[C@@H]1CCCO1)Nc1ccccc1[N+](=O)[O-] ZINC001176927496 1288176237 /nfs/dbraw/zinc/17/62/37/1288176237.db2.gz SLENAVGMHCNJHN-IRXDYDNUSA-N 1 1 347.415 2.957 10 5 EFBEMO Cc1ccc(NCCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)[nH+]c1 ZINC001178603239 1288834137 /nfs/dbraw/zinc/83/41/37/1288834137.db2.gz NCVZGRACXFPDIN-UHFFFAOYSA-N 1 1 334.763 2.794 10 5 EFBEMO CC[N@H+]1C[C@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C(C)(C)C1 ZINC001178856159 1288945057 /nfs/dbraw/zinc/94/50/57/1288945057.db2.gz IBLDITRAIZHGOV-ZDUSSCGKSA-N 1 1 325.796 2.708 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)Nc1ccc(C)c([N+](=O)[O-])c1N ZINC001179878636 1289303430 /nfs/dbraw/zinc/30/34/30/1289303430.db2.gz CKZIRFHBEVXEQC-LLVKDONJSA-N 1 1 331.376 2.834 10 5 EFBEMO CCc1c[nH]c2nc[nH+]c(NCCNc3ccccc3[N+](=O)[O-])c12 ZINC001184650611 1290487993 /nfs/dbraw/zinc/48/79/93/1290487993.db2.gz KDYLUPYCGFPBOI-UHFFFAOYSA-N 1 1 326.360 2.904 10 5 EFBEMO O=[N+]([O-])c1cnc2ccccc2c1N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC001186872770 1291030799 /nfs/dbraw/zinc/03/07/99/1291030799.db2.gz PVGRITZCFMROHG-HZPDHXFCSA-N 1 1 326.400 2.994 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H]1CCC3(CCOCC3)O1)C2 ZINC000878303264 1291613811 /nfs/dbraw/zinc/61/38/11/1291613811.db2.gz LRQMCDQTALDMME-OAHLLOKOSA-N 1 1 332.400 2.681 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H]1CCC3(CCOCC3)O1)C2 ZINC000878303264 1291613816 /nfs/dbraw/zinc/61/38/16/1291613816.db2.gz LRQMCDQTALDMME-OAHLLOKOSA-N 1 1 332.400 2.681 10 5 EFBEMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](C)CN1CCOCC1 ZINC001190527910 1292200510 /nfs/dbraw/zinc/20/05/10/1292200510.db2.gz IXQNRYCKBFWKHK-INIZCTEOSA-N 1 1 335.448 2.774 10 5 EFBEMO O=[N+]([O-])c1ccc(O)cc1CN1CC[NH+](CC2CCCCC2)CC1 ZINC001190635761 1292260478 /nfs/dbraw/zinc/26/04/78/1292260478.db2.gz OSAFFBBSQALGRX-UHFFFAOYSA-N 1 1 333.432 2.998 10 5 EFBEMO COC(=O)[C@]12CCC[C@H]1[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)CC2 ZINC000880183162 1292409482 /nfs/dbraw/zinc/40/94/82/1292409482.db2.gz AOXYMUVMSMJZMM-WBVHZDCISA-N 1 1 334.372 2.521 10 5 EFBEMO O=C(C[N@H+]1CCC[C@@H](C2CCC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001196255640 1294172906 /nfs/dbraw/zinc/17/29/06/1294172906.db2.gz XAQRKGMMOGSQQH-MRXNPFEDSA-N 1 1 343.427 2.996 10 5 EFBEMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCO[C@@H](c2ccccc2)CC1 ZINC001198704979 1295218002 /nfs/dbraw/zinc/21/80/02/1295218002.db2.gz FSIDZGYXICUHJD-MRXNPFEDSA-N 1 1 330.388 2.563 10 5 EFBEMO CC(C)(C)n1cncc1[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1 ZINC001198789908 1295232220 /nfs/dbraw/zinc/23/22/20/1295232220.db2.gz APCDBTQBBDGNNA-AWEZNQCLSA-N 1 1 346.435 2.622 10 5 EFBEMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000826585010 1295550578 /nfs/dbraw/zinc/55/05/78/1295550578.db2.gz KRMUIXIZFPNYST-MRXNPFEDSA-N 1 1 347.459 2.945 10 5 EFBEMO O=C(NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1F ZINC001273814405 1296053758 /nfs/dbraw/zinc/05/37/58/1296053758.db2.gz HSAYTFASNIYNHU-ARJAWSKDSA-N 1 1 349.387 2.871 10 5 EFBEMO C[N@H+]1CCCC[C@H]1CCC(=O)OCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000803857499 1313260719 /nfs/dbraw/zinc/26/07/19/1313260719.db2.gz XFLHSRYTNSYZTF-AWEZNQCLSA-N 1 1 334.372 2.585 10 5 EFBEMO COc1cc(COC(=O)CC[C@@H]2CCCC[N@H+]2C)ccc1[N+](=O)[O-] ZINC000803859472 1313265085 /nfs/dbraw/zinc/26/50/85/1313265085.db2.gz PVUOVRMCGZSCDT-AWEZNQCLSA-N 1 1 336.388 2.911 10 5 EFBEMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]2C[N@H+](C)C[C@@H]21 ZINC000931626077 1297358750 /nfs/dbraw/zinc/35/87/50/1297358750.db2.gz NOYDXSHQIVWBEN-YGRLFVJLSA-N 1 1 338.795 2.724 10 5 EFBEMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCc3nc[nH]c3C23CCC3)cc1 ZINC000931679124 1297361138 /nfs/dbraw/zinc/36/11/38/1297361138.db2.gz KIFYPHATICGJTH-UHFFFAOYSA-N 1 1 328.372 2.634 10 5 EFBEMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCc3nc[nH]c3C23CCC3)cc1 ZINC000931679124 1297361150 /nfs/dbraw/zinc/36/11/50/1297361150.db2.gz KIFYPHATICGJTH-UHFFFAOYSA-N 1 1 328.372 2.634 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1[nH]ccc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001490326004 1298773116 /nfs/dbraw/zinc/77/31/16/1298773116.db2.gz QIROWOTUBQRKCF-UHFFFAOYSA-N 1 1 344.415 2.873 10 5 EFBEMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585842 1299652927 /nfs/dbraw/zinc/65/29/27/1299652927.db2.gz ANCNKVZUMVKQRG-ACJLOTCBSA-N 1 1 330.384 2.897 10 5 EFBEMO COC(=O)N(C)CC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000852568486 1299762379 /nfs/dbraw/zinc/76/23/79/1299762379.db2.gz GSVZGRNKQDHHCE-UHFFFAOYSA-N 1 1 349.309 2.744 10 5 EFBEMO COC(=O)N(C)CC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000852568486 1299762390 /nfs/dbraw/zinc/76/23/90/1299762390.db2.gz GSVZGRNKQDHHCE-UHFFFAOYSA-N 1 1 349.309 2.744 10 5 EFBEMO C[C@]12COC[C@@H]1C[N@H+](Cn1c3cc([N+](=O)[O-])ccc3oc1=S)C2 ZINC000853565559 1300168578 /nfs/dbraw/zinc/16/85/78/1300168578.db2.gz HEMCNMDSAGDSHS-BONVTDFDSA-N 1 1 335.385 2.798 10 5 EFBEMO C[C@]12COC[C@@H]1C[N@@H+](Cn1c3cc([N+](=O)[O-])ccc3oc1=S)C2 ZINC000853565559 1300168589 /nfs/dbraw/zinc/16/85/89/1300168589.db2.gz HEMCNMDSAGDSHS-BONVTDFDSA-N 1 1 335.385 2.798 10 5 EFBEMO C[C@]12COC[C@H]1C[N@H+](Cn1c3cc([N+](=O)[O-])ccc3oc1=S)C2 ZINC000853565558 1300168958 /nfs/dbraw/zinc/16/89/58/1300168958.db2.gz HEMCNMDSAGDSHS-BMIGLBTASA-N 1 1 335.385 2.798 10 5 EFBEMO C[C@]12COC[C@H]1C[N@@H+](Cn1c3cc([N+](=O)[O-])ccc3oc1=S)C2 ZINC000853565558 1300168964 /nfs/dbraw/zinc/16/89/64/1300168964.db2.gz HEMCNMDSAGDSHS-BMIGLBTASA-N 1 1 335.385 2.798 10 5 EFBEMO C[N@@H+](C[C@@H]1CC1(C)C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000853627861 1300199811 /nfs/dbraw/zinc/19/98/11/1300199811.db2.gz IBAJISBOHILWIS-GOEBONIOSA-N 1 1 331.416 2.846 10 5 EFBEMO 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2.673 10 5 EFBEMO O=[N+]([O-])c1cnc2ccc(NC[C@@H]3CC[N@H+]3C3CCCCCC3)nn21 ZINC000866192332 1303556817 /nfs/dbraw/zinc/55/68/17/1303556817.db2.gz IYBHEIVNYXCSGP-AWEZNQCLSA-N 1 1 344.419 2.847 10 5 EFBEMO CS[C@H]1C[C@H]([NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000866488811 1303659798 /nfs/dbraw/zinc/65/97/98/1303659798.db2.gz VBAUATRNLJPJRA-QEJZJMRPSA-N 1 1 332.429 2.901 10 5 EFBEMO CC[C@H](C[C@H](C)O)[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000866632906 1303722087 /nfs/dbraw/zinc/72/20/87/1303722087.db2.gz DGVXISHXLOFVQQ-JGGQBBKZSA-N 1 1 332.404 2.557 10 5 EFBEMO CC[C@H](C[C@H](C)O)[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000866632903 1303722544 /nfs/dbraw/zinc/72/25/44/1303722544.db2.gz DGVXISHXLOFVQQ-BJJXKVORSA-N 1 1 332.404 2.557 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])CC1 ZINC000867485833 1303829875 /nfs/dbraw/zinc/82/98/75/1303829875.db2.gz ZDPSNOIQQQSWOR-UHFFFAOYSA-N 1 1 346.362 2.645 10 5 EFBEMO 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WTJOMSCFCQAXRD-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1ccccn1)Cc1cccc([N+](=O)[O-])c1 ZINC001265096627 1316719565 /nfs/dbraw/zinc/71/95/65/1316719565.db2.gz GTVWWNNNSWLZGG-UHFFFAOYSA-N 1 1 342.399 2.632 10 5 EFBEMO CC[N@@H+](CCCNC(=O)C(C)(C)F)Cc1ccc([N+](=O)[O-])cc1 ZINC001265096559 1316719717 /nfs/dbraw/zinc/71/97/17/1316719717.db2.gz DMCHBGREXJRWSY-UHFFFAOYSA-N 1 1 325.384 2.671 10 5 EFBEMO Cc1cc(C(=O)NCCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)ccn1 ZINC001265940626 1316921957 /nfs/dbraw/zinc/92/19/57/1316921957.db2.gz FPJDVJMLXUXNKX-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO CC/C(C)=C/C(=O)N1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC001279363800 1317245582 /nfs/dbraw/zinc/24/55/82/1317245582.db2.gz WKROBSDBTIXNAK-ULFOHVRDSA-N 1 1 343.427 2.841 10 5 EFBEMO CCOc1cc(C(=O)Nc2cc(C)[nH+]c(C)c2)c([N+](=O)[O-])cc1OC ZINC001319644656 1328936451 /nfs/dbraw/zinc/93/64/51/1328936451.db2.gz DMWQFFXUXAOXQA-UHFFFAOYSA-N 1 1 345.355 2.688 10 5 EFBEMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cc(C)n1 ZINC001292323647 1322054519 /nfs/dbraw/zinc/05/45/19/1322054519.db2.gz CVFSCUCDNQXIJV-AWEZNQCLSA-N 1 1 334.420 2.683 10 5 EFBEMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2N)C1 ZINC001293349642 1322235346 /nfs/dbraw/zinc/23/53/46/1322235346.db2.gz DRPVLLLEWURBNP-ZDUSSCGKSA-N 1 1 348.447 2.807 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC[N@H+](C(C)C)C1 ZINC001296127059 1322856785 /nfs/dbraw/zinc/85/67/85/1322856785.db2.gz MDJJEFUWEZANPO-CYBMUJFWSA-N 1 1 335.404 2.596 10 5 EFBEMO C[N@H+](CCNC(=O)c1cc2occc2[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC001492275131 1324393951 /nfs/dbraw/zinc/39/39/51/1324393951.db2.gz CWRCEHKNEHNVSG-UHFFFAOYSA-N 1 1 342.355 2.531 10 5 EFBEMO C[N@@H+](CCNC(=O)c1cc2occc2[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC001492275131 1324393957 /nfs/dbraw/zinc/39/39/57/1324393957.db2.gz CWRCEHKNEHNVSG-UHFFFAOYSA-N 1 1 342.355 2.531 10 5 EFBEMO C[N@@H+](CCNC(=O)CCc1ccsc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001492280269 1324398004 /nfs/dbraw/zinc/39/80/04/1324398004.db2.gz TWIVLCJPGFSFTQ-UHFFFAOYSA-N 1 1 347.440 2.837 10 5 EFBEMO C[N@H+]1C[C@@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C(C)(C)C1 ZINC001303990302 1324630574 /nfs/dbraw/zinc/63/05/74/1324630574.db2.gz WCLCMCLFZPEFDB-GFCCVEGCSA-N 1 1 345.321 2.684 10 5 EFBEMO C[C@@H](CNc1c([N+](=O)[O-])c(C(F)(F)F)nn1C)[N@H+]1CCC[C@@H](C)C1 ZINC001306931473 1324732859 /nfs/dbraw/zinc/73/28/59/1324732859.db2.gz XKRVRJYBBGXUMN-ZJUUUORDSA-N 1 1 349.357 2.879 10 5 EFBEMO COCCC[N@@H+](C)CCNc1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC001306982403 1324736473 /nfs/dbraw/zinc/73/64/73/1324736473.db2.gz CVESKQMIIPJNID-UHFFFAOYSA-N 1 1 335.326 2.994 10 5 EFBEMO COC(=O)[C@@H]1CCCC[C@@H]1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001307523788 1324770341 /nfs/dbraw/zinc/77/03/41/1324770341.db2.gz PNDUWWFJQCYUBP-RHSMWYFYSA-N 1 1 332.400 2.932 10 5 EFBEMO C[N@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)CC(C)(C)O ZINC001307480463 1324770452 /nfs/dbraw/zinc/77/04/52/1324770452.db2.gz VFHPZOKTHSLUQE-UHFFFAOYSA-N 1 1 340.767 2.501 10 5 EFBEMO C[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)CC(C)(C)O ZINC001307480463 1324770456 /nfs/dbraw/zinc/77/04/56/1324770456.db2.gz VFHPZOKTHSLUQE-UHFFFAOYSA-N 1 1 340.767 2.501 10 5 EFBEMO CC[C@H]1CN(C)c2ccccc2C[N@H+]1CCn1c(C)ncc1[N+](=O)[O-] ZINC001307525067 1324771192 /nfs/dbraw/zinc/77/11/92/1324771192.db2.gz SWCMHKWDDBFWNL-INIZCTEOSA-N 1 1 343.431 2.830 10 5 EFBEMO C[C@H](CO)[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCC1 ZINC001307685024 1324776541 /nfs/dbraw/zinc/77/65/41/1324776541.db2.gz QGJPUENFPJWNLS-GFCCVEGCSA-N 1 1 346.387 2.770 10 5 EFBEMO C[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H](CC(N)=O)c1ccccc1 ZINC001307742974 1324778615 /nfs/dbraw/zinc/77/86/15/1324778615.db2.gz WOKBKWKVVLPFQQ-HNNXBMFYSA-N 1 1 331.347 2.782 10 5 EFBEMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H](CC(N)=O)c1ccccc1 ZINC001307742974 1324778619 /nfs/dbraw/zinc/77/86/19/1324778619.db2.gz WOKBKWKVVLPFQQ-HNNXBMFYSA-N 1 1 331.347 2.782 10 5 EFBEMO C[C@@H](CCO)[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001307892263 1324785299 /nfs/dbraw/zinc/78/52/99/1324785299.db2.gz GSQXVNYLHQKMLL-VIFPVBQESA-N 1 1 340.767 2.501 10 5 EFBEMO C[C@@H](CCO)[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001307892263 1324785307 /nfs/dbraw/zinc/78/53/07/1324785307.db2.gz GSQXVNYLHQKMLL-VIFPVBQESA-N 1 1 340.767 2.501 10 5 EFBEMO COC(=O)[C@]12CCC[C@H]1[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC2 ZINC001308056333 1324790874 /nfs/dbraw/zinc/79/08/74/1324790874.db2.gz KRXBNNPKWUKXMW-AEFFLSMTSA-N 1 1 348.399 2.781 10 5 EFBEMO CC[N@H+](CCNC(=O)c1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC001317473951 1324795754 /nfs/dbraw/zinc/79/57/54/1324795754.db2.gz APZPFNGCMAYTBQ-UHFFFAOYSA-N 1 1 327.384 2.847 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC001317473951 1324795760 /nfs/dbraw/zinc/79/57/60/1324795760.db2.gz APZPFNGCMAYTBQ-UHFFFAOYSA-N 1 1 327.384 2.847 10 5 EFBEMO Cc1cccnc1[C@@H](C)[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC001308152467 1324797209 /nfs/dbraw/zinc/79/72/09/1324797209.db2.gz DJDBHQHWCRWWNH-CYBMUJFWSA-N 1 1 328.372 2.612 10 5 EFBEMO C[N@@H+](CCCNC(=O)/C=C/c1ccc[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC001316817857 1325073084 /nfs/dbraw/zinc/07/30/84/1325073084.db2.gz BPVOYLRKHMNNRH-JXMROGBWSA-N 1 1 342.399 2.574 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1ncoc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001316885911 1325265486 /nfs/dbraw/zinc/26/54/86/1325265486.db2.gz NRHQKXPNVOVHFM-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO O=C(CCCC1CC1)N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21 ZINC001317212731 1327754877 /nfs/dbraw/zinc/75/48/77/1327754877.db2.gz IDHIWOVAYRHOIO-MNZLEMJZSA-N 1 1 343.427 2.722 10 5 EFBEMO Cc1cc(C)c(C(=O)NCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)o1 ZINC001317441678 1328030197 /nfs/dbraw/zinc/03/01/97/1328030197.db2.gz ARDSNPKYSJWFRV-UHFFFAOYSA-N 1 1 331.372 2.666 10 5 EFBEMO COc1ccsc1C(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001317468096 1328055780 /nfs/dbraw/zinc/05/57/80/1328055780.db2.gz QVNLNUMKQPHYNC-UHFFFAOYSA-N 1 1 349.412 2.527 10 5 EFBEMO COc1ccsc1C(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001317468096 1328055790 /nfs/dbraw/zinc/05/57/90/1328055790.db2.gz QVNLNUMKQPHYNC-UHFFFAOYSA-N 1 1 349.412 2.527 10 5 EFBEMO C[N@H+](CCNC(=O)c1c(F)cccc1F)Cc1cccc([N+](=O)[O-])c1 ZINC001317468615 1328056288 /nfs/dbraw/zinc/05/62/88/1328056288.db2.gz ASTFWNWJOGHJEW-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO C[N@@H+](CCNC(=O)c1c(F)cccc1F)Cc1cccc([N+](=O)[O-])c1 ZINC001317468615 1328056290 /nfs/dbraw/zinc/05/62/90/1328056290.db2.gz ASTFWNWJOGHJEW-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1coc(C)c1)Cc1cccc([N+](=O)[O-])c1 ZINC001317475596 1328060719 /nfs/dbraw/zinc/06/07/19/1328060719.db2.gz YZQKPISHKPQHAD-UHFFFAOYSA-N 1 1 331.372 2.748 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1cc[nH]c1)Cc1ccc([N+](=O)[O-])cc1 ZINC001317540091 1328126261 /nfs/dbraw/zinc/12/62/61/1328126261.db2.gz FOTGNKQMYXIARF-UHFFFAOYSA-N 1 1 330.388 2.565 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1ccsn1)Cc1ccc([N+](=O)[O-])cc1 ZINC001317541522 1328126692 /nfs/dbraw/zinc/12/66/92/1328126692.db2.gz XNAYDGYPIUJSBT-UHFFFAOYSA-N 1 1 348.428 2.693 10 5 EFBEMO O=C(CCC1CCC1)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001318116075 1328499209 /nfs/dbraw/zinc/49/92/09/1328499209.db2.gz ZDFNGNXWTWPKRA-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO CC(C)c1ccccc1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCC1 ZINC001326822647 1330369041 /nfs/dbraw/zinc/36/90/41/1330369041.db2.gz OJASDXXNRIYGBP-IAGOWNOFSA-N 1 1 345.443 2.604 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1ccoc1 ZINC001327187376 1330438543 /nfs/dbraw/zinc/43/85/43/1330438543.db2.gz HJUODLXQVPRAKM-UHFFFAOYSA-N 1 1 331.372 2.782 10 5 EFBEMO CN1CC[NH+](C(C)(C)CNc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC001329174649 1330677224 /nfs/dbraw/zinc/67/72/24/1330677224.db2.gz XGLFSUYGVCTPOH-UHFFFAOYSA-N 1 1 343.431 2.581 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3ncnc4c(Cl)cc([N+](=O)[O-])cc43)CC[C@H]21 ZINC001329748436 1330733422 /nfs/dbraw/zinc/73/34/22/1330733422.db2.gz KGFFUJNMDIAPTP-IINYFYTJSA-N 1 1 347.806 2.722 10 5 EFBEMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])cc2ccccc21)[N@@H+](C)C1CC1 ZINC001331865459 1330882348 /nfs/dbraw/zinc/88/23/48/1330882348.db2.gz GINMGHRJLYSTNE-GFCCVEGCSA-N 1 1 327.384 2.961 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)OCCC[N@H+]1CCO[C@@H](C)C1 ZINC001338203146 1331671832 /nfs/dbraw/zinc/67/18/32/1331671832.db2.gz SRHYAHQSZUZOGY-ZQHYZAEZSA-N 1 1 348.399 2.652 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001340992780 1332225421 /nfs/dbraw/zinc/22/54/21/1332225421.db2.gz VZNBBKQVWKYUMA-XYPHTWIQSA-N 1 1 331.416 2.689 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001340992777 1332225542 /nfs/dbraw/zinc/22/55/42/1332225542.db2.gz VZNBBKQVWKYUMA-XOKHGSTOSA-N 1 1 331.416 2.689 10 5 EFBEMO CCc1ccc(C(=O)OC[C@@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC001347391995 1332739657 /nfs/dbraw/zinc/73/96/57/1332739657.db2.gz PGSQHWOEOIYCHZ-INIZCTEOSA-N 1 1 348.399 2.567 10 5 EFBEMO C[C@H](NC(=O)[C@H]1CC[C@@H]2C[C@@H](C)C[N@H+]2C1)c1ccccc1[N+](=O)[O-] ZINC001347531135 1332753275 /nfs/dbraw/zinc/75/32/75/1332753275.db2.gz RCODYDOVASYDLR-CBBWQLFWSA-N 1 1 331.416 2.892 10 5 EFBEMO C[C@@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1C1CCCC1 ZINC001347813900 1332775315 /nfs/dbraw/zinc/77/53/15/1332775315.db2.gz OASNNOVJYSXNHL-CQSZACIVSA-N 1 1 331.416 2.613 10 5 EFBEMO COc1ccc(C(=O)N2CC[N@@H+](C3CCCC3)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001347813627 1332775381 /nfs/dbraw/zinc/77/53/81/1332775381.db2.gz LOVFMDDIPXINDI-ZDUSSCGKSA-N 1 1 347.415 2.692 10 5 EFBEMO Cc1ccc(C(=O)N2CC[N@@H+](C3CCCC3)[C@H](C)C2)cc1[N+](=O)[O-] ZINC001348349279 1332827480 /nfs/dbraw/zinc/82/74/80/1332827480.db2.gz OLMBLXVDKFRDQP-CQSZACIVSA-N 1 1 331.416 2.992 10 5 EFBEMO Cc1cc(C(=O)N2CC[N@@H+](C3CCCC3)[C@H](C)C2)c(N)c([N+](=O)[O-])c1 ZINC001348348355 1332827663 /nfs/dbraw/zinc/82/76/63/1332827663.db2.gz CEXIBERDIANDSW-CYBMUJFWSA-N 1 1 346.431 2.574 10 5 EFBEMO C[C@@H]1CN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])CC[N@H+]1C1CCCC1 ZINC001348349864 1332828057 /nfs/dbraw/zinc/82/80/57/1332828057.db2.gz TXPGWRMILMLVHI-CYBMUJFWSA-N 1 1 349.406 2.752 10 5 EFBEMO CC(C)(NC(=O)[C@H]1CC[C@H]2CCCC[N@H+]21)c1ccc([N+](=O)[O-])cc1 ZINC001350590224 1333100457 /nfs/dbraw/zinc/10/04/57/1333100457.db2.gz UTIVHZUXYKZGNI-GDBMZVCRSA-N 1 1 331.416 2.963 10 5 EFBEMO Cc1ccc([C@H](C)OC(=O)c2cc(C[NH+](C)C)on2)cc1[N+](=O)[O-] ZINC001355111834 1334700777 /nfs/dbraw/zinc/70/07/77/1334700777.db2.gz NKKFRRJUATUPKC-NSHDSACASA-N 1 1 333.344 2.871 10 5 EFBEMO CC[C@H]1CCC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848475118 1334734761 /nfs/dbraw/zinc/73/47/61/1334734761.db2.gz LYKNPIFZFDAOLU-YOEHRIQHSA-N 1 1 331.416 2.990 10 5 EFBEMO CC(C)[C@H]1CCC[N@H+]1CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848475708 1334735308 /nfs/dbraw/zinc/73/53/08/1334735308.db2.gz STEKXDMPUPUAQV-IAGOWNOFSA-N 1 1 331.416 2.989 10 5 EFBEMO CN(Cn1cc(-c2ccccc2[N+](=O)[O-])cn1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000848478244 1334735769 /nfs/dbraw/zinc/73/57/69/1334735769.db2.gz IVGQYTXODPAQOY-INIZCTEOSA-N 1 1 341.415 2.584 10 5 EFBEMO CCCC[N@@H+](CCOC)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848478085 1334735899 /nfs/dbraw/zinc/73/58/99/1334735899.db2.gz GBDFQPDIJUMKAI-KRWDZBQOSA-N 1 1 349.431 2.617 10 5 EFBEMO C[C@@H]1CCC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000848476973 1334736357 /nfs/dbraw/zinc/73/63/57/1334736357.db2.gz JKZKGGUQJZKGLU-RHSMWYFYSA-N 1 1 331.416 2.990 10 5 EFBEMO C[N@@H+](CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O)C(C1CC1)C1CC1 ZINC000848477245 1334736449 /nfs/dbraw/zinc/73/64/49/1334736449.db2.gz NRJBGYTUTVZTBP-KRWDZBQOSA-N 1 1 343.427 2.989 10 5 EFBEMO C[C@@H]([N@@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O)C1(C)CC1 ZINC000848481404 1334737512 /nfs/dbraw/zinc/73/75/12/1334737512.db2.gz CENYPWFEBDJLSY-CZUORRHYSA-N 1 1 331.416 2.989 10 5 EFBEMO CC[C@@H]1C[C@H](C)C[N@H+]1CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848481261 1334738053 /nfs/dbraw/zinc/73/80/53/1334738053.db2.gz XLVJTKUVNPDCRU-LXZKKBNFSA-N 1 1 331.416 2.989 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCC[C@@H]3COCC[C@H]32)c1 ZINC000848482667 1334740527 /nfs/dbraw/zinc/74/05/27/1334740527.db2.gz SSYGXKHNZDQUDB-RHSMWYFYSA-N 1 1 342.399 2.917 10 5 EFBEMO C[C@H]1CC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCS1 ZINC000848484808 1334741492 /nfs/dbraw/zinc/74/14/92/1334741492.db2.gz FEPFPWYOEGTKDP-BBRMVZONSA-N 1 1 349.456 2.696 10 5 EFBEMO C[C@@H]1CC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCS1 ZINC000848484811 1334741663 /nfs/dbraw/zinc/74/16/63/1334741663.db2.gz FEPFPWYOEGTKDP-CZUORRHYSA-N 1 1 349.456 2.696 10 5 EFBEMO C[C@@H]1CSCC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848485842 1334742093 /nfs/dbraw/zinc/74/20/93/1334742093.db2.gz YTLWWNNWBFKUKL-BBRMVZONSA-N 1 1 349.456 2.553 10 5 EFBEMO 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/nfs/dbraw/zinc/09/58/21/1417095821.db2.gz PISRUNCBMJGJCW-UHFFFAOYSA-N 1 1 344.415 2.873 10 5 EFBEMO C[N@@H+](CCCNC(=O)C(C)(C)C1CC1)Cc1ccccc1[N+](=O)[O-] ZINC001707398922 1418238077 /nfs/dbraw/zinc/23/80/77/1418238077.db2.gz BADAGQAGADPPCV-UHFFFAOYSA-N 1 1 333.432 2.969 10 5 EFBEMO CCCC(C)(C)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21 ZINC001713283111 1418451786 /nfs/dbraw/zinc/45/17/86/1418451786.db2.gz PPMSJFLZJJEBJY-QLPKVWCKSA-N 1 1 345.443 2.968 10 5 EFBEMO CC/C=C(/C)C(=O)N1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC001717008450 1419144537 /nfs/dbraw/zinc/14/45/37/1419144537.db2.gz MFBJOSAERWOYSV-DKFSEWANSA-N 1 1 343.427 2.841 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)CC(C)(F)F ZINC001717211379 1419268653 /nfs/dbraw/zinc/26/86/53/1419268653.db2.gz NUBOGELAPONKMD-UHFFFAOYSA-N 1 1 343.374 2.920 10 5 EFBEMO Cc1ccc(N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)c([N+](=O)[O-])c1Br ZINC000804669306 713324257 /nfs/dbraw/zinc/32/42/57/713324257.db2.gz ZPEZKFKLRYTUNQ-PHIMTYICSA-N 1 1 340.221 2.664 10 5 EFBEMO C[N@H+]1C[C@@H]2CN(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)C[C@]2(C)C1 ZINC000933736571 715032667 /nfs/dbraw/zinc/03/26/67/715032667.db2.gz WTPDRRLDLQMCAO-KDOFPFPSSA-N 1 1 342.399 2.633 10 5 EFBEMO CC(C)(C)OC(=O)[C@@H]1CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000176166134 715161576 /nfs/dbraw/zinc/16/15/76/715161576.db2.gz PWXWKUQLDUHUJJ-CYBMUJFWSA-N 1 1 346.387 2.566 10 5 EFBEMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000176166134 715161578 /nfs/dbraw/zinc/16/15/78/715161578.db2.gz PWXWKUQLDUHUJJ-CYBMUJFWSA-N 1 1 346.387 2.566 10 5 EFBEMO CC[C@H](NC(=O)NCC[N@H+]1CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000893449877 715526602 /nfs/dbraw/zinc/52/66/02/715526602.db2.gz KBHAGSFAWMSATR-BBRMVZONSA-N 1 1 334.420 2.829 10 5 EFBEMO CC[C@H](NC(=O)N1CC[C@H]2[C@H]1CCC[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000893452681 715560801 /nfs/dbraw/zinc/56/08/01/715560801.db2.gz WRZWCLKIFYDPOC-YESZJQIVSA-N 1 1 346.431 2.924 10 5 EFBEMO COC(=O)[C@@H]1[C@@H](C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)C1(F)F ZINC000893945690 720177697 /nfs/dbraw/zinc/17/76/97/720177697.db2.gz JJZRFPUQVJBLCA-OCCSQVGLSA-N 1 1 340.326 2.614 10 5 EFBEMO COC(=O)[C@@H]1[C@@H](C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)C1(F)F ZINC000893945690 720177700 /nfs/dbraw/zinc/17/77/00/720177700.db2.gz JJZRFPUQVJBLCA-OCCSQVGLSA-N 1 1 340.326 2.614 10 5 EFBEMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2Cc1c(Br)cccc1[N+](=O)[O-] ZINC000931390642 721310495 /nfs/dbraw/zinc/31/04/95/721310495.db2.gz KLVWCWOXEUZGEW-PHIMTYICSA-N 1 1 340.221 2.636 10 5 EFBEMO C[C@@H]1C[N@H+](CCCOC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000893394765 721363539 /nfs/dbraw/zinc/36/35/39/721363539.db2.gz XGSGYLAQLSXIOS-LLVKDONJSA-N 1 1 342.779 2.516 10 5 EFBEMO C[C@@H]1C[N@@H+](CCCOC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000893394765 721363541 /nfs/dbraw/zinc/36/35/41/721363541.db2.gz XGSGYLAQLSXIOS-LLVKDONJSA-N 1 1 342.779 2.516 10 5 EFBEMO C[C@@H]1[C@H](NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC[N@H+]1C ZINC000928435134 722862440 /nfs/dbraw/zinc/86/24/40/722862440.db2.gz RAKLCNAUDILTST-RDDDGLTNSA-N 1 1 332.187 2.724 10 5 EFBEMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@H]1C ZINC000928438771 722872009 /nfs/dbraw/zinc/87/20/09/722872009.db2.gz MPACFWRWIXDRHU-FZMZJTMJSA-N 1 1 337.445 2.918 10 5 EFBEMO Cc1c(C[N@@H+]2CCc3nc[nH]c3C23CCOCC3)cccc1[N+](=O)[O-] ZINC000895070957 723178064 /nfs/dbraw/zinc/17/80/64/723178064.db2.gz VQDFYPPEGCNPAD-UHFFFAOYSA-N 1 1 342.399 2.690 10 5 EFBEMO Cc1c(C[N@H+]2CCc3nc[nH]c3C23CCOCC3)cccc1[N+](=O)[O-] ZINC000895070957 723178068 /nfs/dbraw/zinc/17/80/68/723178068.db2.gz VQDFYPPEGCNPAD-UHFFFAOYSA-N 1 1 342.399 2.690 10 5 EFBEMO CC[C@@H](C)[N@@H+](C)CCNc1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] ZINC000727112253 723819801 /nfs/dbraw/zinc/81/98/01/723819801.db2.gz FFBNTDAJSPPTQK-FNOHHLHBSA-N 1 1 335.404 2.923 10 5 EFBEMO CC(=O)c1c(N[C@@H]2CCC[N@@H+]3CCSC[C@@H]23)cccc1[N+](=O)[O-] ZINC000895563905 724197594 /nfs/dbraw/zinc/19/75/94/724197594.db2.gz FNQJMWGYWJJHGH-DOMZBBRYSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1c(N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)cccc1[N+](=O)[O-] ZINC000895563905 724197595 /nfs/dbraw/zinc/19/75/95/724197595.db2.gz FNQJMWGYWJJHGH-DOMZBBRYSA-N 1 1 335.429 2.789 10 5 EFBEMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000907204652 726884358 /nfs/dbraw/zinc/88/43/58/726884358.db2.gz FKWCVXCSCDAGBC-RYUDHWBXSA-N 1 1 339.823 2.732 10 5 EFBEMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC000908127011 727105559 /nfs/dbraw/zinc/10/55/59/727105559.db2.gz VYIQPGJOXOLBGP-WBVHZDCISA-N 1 1 331.416 2.613 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC000908282773 727150465 /nfs/dbraw/zinc/15/04/65/727150465.db2.gz VWWHCHVGOFIEAN-DOMZBBRYSA-N 1 1 333.388 2.949 10 5 EFBEMO COc1ccc(C[NH2+][C@@H](C)c2cn3c(n2)CCCC3)cc1[N+](=O)[O-] ZINC000924840177 727559551 /nfs/dbraw/zinc/55/95/51/727559551.db2.gz BEUHEBCNKBAOAD-LBPRGKRZSA-N 1 1 330.388 2.987 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](C)[N@@H+](CC)[C@@H](C)C1 ZINC000912024069 727636275 /nfs/dbraw/zinc/63/62/75/727636275.db2.gz LMSFPPFNZYBIGZ-BETUJISGSA-N 1 1 335.404 2.548 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](C)[N@H+](CC)[C@@H](C)C1 ZINC000912024069 727636277 /nfs/dbraw/zinc/63/62/77/727636277.db2.gz LMSFPPFNZYBIGZ-BETUJISGSA-N 1 1 335.404 2.548 10 5 EFBEMO C[C@@H](C(=O)N1C[C@]2(C)C[N@@H+](C)C[C@]2(C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000913280759 727810805 /nfs/dbraw/zinc/81/08/05/727810805.db2.gz GOHJBZJTDVMZIX-PJSAGSTRSA-N 1 1 349.406 2.638 10 5 EFBEMO C/C(=C\C(=O)N1C[C@]2(C)C[N@H+](C)C[C@]2(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000913281805 727814954 /nfs/dbraw/zinc/81/49/54/727814954.db2.gz SUBSOLLFTMOHOM-NIKHWINYSA-N 1 1 343.427 2.798 10 5 EFBEMO CCc1ccc(C(=O)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)cc1[N+](=O)[O-] ZINC000913282913 727815149 /nfs/dbraw/zinc/81/51/49/727815149.db2.gz KQYWJZDIGUMGFQ-HDICACEKSA-N 1 1 331.416 2.571 10 5 EFBEMO C[C@@H](NC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc([N+](=O)[O-])cc1 ZINC000920659702 729217157 /nfs/dbraw/zinc/21/71/57/729217157.db2.gz OLSARCIXNXRJOC-JATKITJMSA-N 1 1 346.431 2.970 10 5 EFBEMO C[C@H](CO)[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001647591429 1089586903 /nfs/dbraw/zinc/58/69/03/1089586903.db2.gz ZSPMTPSSSGPUHT-TZMCWYRMSA-N 1 1 346.387 2.628 10 5 EFBEMO Cc1ccccc1[C@@H](CO)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC001648333354 1089986684 /nfs/dbraw/zinc/98/66/84/1089986684.db2.gz OZACKUMTBCAWPI-GOSISDBHSA-N 1 1 330.384 2.947 10 5 EFBEMO O=C(C[N@@H+]1CCCC[C@]12CCCOC2)Nc1ccccc1[N+](=O)[O-] ZINC001620684709 1091149541 /nfs/dbraw/zinc/14/95/41/1091149541.db2.gz RRKSMUKBCYZUBF-QGZVFWFLSA-N 1 1 333.388 2.568 10 5 EFBEMO O=C(C[N@H+]1CCCC[C@]12CCCOC2)Nc1ccccc1[N+](=O)[O-] ZINC001620684709 1091149544 /nfs/dbraw/zinc/14/95/44/1091149544.db2.gz RRKSMUKBCYZUBF-QGZVFWFLSA-N 1 1 333.388 2.568 10 5 EFBEMO O=C(C[N@@H+]1CCCC[C@@]12CCCOC2)Nc1ccccc1[N+](=O)[O-] ZINC001620684708 1091149984 /nfs/dbraw/zinc/14/99/84/1091149984.db2.gz RRKSMUKBCYZUBF-KRWDZBQOSA-N 1 1 333.388 2.568 10 5 EFBEMO O=C(C[N@H+]1CCCC[C@@]12CCCOC2)Nc1ccccc1[N+](=O)[O-] ZINC001620684708 1091149988 /nfs/dbraw/zinc/14/99/88/1091149988.db2.gz RRKSMUKBCYZUBF-KRWDZBQOSA-N 1 1 333.388 2.568 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCO2)c1 ZINC001648617758 1092239837 /nfs/dbraw/zinc/23/98/37/1092239837.db2.gz VVUXQVUPZKVWOO-SJORKVTESA-N 1 1 348.399 2.915 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCO2)c1 ZINC001648617758 1092239846 /nfs/dbraw/zinc/23/98/46/1092239846.db2.gz VVUXQVUPZKVWOO-SJORKVTESA-N 1 1 348.399 2.915 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC[C@@]12CCOC2 ZINC001648641520 1092243766 /nfs/dbraw/zinc/24/37/66/1092243766.db2.gz BSQAFSQLQSZWKA-SFHVURJKSA-N 1 1 347.415 2.877 10 5 EFBEMO CC1(C(=O)NCC2=CC[N@H+](Cc3ccccc3[N+](=O)[O-])CC2)CC1 ZINC001279565173 1092517497 /nfs/dbraw/zinc/51/74/97/1092517497.db2.gz LGNUPNXOQAQEQU-UHFFFAOYSA-N 1 1 329.400 2.643 10 5 EFBEMO CC1(C(=O)NCC2=CC[N@@H+](Cc3ccccc3[N+](=O)[O-])CC2)CC1 ZINC001279565173 1092517510 /nfs/dbraw/zinc/51/75/10/1092517510.db2.gz LGNUPNXOQAQEQU-UHFFFAOYSA-N 1 1 329.400 2.643 10 5 EFBEMO O=C(CC1CCCC1)NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC001670738443 1092690445 /nfs/dbraw/zinc/69/04/45/1092690445.db2.gz GFFLGBMVPMBQJY-UHFFFAOYSA-N 1 1 337.445 2.975 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC001587990218 1092879617 /nfs/dbraw/zinc/87/96/17/1092879617.db2.gz KSVQTKBRFVZSBR-KBPBESRZSA-N 1 1 347.415 2.550 10 5 EFBEMO CCc1occc1C(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001267193626 1093148417 /nfs/dbraw/zinc/14/84/17/1093148417.db2.gz UJRODHDTLRUUIF-UHFFFAOYSA-N 1 1 331.372 2.612 10 5 EFBEMO CCc1occc1C(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001267193626 1093148422 /nfs/dbraw/zinc/14/84/22/1093148422.db2.gz UJRODHDTLRUUIF-UHFFFAOYSA-N 1 1 331.372 2.612 10 5 EFBEMO CCCc1[nH]ccc1C(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001267210510 1093207083 /nfs/dbraw/zinc/20/70/83/1093207083.db2.gz GRANNLSXRLLSRN-UHFFFAOYSA-N 1 1 344.415 2.737 10 5 EFBEMO CCCc1[nH]ccc1C(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001267210510 1093207088 /nfs/dbraw/zinc/20/70/88/1093207088.db2.gz GRANNLSXRLLSRN-UHFFFAOYSA-N 1 1 344.415 2.737 10 5 EFBEMO COc1csc(C(=O)NCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC001267210235 1093208747 /nfs/dbraw/zinc/20/87/47/1093208747.db2.gz CJGCBQDIJNWHON-UHFFFAOYSA-N 1 1 349.412 2.527 10 5 EFBEMO COc1csc(C(=O)NCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC001267210235 1093208757 /nfs/dbraw/zinc/20/87/57/1093208757.db2.gz CJGCBQDIJNWHON-UHFFFAOYSA-N 1 1 349.412 2.527 10 5 EFBEMO COc1ccsc1C(=O)NCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001267227021 1093277698 /nfs/dbraw/zinc/27/76/98/1093277698.db2.gz ZTCLFKIBUJDLJV-UHFFFAOYSA-N 1 1 349.412 2.527 10 5 EFBEMO CC(C)[N@@H+](CCCNC(=O)c1ccc[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC001267231962 1093298780 /nfs/dbraw/zinc/29/87/80/1093298780.db2.gz SOUOWTNGSGAWEO-UHFFFAOYSA-N 1 1 344.415 2.953 10 5 EFBEMO CC(C)[N@@H+](CCCNC(=O)c1ccon1)Cc1cccc([N+](=O)[O-])c1 ZINC001267235436 1093309899 /nfs/dbraw/zinc/30/98/99/1093309899.db2.gz AIEBFNRCZGKNCE-UHFFFAOYSA-N 1 1 346.387 2.613 10 5 EFBEMO CC1(C)CN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[N@H+]1CCO ZINC001650975837 1093515708 /nfs/dbraw/zinc/51/57/08/1093515708.db2.gz UXLOEIMAUGRBEK-UHFFFAOYSA-N 1 1 347.337 2.507 10 5 EFBEMO CCC1(C(=O)NCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC001267332160 1093599005 /nfs/dbraw/zinc/59/90/05/1093599005.db2.gz FCHHCOOMFUMOIC-UHFFFAOYSA-N 1 1 331.416 2.866 10 5 EFBEMO CCc1[nH+]ccn1CCNC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC001595406878 1094465562 /nfs/dbraw/zinc/46/55/62/1094465562.db2.gz OGKBDNJGFJSZJF-UHFFFAOYSA-N 1 1 334.401 2.506 10 5 EFBEMO Cc1cc([N+](=O)[O-])cc(C(=O)NCCCC[N@@H+]2CCCC[C@H]2C)n1 ZINC001596173903 1094518256 /nfs/dbraw/zinc/51/82/56/1094518256.db2.gz UGUJLFKPPXONKP-CQSZACIVSA-N 1 1 334.420 2.683 10 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O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@H]3CCOC34CCCC4)n2)cc1 ZINC001655823839 1101899444 /nfs/dbraw/zinc/89/94/44/1101899444.db2.gz NDEMDUDPMHBLKX-AWEZNQCLSA-N 1 1 344.371 2.836 10 5 EFBEMO CC(C)c1[nH+]ccn1CCNc1c2ccccc2ncc1[N+](=O)[O-] ZINC001655872746 1101904139 /nfs/dbraw/zinc/90/41/39/1101904139.db2.gz SDGHPVYBSWPMKE-UHFFFAOYSA-N 1 1 325.372 2.997 10 5 EFBEMO Cc1ccc(NCCNc2c3cc(F)ccc3ncc2[N+](=O)[O-])[nH+]c1 ZINC001655881376 1101906932 /nfs/dbraw/zinc/90/69/32/1101906932.db2.gz LTWVJGUYNXJCGS-UHFFFAOYSA-N 1 1 341.346 2.931 10 5 EFBEMO Cn1nccc1C[C@@H]1CCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC001655919236 1101910659 /nfs/dbraw/zinc/91/06/59/1101910659.db2.gz PSPFEJDEFDYSIB-KRWDZBQOSA-N 1 1 344.415 2.804 10 5 EFBEMO COCC[N@H+](CCC(=O)OC(C)(C)C)Cc1ccccc1[N+](=O)[O-] ZINC001656431589 1102073904 /nfs/dbraw/zinc/07/39/04/1102073904.db2.gz CMMVRVAWFPDHDL-UHFFFAOYSA-N 1 1 338.404 2.775 10 5 EFBEMO COCC[N@@H+](CCC(=O)OC(C)(C)C)Cc1ccccc1[N+](=O)[O-] ZINC001656431589 1102073922 /nfs/dbraw/zinc/07/39/22/1102073922.db2.gz CMMVRVAWFPDHDL-UHFFFAOYSA-N 1 1 338.404 2.775 10 5 EFBEMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@@H]2Cc2ccc(O)cc2)c1 ZINC001656469798 1102101660 /nfs/dbraw/zinc/10/16/60/1102101660.db2.gz PISKBSKRCGHUNQ-OAHLLOKOSA-N 1 1 330.388 2.594 10 5 EFBEMO C[N@@H+](CCOc1ccc2c(c1)OCO2)CCc1ccccc1[N+](=O)[O-] ZINC001658612166 1102473163 /nfs/dbraw/zinc/47/31/63/1102473163.db2.gz HJBOYZWIDPRLCE-UHFFFAOYSA-N 1 1 344.367 2.877 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+](C)C[C@@H]1C(C)C ZINC000588440853 1102524411 /nfs/dbraw/zinc/52/44/11/1102524411.db2.gz VBFJLNIEKHNYBG-VWILAXROSA-N 1 1 331.416 2.797 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](c2nnc(N)o2)C1 ZINC001659612852 1102553653 /nfs/dbraw/zinc/55/36/53/1102553653.db2.gz RCBGFVWFGYVBLD-RYUDHWBXSA-N 1 1 331.376 2.809 10 5 EFBEMO CCOc1cc(C[N@H+]2Cc3c[nH]nc3C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC001660160535 1102621434 /nfs/dbraw/zinc/62/14/34/1102621434.db2.gz HQKXUAUNMQKQIK-LBPRGKRZSA-N 1 1 330.388 2.911 10 5 EFBEMO CCOc1cc(C[N@@H+]2Cc3c[nH]nc3C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC001660160535 1102621444 /nfs/dbraw/zinc/62/14/44/1102621444.db2.gz HQKXUAUNMQKQIK-LBPRGKRZSA-N 1 1 330.388 2.911 10 5 EFBEMO C[C@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C1CCCC1 ZINC001660167752 1102624695 /nfs/dbraw/zinc/62/46/95/1102624695.db2.gz YSMSJQPZMVMJCU-HNNXBMFYSA-N 1 1 333.432 2.922 10 5 EFBEMO O=C1[C@@H]([NH+]2CCC(F)(C3CC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC001660474708 1102782664 /nfs/dbraw/zinc/78/26/64/1102782664.db2.gz RKGZSJGBDZRXBG-INIZCTEOSA-N 1 1 347.390 2.914 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1ncoc1C)Cc1cccc([N+](=O)[O-])c1 ZINC001660498708 1102798558 /nfs/dbraw/zinc/79/85/58/1102798558.db2.gz ZYPZHLNOUBDSHL-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@@]2(CO)c2ccccc2)c1 ZINC001660658866 1102913831 /nfs/dbraw/zinc/91/38/31/1102913831.db2.gz ZIEGWAZYSWUKCX-RTBURBONSA-N 1 1 342.395 2.612 10 5 EFBEMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@]2(CO)c2ccccc2)c1 ZINC001660658864 1102914556 /nfs/dbraw/zinc/91/45/56/1102914556.db2.gz ZIEGWAZYSWUKCX-OALUTQOASA-N 1 1 342.395 2.612 10 5 EFBEMO C[C@@H]1C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)CCO1 ZINC001660667697 1102919986 /nfs/dbraw/zinc/91/99/86/1102919986.db2.gz POKRMYNMIXISLQ-VXGBXAGGSA-N 1 1 332.360 2.644 10 5 EFBEMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)CCO1 ZINC001660667697 1102919994 /nfs/dbraw/zinc/91/99/94/1102919994.db2.gz POKRMYNMIXISLQ-VXGBXAGGSA-N 1 1 332.360 2.644 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1Cc1ccnn1C ZINC001660700023 1102935745 /nfs/dbraw/zinc/93/57/45/1102935745.db2.gz AEOFARLQZOVVPK-HNNXBMFYSA-N 1 1 330.388 2.544 10 5 EFBEMO Cc1ncc(C(=O)N(C)CC[N@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC001271977336 1103331487 /nfs/dbraw/zinc/33/14/87/1103331487.db2.gz NRFAPGFAYBPLNH-UHFFFAOYSA-N 1 1 348.428 2.564 10 5 EFBEMO Cc1ncc(C(=O)N(C)CC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC001271977336 1103331499 /nfs/dbraw/zinc/33/14/99/1103331499.db2.gz NRFAPGFAYBPLNH-UHFFFAOYSA-N 1 1 348.428 2.564 10 5 EFBEMO CCC(C)(C)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21 ZINC001662063548 1103575431 /nfs/dbraw/zinc/57/54/31/1103575431.db2.gz HDQROHQTHVGPDL-ZSHCYNCHSA-N 1 1 331.416 2.577 10 5 EFBEMO Cc1cccnc1C(=O)N(C)CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001482587962 1103918043 /nfs/dbraw/zinc/91/80/43/1103918043.db2.gz LAARWKIPNZWGES-UHFFFAOYSA-N 1 1 342.399 2.502 10 5 EFBEMO Cc1cccnc1C(=O)N(C)CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001482587962 1103918052 /nfs/dbraw/zinc/91/80/52/1103918052.db2.gz LAARWKIPNZWGES-UHFFFAOYSA-N 1 1 342.399 2.502 10 5 EFBEMO C[C@@H]1C[NH+](Cc2cccc([N+](=O)[O-])c2Br)C[C@@H](C)C1O ZINC000697233813 1103989056 /nfs/dbraw/zinc/98/90/56/1103989056.db2.gz UJOWRMSNYGKDIR-NXEZZACHSA-N 1 1 343.221 2.806 10 5 EFBEMO Cc1c(F)cccc1C(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001663188744 1104019665 /nfs/dbraw/zinc/01/96/65/1104019665.db2.gz 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CN(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)/C=C\c1ccc[nH]1 ZINC001667556639 1105160847 /nfs/dbraw/zinc/16/08/47/1105160847.db2.gz GKMPTWVJFXQNRZ-HJWRWDBZSA-N 1 1 342.399 2.527 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)C1(CCF)CC1 ZINC001667603863 1105166184 /nfs/dbraw/zinc/16/61/84/1105166184.db2.gz RKCWVRJYDVNIIH-UHFFFAOYSA-N 1 1 337.395 2.625 10 5 EFBEMO Cc1coc(C(=O)N(C)CC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC001667612079 1105167620 /nfs/dbraw/zinc/16/76/20/1105167620.db2.gz ZPNWMQHXVBHGJF-UHFFFAOYSA-N 1 1 331.372 2.700 10 5 EFBEMO Cc1coc(C(=O)N(C)CC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC001667612079 1105167621 /nfs/dbraw/zinc/16/76/21/1105167621.db2.gz ZPNWMQHXVBHGJF-UHFFFAOYSA-N 1 1 331.372 2.700 10 5 EFBEMO O=C(NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1)C1(C2CC2)CC1 ZINC001483025997 1105622414 /nfs/dbraw/zinc/62/24/14/1105622414.db2.gz WMYXSFNIMKZPBW-OWOJBTEDSA-N 1 1 335.429 2.609 10 5 EFBEMO O=C(NCC1CC1)C1([NH2+]Cc2c(F)cccc2[N+](=O)[O-])CCCC1 ZINC000085937104 1105724257 /nfs/dbraw/zinc/72/42/57/1105724257.db2.gz OSJQKUXHVWIVBV-UHFFFAOYSA-N 1 1 335.379 2.663 10 5 EFBEMO CC[C@H](NC(=O)N1CCC[N@@H+](CC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090685775 1106495669 /nfs/dbraw/zinc/49/56/69/1106495669.db2.gz FXRWOFYAFXVGCD-INIZCTEOSA-N 1 1 334.420 2.783 10 5 EFBEMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC001681237090 1108175071 /nfs/dbraw/zinc/17/50/71/1108175071.db2.gz DNGMZJUQXQTDJE-QGZVFWFLSA-N 1 1 348.447 2.509 10 5 EFBEMO Cc1cccc(NCCNC(=O)NCc2cccc([N+](=O)[O-])c2C)[nH+]1 ZINC001681561008 1108341104 /nfs/dbraw/zinc/34/11/04/1108341104.db2.gz XXQRJYAFMLUPOD-UHFFFAOYSA-N 1 1 343.387 2.518 10 5 EFBEMO CCn1cccc1C(=O)NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001483097240 1108625828 /nfs/dbraw/zinc/62/58/28/1108625828.db2.gz POBPFKRWKHQHAT-ARJAWSKDSA-N 1 1 348.428 2.554 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCC[N@H+](CCF)C1 ZINC000898505080 1108980612 /nfs/dbraw/zinc/98/06/12/1108980612.db2.gz 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CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)Nc2ccncc2[N+](=O)[O-])C1 ZINC000183554994 529760443 /nfs/dbraw/zinc/76/04/43/529760443.db2.gz IWMSJIUMZOVDQJ-GFCCVEGCSA-N 1 1 344.375 2.618 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCO[C@@]4(CCOC4)C3)o2)c1 ZINC000187546286 236242220 /nfs/dbraw/zinc/24/22/20/236242220.db2.gz YMAJUGSTKWKWGJ-SFHVURJKSA-N 1 1 344.367 2.846 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCO[C@@]4(CCOC4)C3)o2)c1 ZINC000187546286 236242223 /nfs/dbraw/zinc/24/22/23/236242223.db2.gz YMAJUGSTKWKWGJ-SFHVURJKSA-N 1 1 344.367 2.846 10 5 EFBEMO C[C@@H]1CC[C@@](CO)([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000187985201 236371786 /nfs/dbraw/zinc/37/17/86/236371786.db2.gz GMJVPPIOXOWWMY-SJKOYZFVSA-N 1 1 346.387 2.628 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@]1(CO)CC[C@H](C)C1 ZINC000187967248 236361610 /nfs/dbraw/zinc/36/16/10/236361610.db2.gz VZGLXQHAYMBTLY-SCLBCKFNSA-N 1 1 349.431 2.715 10 5 EFBEMO Cn1cnc([N+](=O)[O-])c1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000264743380 201211779 /nfs/dbraw/zinc/21/17/79/201211779.db2.gz KUBCVGARECFVGZ-MQVJKMGUSA-N 1 1 341.415 2.936 10 5 EFBEMO O=C(NCC[N@H+]1CC=CCC1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000357622925 242102852 /nfs/dbraw/zinc/10/28/52/242102852.db2.gz SGLIULTUMTVWMP-UHFFFAOYSA-N 1 1 347.418 2.673 10 5 EFBEMO O=C(NCC[N@@H+]1CC=CCC1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000357622925 242102859 /nfs/dbraw/zinc/10/28/59/242102859.db2.gz SGLIULTUMTVWMP-UHFFFAOYSA-N 1 1 347.418 2.673 10 5 EFBEMO Cc1ccc([C@@H]2CCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1C ZINC000229339135 242157088 /nfs/dbraw/zinc/15/70/88/242157088.db2.gz QTGDPSDIACEXHL-MSOLQXFVSA-N 1 1 344.415 2.606 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000412136984 243163052 /nfs/dbraw/zinc/16/30/52/243163052.db2.gz VQZZLWYIUKZOAZ-OSMBCOQSSA-N 1 1 331.416 2.639 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000413502287 243703954 /nfs/dbraw/zinc/70/39/54/243703954.db2.gz MYWWQYYVEAAKPZ-RUGDWHBFSA-N 1 1 345.443 2.887 10 5 EFBEMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2ccc3cncn3c2)n1 ZINC000414188234 244038319 /nfs/dbraw/zinc/03/83/19/244038319.db2.gz QHEKQOQEMNZLQK-JKSUJKDBSA-N 1 1 340.387 2.713 10 5 EFBEMO Cc1cccc(N2CCN(C(=O)c3csc([N+](=O)[O-])c3)[C@H](C)C2)[nH+]1 ZINC000071908096 203146319 /nfs/dbraw/zinc/14/63/19/203146319.db2.gz AKYQOXYMJMZDJT-GFCCVEGCSA-N 1 1 346.412 2.711 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2CC(C)(C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000414519417 244207690 /nfs/dbraw/zinc/20/76/90/244207690.db2.gz BCBFDSCEJURGBI-LBPRGKRZSA-N 1 1 336.388 2.767 10 5 EFBEMO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NCC1([NH3+])CCCCCC1 ZINC000414860674 244375994 /nfs/dbraw/zinc/37/59/94/244375994.db2.gz QCJORFMCVHMMQK-CQSZACIVSA-N 1 1 348.447 2.953 10 5 EFBEMO CCCC(=O)N[C@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000101563292 204009363 /nfs/dbraw/zinc/00/93/63/204009363.db2.gz UGPHREPTVROXNJ-HNNXBMFYSA-N 1 1 349.431 2.744 10 5 EFBEMO CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000105851497 204169796 /nfs/dbraw/zinc/16/97/96/204169796.db2.gz NWZQGMMVXQKFDF-NSHDSACASA-N 1 1 334.401 2.893 10 5 EFBEMO Cc1ccc(N2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3C)CC2)nn1 ZINC000105801602 204159716 /nfs/dbraw/zinc/15/97/16/204159716.db2.gz RHELUUUYXPAFEP-UHFFFAOYSA-N 1 1 341.415 2.714 10 5 EFBEMO C[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCCN(c2cccnn2)C1 ZINC000105803933 204160939 /nfs/dbraw/zinc/16/09/39/204160939.db2.gz QDBMQXOEDUFZBS-CYBMUJFWSA-N 1 1 333.417 2.547 10 5 EFBEMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCCN(c2cccnn2)C1 ZINC000105803933 204160942 /nfs/dbraw/zinc/16/09/42/204160942.db2.gz QDBMQXOEDUFZBS-CYBMUJFWSA-N 1 1 333.417 2.547 10 5 EFBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1[C@@H]2CC[C@H]1CC(O)C2 ZINC000111318351 204349907 /nfs/dbraw/zinc/34/99/07/204349907.db2.gz ZIWSGGBXLYDKLE-ZEIJEMSESA-N 1 1 344.371 2.694 10 5 EFBEMO CC[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000126534890 205060356 /nfs/dbraw/zinc/06/03/56/205060356.db2.gz LNLDFUQJUDDKAT-SNVBAGLBSA-N 1 1 345.321 2.685 10 5 EFBEMO CC(C)c1ccc(C[N@H+]2C[C@H](C)[C@H](N3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000245776750 205155894 /nfs/dbraw/zinc/15/58/94/205155894.db2.gz SUIDUBCXRVWDFZ-HNAYVOBHSA-N 1 1 347.459 2.871 10 5 EFBEMO Cc1[nH+]ccn1CCCCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000130421282 205238483 /nfs/dbraw/zinc/23/84/83/205238483.db2.gz MRJFEFDCTQIOOI-UHFFFAOYSA-N 1 1 341.371 2.791 10 5 EFBEMO COc1ccc(C[NH2+]Cc2ccc(-c3cc[nH]n3)o2)cc1[N+](=O)[O-] ZINC000433307271 248042175 /nfs/dbraw/zinc/04/21/75/248042175.db2.gz UZNCRNXQHHKAKH-UHFFFAOYSA-N 1 1 328.328 2.876 10 5 EFBEMO CC[N@H+]1CC[C@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000170970055 206641513 /nfs/dbraw/zinc/64/15/13/206641513.db2.gz XKRWYFQCOMKVQB-LLVKDONJSA-N 1 1 333.413 2.881 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441214035 250008996 /nfs/dbraw/zinc/00/89/96/250008996.db2.gz WXDVBUXYAMLUCP-HUUCEWRRSA-N 1 1 347.415 2.590 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441274770 250012793 /nfs/dbraw/zinc/01/27/93/250012793.db2.gz GALQIEGYWUZACB-HUUCEWRRSA-N 1 1 347.415 2.590 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441274770 250012798 /nfs/dbraw/zinc/01/27/98/250012798.db2.gz GALQIEGYWUZACB-HUUCEWRRSA-N 1 1 347.415 2.590 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@H]([C@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000441285893 250015178 /nfs/dbraw/zinc/01/51/78/250015178.db2.gz ZKVZUYTZNMMJMO-GJZGRUSLSA-N 1 1 347.415 2.672 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000441285896 250016035 /nfs/dbraw/zinc/01/60/35/250016035.db2.gz ZKVZUYTZNMMJMO-LSDHHAIUSA-N 1 1 347.415 2.672 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@]4(CCCOC4)C3)nc2c1 ZINC000444653518 250324115 /nfs/dbraw/zinc/32/41/15/250324115.db2.gz UWTJECPOKFACID-KRWDZBQOSA-N 1 1 330.388 2.864 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@]4(CCCOC4)C3)nc2c1 ZINC000444653518 250324117 /nfs/dbraw/zinc/32/41/17/250324117.db2.gz UWTJECPOKFACID-KRWDZBQOSA-N 1 1 330.388 2.864 10 5 EFBEMO Cc1cc(C)cc(C[N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000444715321 250333772 /nfs/dbraw/zinc/33/37/72/250333772.db2.gz MIPPYLIXNJOFNB-UHFFFAOYSA-N 1 1 327.384 2.943 10 5 EFBEMO Cc1cc(C)cc(C[N@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000444715321 250333775 /nfs/dbraw/zinc/33/37/75/250333775.db2.gz MIPPYLIXNJOFNB-UHFFFAOYSA-N 1 1 327.384 2.943 10 5 EFBEMO COc1cc(C[N@@H+]2CCC[C@@H]([C@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000444739597 250339193 /nfs/dbraw/zinc/33/91/93/250339193.db2.gz VCORMAJQIWBKQT-RISCZKNCSA-N 1 1 348.321 2.739 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@@H]([C@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000444739597 250339195 /nfs/dbraw/zinc/33/91/95/250339195.db2.gz VCORMAJQIWBKQT-RISCZKNCSA-N 1 1 348.321 2.739 10 5 EFBEMO COc1cc(C[N@@H+]2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000444739592 250340130 /nfs/dbraw/zinc/34/01/30/250340130.db2.gz VCORMAJQIWBKQT-BXUZGUMPSA-N 1 1 348.321 2.739 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000444739592 250340133 /nfs/dbraw/zinc/34/01/33/250340133.db2.gz VCORMAJQIWBKQT-BXUZGUMPSA-N 1 1 348.321 2.739 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000153676431 296311826 /nfs/dbraw/zinc/31/18/26/296311826.db2.gz OKCLJCHRJBYAEL-CYBMUJFWSA-N 1 1 344.415 2.609 10 5 EFBEMO Cc1cccc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1[N+](=O)[O-] ZINC000174986554 207079903 /nfs/dbraw/zinc/07/99/03/207079903.db2.gz KQYQPWFPABCBTP-CABCVRRESA-N 1 1 331.416 2.991 10 5 EFBEMO C[C@H]1CN(CC(F)(F)F)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000449664734 251105177 /nfs/dbraw/zinc/10/51/77/251105177.db2.gz LVMGTORCXIMWQB-GFCCVEGCSA-N 1 1 331.338 2.911 10 5 EFBEMO C[C@H]1CN(CC(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000449664734 251105182 /nfs/dbraw/zinc/10/51/82/251105182.db2.gz LVMGTORCXIMWQB-GFCCVEGCSA-N 1 1 331.338 2.911 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2cnn(C)c2)C1 ZINC000175239958 207106474 /nfs/dbraw/zinc/10/64/74/207106474.db2.gz ZGNPFQFUDIWXAA-ZDUSSCGKSA-N 1 1 330.388 2.717 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H]([C@H](O)C(F)(F)F)C1 ZINC000449673583 251111469 /nfs/dbraw/zinc/11/14/69/251111469.db2.gz PGLWTXNOEMYDMZ-HZMBPMFUSA-N 1 1 348.321 2.739 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]([C@H](O)C(F)(F)F)C1 ZINC000449673583 251111473 /nfs/dbraw/zinc/11/14/73/251111473.db2.gz PGLWTXNOEMYDMZ-HZMBPMFUSA-N 1 1 348.321 2.739 10 5 EFBEMO C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000449679064 251113560 /nfs/dbraw/zinc/11/35/60/251113560.db2.gz QULGHDCWCNCCCC-BBRMVZONSA-N 1 1 346.383 2.827 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000175361654 207120592 /nfs/dbraw/zinc/12/05/92/207120592.db2.gz ICEKBHAKROOAAI-OAHLLOKOSA-N 1 1 345.403 2.561 10 5 EFBEMO C[C@@H](NC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000175736509 207155070 /nfs/dbraw/zinc/15/50/70/207155070.db2.gz WQHPDHLESMXZFC-OHRKKDJYSA-N 1 1 346.431 2.970 10 5 EFBEMO Cc1ccc(C)c([C@H]2C[N@H+](CCn3ccc([N+](=O)[O-])n3)[C@H](C)CO2)c1 ZINC000176267234 207210161 /nfs/dbraw/zinc/21/01/61/207210161.db2.gz UFJCMNSCYOSNCE-NVXWUHKLSA-N 1 1 344.415 2.870 10 5 EFBEMO Cc1ccc(C)c([C@H]2C[N@@H+](CCn3ccc([N+](=O)[O-])n3)[C@H](C)CO2)c1 ZINC000176267234 207210165 /nfs/dbraw/zinc/21/01/65/207210165.db2.gz UFJCMNSCYOSNCE-NVXWUHKLSA-N 1 1 344.415 2.870 10 5 EFBEMO C[C@@H](N=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000450436876 251386887 /nfs/dbraw/zinc/38/68/87/251386887.db2.gz RVCFPJTWAFGTCU-CHWSQXEVSA-N 1 1 343.431 2.958 10 5 EFBEMO Cc1ccc([C@@H](C)NC(=O)N2CC[N@H+]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000176726247 207254652 /nfs/dbraw/zinc/25/46/52/207254652.db2.gz HMQQBLBIRRUDHL-GDBMZVCRSA-N 1 1 346.431 2.844 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000177024245 207283748 /nfs/dbraw/zinc/28/37/48/207283748.db2.gz CBBWTCXJHPMQQZ-CQSZACIVSA-N 1 1 339.823 2.733 10 5 EFBEMO C[C@H]([NH2+][C@H]1COCC1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000451812781 251695497 /nfs/dbraw/zinc/69/54/97/251695497.db2.gz UKZNQTCETWDVTO-GWCFXTLKSA-N 1 1 332.360 2.720 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000177496796 207344300 /nfs/dbraw/zinc/34/43/00/207344300.db2.gz REDNAJYMMKOGTM-HUUCEWRRSA-N 1 1 332.404 2.994 10 5 EFBEMO COc1ccc(N2CC[NH+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)nc1 ZINC000452056492 251770549 /nfs/dbraw/zinc/77/05/49/251770549.db2.gz JHZHDJXPQPVZBC-CQSZACIVSA-N 1 1 342.399 2.882 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCNC(C)(C)C[NH+]1CCCC1 ZINC000452097327 251784713 /nfs/dbraw/zinc/78/47/13/251784713.db2.gz QBDZJTYFLMJIEI-UHFFFAOYSA-N 1 1 348.447 2.696 10 5 EFBEMO CN(C(=O)c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000268588812 252047797 /nfs/dbraw/zinc/04/77/97/252047797.db2.gz RVFVEIYSNARMPA-MRXNPFEDSA-N 1 1 339.395 2.941 10 5 EFBEMO CN(C(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000268631368 252084496 /nfs/dbraw/zinc/08/44/96/252084496.db2.gz ZYWZXTHXEADBCS-GOSISDBHSA-N 1 1 339.395 2.941 10 5 EFBEMO O=C1C[C@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(Cl)cc2[N+](=O)[O-])CN1 ZINC000378322936 296348638 /nfs/dbraw/zinc/34/86/38/296348638.db2.gz YILVZTLPAVQDGJ-JSGCOSHPSA-N 1 1 337.807 2.739 10 5 EFBEMO C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000247113605 141384779 /nfs/dbraw/zinc/38/47/79/141384779.db2.gz FCPDZUCRTGGTDG-JQWIXIFHSA-N 1 1 338.795 2.949 10 5 EFBEMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC3(C2)CCCCC3)c1 ZINC000303955663 141437641 /nfs/dbraw/zinc/43/76/41/141437641.db2.gz XDASBWFYVQPPQC-MRXNPFEDSA-N 1 1 334.416 2.991 10 5 EFBEMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cn1 ZINC000344443276 142017621 /nfs/dbraw/zinc/01/76/21/142017621.db2.gz TZEVXPDGEBFAJI-INIZCTEOSA-N 1 1 326.400 2.966 10 5 EFBEMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000344630629 142052250 /nfs/dbraw/zinc/05/22/50/142052250.db2.gz WQQBSIHZFCJOME-MRXNPFEDSA-N 1 1 344.415 2.926 10 5 EFBEMO O=C(NC[C@H]1CCCC[N@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])[nH]1 ZINC000346174822 142161109 /nfs/dbraw/zinc/16/11/09/142161109.db2.gz VKHBWGWFOQIXRT-OAHLLOKOSA-N 1 1 342.399 2.707 10 5 EFBEMO COc1cc(C[NH2+][C@@H](C[S@](C)=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000347691449 142257804 /nfs/dbraw/zinc/25/78/04/142257804.db2.gz ZOCJYYPLKNNSOQ-OWJWWREXSA-N 1 1 348.424 2.813 10 5 EFBEMO Cc1cnn(CCCCC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)c1 ZINC000347785353 142271794 /nfs/dbraw/zinc/27/17/94/142271794.db2.gz CRYNKBASDOAJAR-UHFFFAOYSA-N 1 1 329.404 2.723 10 5 EFBEMO Cc1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc(C)c1O ZINC000347865863 142284444 /nfs/dbraw/zinc/28/44/44/142284444.db2.gz ZWWFMCNAFASZNS-HNNXBMFYSA-N 1 1 342.399 2.999 10 5 EFBEMO C[N@@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1ccc(Cl)cc1 ZINC000341173510 145005788 /nfs/dbraw/zinc/00/57/88/145005788.db2.gz VDBCZEYTGSJXOB-WFASDCNBSA-N 1 1 348.790 2.752 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1ccc(Cl)cc1 ZINC000341173510 145005790 /nfs/dbraw/zinc/00/57/90/145005790.db2.gz VDBCZEYTGSJXOB-WFASDCNBSA-N 1 1 348.790 2.752 10 5 EFBEMO C[C@@H]([NH2+]CC(=O)NCc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000342298199 145095682 /nfs/dbraw/zinc/09/56/82/145095682.db2.gz LBEHDUVNTWUZJQ-GFCCVEGCSA-N 1 1 331.347 2.701 10 5 EFBEMO C[C@@H]1CC[C@]2(CC[N@@H+](C[C@@H](O)COc3ccccc3[N+](=O)[O-])C2)C1 ZINC000343763549 145288685 /nfs/dbraw/zinc/28/86/85/145288685.db2.gz VWSFRCBBZWQROA-RKVPGOIHSA-N 1 1 334.416 2.847 10 5 EFBEMO C[N@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C[C@@H]1CC=CCC1 ZINC000344075460 145362216 /nfs/dbraw/zinc/36/22/16/145362216.db2.gz USEHWGZWUMLJKY-CQSZACIVSA-N 1 1 338.429 2.657 10 5 EFBEMO C[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C[C@@H]1CC=CCC1 ZINC000344075460 145362218 /nfs/dbraw/zinc/36/22/18/145362218.db2.gz USEHWGZWUMLJKY-CQSZACIVSA-N 1 1 338.429 2.657 10 5 EFBEMO C[N@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C[C@H]1CC=CCC1 ZINC000344075456 145362263 /nfs/dbraw/zinc/36/22/63/145362263.db2.gz USEHWGZWUMLJKY-AWEZNQCLSA-N 1 1 338.429 2.657 10 5 EFBEMO C[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C[C@H]1CC=CCC1 ZINC000344075456 145362264 /nfs/dbraw/zinc/36/22/64/145362264.db2.gz USEHWGZWUMLJKY-AWEZNQCLSA-N 1 1 338.429 2.657 10 5 EFBEMO [NH3+]CCN(Cc1cnc(-c2ccccc2)[nH]1)c1ccccc1[N+](=O)[O-] ZINC000348918837 146024609 /nfs/dbraw/zinc/02/46/09/146024609.db2.gz CRNYPDAPBLKDGT-UHFFFAOYSA-N 1 1 337.383 2.950 10 5 EFBEMO COc1cc(C[NH+]2CCN(c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000351971584 146251566 /nfs/dbraw/zinc/25/15/66/146251566.db2.gz URTAZSLWRVNECV-UHFFFAOYSA-N 1 1 327.384 2.926 10 5 EFBEMO COc1cccc(CCC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)c1 ZINC000353033317 146381149 /nfs/dbraw/zinc/38/11/49/146381149.db2.gz NCJUVFNSEKENAM-UHFFFAOYSA-N 1 1 327.384 2.989 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2CCC[C@H](C)CC2)cc1[N+](=O)[O-] ZINC000355606533 147011219 /nfs/dbraw/zinc/01/12/19/147011219.db2.gz LJOABALTMWBHJH-ZDUSSCGKSA-N 1 1 336.388 2.769 10 5 EFBEMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000355738098 147049353 /nfs/dbraw/zinc/04/93/53/147049353.db2.gz HHBFGSYWWZNQOX-MGPQQGTHSA-N 1 1 340.445 2.735 10 5 EFBEMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000355738098 147049356 /nfs/dbraw/zinc/04/93/56/147049356.db2.gz HHBFGSYWWZNQOX-MGPQQGTHSA-N 1 1 340.445 2.735 10 5 EFBEMO C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000355738093 147049586 /nfs/dbraw/zinc/04/95/86/147049586.db2.gz HHBFGSYWWZNQOX-HZSPNIEDSA-N 1 1 340.445 2.735 10 5 EFBEMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000355738093 147049587 /nfs/dbraw/zinc/04/95/87/147049587.db2.gz HHBFGSYWWZNQOX-HZSPNIEDSA-N 1 1 340.445 2.735 10 5 EFBEMO C[C@H]1C[C@H](N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000356340734 147217296 /nfs/dbraw/zinc/21/72/96/147217296.db2.gz PDFJKPYOFXNJEW-XJKSGUPXSA-N 1 1 333.432 2.814 10 5 EFBEMO CN(c1ccc([N+](=O)[O-])c(OC(F)F)c1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000356741903 147324714 /nfs/dbraw/zinc/32/47/14/147324714.db2.gz LKSDBIGDJPHVDX-LBPRGKRZSA-N 1 1 327.331 2.869 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NCCc2cn3c([nH+]2)CCCC3)c1 ZINC000360155618 148286983 /nfs/dbraw/zinc/28/69/83/148286983.db2.gz FNIKFYDQNREXHM-UHFFFAOYSA-N 1 1 344.371 2.569 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC2(CCOCC2)[C@@H]1C ZINC000363790552 149012971 /nfs/dbraw/zinc/01/29/71/149012971.db2.gz ALPCQGFSUABSCQ-AWEZNQCLSA-N 1 1 347.415 2.733 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC000365051948 149304704 /nfs/dbraw/zinc/30/47/04/149304704.db2.gz ZKFMQCITFWAQIV-KRWDZBQOSA-N 1 1 325.368 2.820 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[N@H+](C)Cc2ccccc21 ZINC000365051948 149304707 /nfs/dbraw/zinc/30/47/07/149304707.db2.gz ZKFMQCITFWAQIV-KRWDZBQOSA-N 1 1 325.368 2.820 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@]4(C3)CCCOC4)n2)c1 ZINC000368500504 150134472 /nfs/dbraw/zinc/13/44/72/150134472.db2.gz XHJNGJVXQKAGJU-KRWDZBQOSA-N 1 1 344.371 2.647 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3C[C@@H](O)C4(CC4)C3)cs2)c1 ZINC000368800114 150207479 /nfs/dbraw/zinc/20/74/79/150207479.db2.gz LGSCFYZHDIQFJH-CQSZACIVSA-N 1 1 331.397 2.675 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3C[C@@H](O)C4(CC4)C3)cs2)c1 ZINC000368800114 150207485 /nfs/dbraw/zinc/20/74/85/150207485.db2.gz LGSCFYZHDIQFJH-CQSZACIVSA-N 1 1 331.397 2.675 10 5 EFBEMO CC[N@@H+]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])cc3C)sc2C1 ZINC000368866451 150224731 /nfs/dbraw/zinc/22/47/31/150224731.db2.gz NYXFOWBMWBJJFO-UHFFFAOYSA-N 1 1 346.412 2.990 10 5 EFBEMO CC[N@H+]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])cc3C)sc2C1 ZINC000368866451 150224733 /nfs/dbraw/zinc/22/47/33/150224733.db2.gz NYXFOWBMWBJJFO-UHFFFAOYSA-N 1 1 346.412 2.990 10 5 EFBEMO COc1cc(C[NH+]2CCC(c3c[nH]cn3)CC2)c([N+](=O)[O-])cc1F ZINC000373324058 151152873 /nfs/dbraw/zinc/15/28/73/151152873.db2.gz IDUSRGSGYWZTFS-UHFFFAOYSA-N 1 1 334.351 2.845 10 5 EFBEMO C[C@@H]1C[C@]2(CCO1)C[N@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@H](C)O2 ZINC000374012914 151268181 /nfs/dbraw/zinc/26/81/81/151268181.db2.gz GKXMGZHTYPRVPI-RVKKMQEKSA-N 1 1 334.416 2.796 10 5 EFBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2c[nH]cn2)CC1 ZINC000374207618 151301449 /nfs/dbraw/zinc/30/14/49/151301449.db2.gz JNAPKGYVPYQMEH-LBPRGKRZSA-N 1 1 343.387 2.525 10 5 EFBEMO O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c1 ZINC000374553497 151368036 /nfs/dbraw/zinc/36/80/36/151368036.db2.gz ZWRRIQSQUTXNQV-GFCCVEGCSA-N 1 1 332.326 2.846 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(N2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c1 ZINC000407997929 152142165 /nfs/dbraw/zinc/14/21/65/152142165.db2.gz YQDOUQVCYRFWPK-SJPCQFCGSA-N 1 1 344.459 2.650 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000123968348 222359112 /nfs/dbraw/zinc/35/91/12/222359112.db2.gz ODIJUXGRFMDPIS-AAEUAGOBSA-N 1 1 339.823 2.732 10 5 EFBEMO CCN(CC)C(=O)[C@H]1CCC[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000092509885 544547911 /nfs/dbraw/zinc/54/79/11/544547911.db2.gz OCVXZRZJHSWPPI-PYUISTEWSA-N 1 1 331.416 2.941 10 5 EFBEMO CCN(CC)C(=O)[C@H]1CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000092509885 544547914 /nfs/dbraw/zinc/54/79/14/544547914.db2.gz OCVXZRZJHSWPPI-PYUISTEWSA-N 1 1 331.416 2.941 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184266414 265013754 /nfs/dbraw/zinc/01/37/54/265013754.db2.gz IBWXLRUOFQEHLF-UONOGXRCSA-N 1 1 337.395 2.801 10 5 EFBEMO COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000191214298 265255569 /nfs/dbraw/zinc/25/55/69/265255569.db2.gz FTFJJRGOYCFMHV-COXVUDFISA-N 1 1 348.399 2.637 10 5 EFBEMO CC[N@H+]1CCC[C@@H](NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000194633892 265378739 /nfs/dbraw/zinc/37/87/39/265378739.db2.gz ZTQDWMYAAHPSBU-CHWSQXEVSA-N 1 1 337.445 2.676 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000272406693 266255407 /nfs/dbraw/zinc/25/54/07/266255407.db2.gz ZZLSLTPGVQYHPQ-IOASZLSFSA-N 1 1 349.431 2.651 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000272406693 266255410 /nfs/dbraw/zinc/25/54/10/266255410.db2.gz ZZLSLTPGVQYHPQ-IOASZLSFSA-N 1 1 349.431 2.651 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1C[C@H](C)[N@H+](C2CC2)C1 ZINC000276544494 267009919 /nfs/dbraw/zinc/00/99/19/267009919.db2.gz GSSQYELDRVQCFX-JQWIXIFHSA-N 1 1 337.807 2.912 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1 ZINC000276544490 267009997 /nfs/dbraw/zinc/00/99/97/267009997.db2.gz GSSQYELDRVQCFX-CMPLNLGQSA-N 1 1 337.807 2.912 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1 ZINC000276544500 267010633 /nfs/dbraw/zinc/01/06/33/267010633.db2.gz GSSQYELDRVQCFX-ZYHUDNBSSA-N 1 1 337.807 2.912 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000277641023 267220713 /nfs/dbraw/zinc/22/07/13/267220713.db2.gz TYZZFMLRXJLOKO-HIFRSBDPSA-N 1 1 347.415 2.691 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(N3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)nc2c1 ZINC000278607598 267497332 /nfs/dbraw/zinc/49/73/32/267497332.db2.gz ZWAGQBPTSODBKT-YVEFUNNKSA-N 1 1 341.415 2.924 10 5 EFBEMO COc1cc(C[N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1 ZINC000269662344 273087426 /nfs/dbraw/zinc/08/74/26/273087426.db2.gz KGZLLXIPUPIIHE-SFHVURJKSA-N 1 1 346.383 2.777 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)nc1 ZINC000281828062 273473602 /nfs/dbraw/zinc/47/36/02/273473602.db2.gz ICNWVVWBVADWNC-CYBMUJFWSA-N 1 1 327.388 2.907 10 5 EFBEMO COC(=O)c1cc(N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc(C)c1[N+](=O)[O-] ZINC000268841192 274000209 /nfs/dbraw/zinc/00/02/09/274000209.db2.gz OPJMSHJGPLBHFJ-CZUORRHYSA-N 1 1 347.415 2.610 10 5 EFBEMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000355791798 274384785 /nfs/dbraw/zinc/38/47/85/274384785.db2.gz ZVLZQLCXCWDRRO-MGPQQGTHSA-N 1 1 331.416 2.850 10 5 EFBEMO CCC[C@H]1CN(c2nc(C)cc(C)c2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000359087171 276049614 /nfs/dbraw/zinc/04/96/14/276049614.db2.gz WWLLSFWYJDCWBX-HNNXBMFYSA-N 1 1 336.436 2.544 10 5 EFBEMO CC(C)c1ccc(C[N@@H+]2C[C@H](N3CCOCC3)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000180230824 276053254 /nfs/dbraw/zinc/05/32/54/276053254.db2.gz SUIDUBCXRVWDFZ-KXBFYZLASA-N 1 1 347.459 2.871 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC000095438438 277137411 /nfs/dbraw/zinc/13/74/11/277137411.db2.gz JUMDISCTDFHLDB-WBVHZDCISA-N 1 1 343.358 2.909 10 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CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000247037877 281198227 /nfs/dbraw/zinc/19/82/27/281198227.db2.gz UZQVYBIQEWRFMP-STQMWFEESA-N 1 1 337.807 2.947 10 5 EFBEMO CCc1ccc(C(=O)N2C[C@@H]3CCC[N@@H+]3C[C@H]2CC)cc1[N+](=O)[O-] ZINC000245407815 281399276 /nfs/dbraw/zinc/39/92/76/281399276.db2.gz CZNLMPIOFVVRMS-CVEARBPZSA-N 1 1 331.416 2.856 10 5 EFBEMO COC(=O)c1ccc(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000153092055 293360051 /nfs/dbraw/zinc/36/00/51/293360051.db2.gz KALXCTZSVGCUJT-UHFFFAOYSA-N 1 1 326.352 2.940 10 5 EFBEMO COC(=O)c1ccc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000153092055 293360053 /nfs/dbraw/zinc/36/00/53/293360053.db2.gz KALXCTZSVGCUJT-UHFFFAOYSA-N 1 1 326.352 2.940 10 5 EFBEMO Cc1nc2n(n1)CCC[C@H]2[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193016071 293527721 /nfs/dbraw/zinc/52/77/21/293527721.db2.gz CLSSNFBVLIMFLA-JKSUJKDBSA-N 1 1 327.388 2.997 10 5 EFBEMO COc1ccc(NC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000291110211 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334.351 2.930 10 5 EFBEMO O=[N+]([O-])c1ccc(CO)cc1N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000302065813 311175814 /nfs/dbraw/zinc/17/58/14/311175814.db2.gz UIJPVKFFHUPWCN-HOCLYGCPSA-N 1 1 331.416 2.540 10 5 EFBEMO CC(C)C[C@H](CNc1cc(F)ccc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000302824897 311203134 /nfs/dbraw/zinc/20/31/34/311203134.db2.gz XSDXLAXXQQQPFU-CQSZACIVSA-N 1 1 325.384 2.893 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000330719079 311330907 /nfs/dbraw/zinc/33/09/07/311330907.db2.gz WBBCKNPSMXDVLS-UHOFOFEASA-N 1 1 349.431 2.651 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000330719079 311330908 /nfs/dbraw/zinc/33/09/08/311330908.db2.gz WBBCKNPSMXDVLS-UHOFOFEASA-N 1 1 349.431 2.651 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000330836424 311337638 /nfs/dbraw/zinc/33/76/38/311337638.db2.gz IFEWZNMBJYFZJL-GDBMZVCRSA-N 1 1 349.431 2.571 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000330836424 311337636 /nfs/dbraw/zinc/33/76/36/311337636.db2.gz IFEWZNMBJYFZJL-GDBMZVCRSA-N 1 1 349.431 2.571 10 5 EFBEMO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@@H]([NH3+])c1ccccc1 ZINC000414826331 312054793 /nfs/dbraw/zinc/05/47/93/312054793.db2.gz FMMOPTYJCXUMDA-SUMWQHHRSA-N 1 1 342.399 2.602 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@](O)(C(F)(F)F)C1 ZINC000470178691 313130092 /nfs/dbraw/zinc/13/00/92/313130092.db2.gz MIALOUVREKXTID-OIOXUXFSSA-N 1 1 330.306 2.997 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@](O)(C(F)(F)F)C1 ZINC000470178691 313130095 /nfs/dbraw/zinc/13/00/95/313130095.db2.gz MIALOUVREKXTID-OIOXUXFSSA-N 1 1 330.306 2.997 10 5 EFBEMO CC[N@H+]1C[C@@H](C)N(c2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)C[C@H]1C ZINC000497515958 315393291 /nfs/dbraw/zinc/39/32/91/315393291.db2.gz PZAKNGRVWNYNDK-CHWSQXEVSA-N 1 1 335.404 2.609 10 5 EFBEMO 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337.379 2.684 10 5 EFBEMO CC[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1ccccc1 ZINC000040087762 472027666 /nfs/dbraw/zinc/02/76/66/472027666.db2.gz BCUDJDOSBUYKJE-MRXNPFEDSA-N 1 1 330.384 2.857 10 5 EFBEMO O=C(CC[N@H+]1CCc2ccccc2C1)Nc1cccc([N+](=O)[O-])c1 ZINC000026156139 472125822 /nfs/dbraw/zinc/12/58/22/472125822.db2.gz VRGKEXKBQUPVOG-UHFFFAOYSA-N 1 1 325.368 2.982 10 5 EFBEMO C[N@H+](CCc1ccc(F)cc1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000055022787 472131850 /nfs/dbraw/zinc/13/18/50/472131850.db2.gz ZGZLDDCLOOKUAV-UHFFFAOYSA-N 1 1 331.347 2.847 10 5 EFBEMO C[N@@H+](CCc1ccc(F)cc1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000055022787 472131854 /nfs/dbraw/zinc/13/18/54/472131854.db2.gz ZGZLDDCLOOKUAV-UHFFFAOYSA-N 1 1 331.347 2.847 10 5 EFBEMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCN(C[C@H]2CCCC[N@H+]2C)CC1 ZINC000075718687 472188450 /nfs/dbraw/zinc/18/84/50/472188450.db2.gz BFKBLJBTCJFVLQ-DLBZAZTESA-N 1 1 346.475 2.758 10 5 EFBEMO CCOc1cc(N2CCC[N@H+](C3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000084805117 472219405 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10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[NH+]1CCC(=Cc2ccccc2)CC1 ZINC000090551862 472635491 /nfs/dbraw/zinc/63/54/91/472635491.db2.gz ARHQQLBZYMTPPF-UHFFFAOYSA-N 1 1 339.395 2.936 10 5 EFBEMO CC[C@H](NC(=O)NC[C@@H]1CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000090563038 472636980 /nfs/dbraw/zinc/63/69/80/472636980.db2.gz CYICFDIPQFUSAT-BBRMVZONSA-N 1 1 334.420 2.687 10 5 EFBEMO CC[C@H](NC(=O)NC[C@H]1CCC[N@H+]1CC)c1cccc([N+](=O)[O-])c1 ZINC000090591910 472641196 /nfs/dbraw/zinc/64/11/96/472641196.db2.gz KERKIAVSPRILCG-CVEARBPZSA-N 1 1 334.420 2.829 10 5 EFBEMO CCOCCC[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000072286179 472649326 /nfs/dbraw/zinc/64/93/26/472649326.db2.gz AYFLDVMVFUWDAK-GDBMZVCRSA-N 1 1 336.436 2.847 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000047142688 472659695 /nfs/dbraw/zinc/65/96/95/472659695.db2.gz HTYYMXAENZNWFT-LLVKDONJSA-N 1 1 325.796 2.852 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000060524369 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2.715 10 5 EFBEMO Cc1sc(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000063723161 472806880 /nfs/dbraw/zinc/80/68/80/472806880.db2.gz XRGWSBSOVYOORO-UHFFFAOYSA-N 1 1 325.434 2.911 10 5 EFBEMO CC[N@H+](CCc1nccs1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000121169112 472810944 /nfs/dbraw/zinc/81/09/44/472810944.db2.gz OKSZIGBHHSNMEL-LBPRGKRZSA-N 1 1 348.428 2.943 10 5 EFBEMO CC[N@@H+](CCc1nccs1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000121169112 472810951 /nfs/dbraw/zinc/81/09/51/472810951.db2.gz OKSZIGBHHSNMEL-LBPRGKRZSA-N 1 1 348.428 2.943 10 5 EFBEMO CCn1cnnc1C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000105928418 472811060 /nfs/dbraw/zinc/81/10/60/472811060.db2.gz CQIGSYYADVJAHR-UHFFFAOYSA-N 1 1 333.367 2.725 10 5 EFBEMO COC(=O)/C=C/c1ccc(N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000133534188 472815089 /nfs/dbraw/zinc/81/50/89/472815089.db2.gz OJVWFEQSXABDOP-RDGOESDJSA-N 1 1 345.399 2.818 10 5 EFBEMO COCC[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000092649499 472951482 /nfs/dbraw/zinc/95/14/82/472951482.db2.gz LTGBDIKQUQRUDA-CYBMUJFWSA-N 1 1 330.388 2.666 10 5 EFBEMO O=C(C[C@@H]1CCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1)c1ccc(F)cc1 ZINC000134840597 472973126 /nfs/dbraw/zinc/97/31/26/472973126.db2.gz LHSQADMWXSKFEE-HNNXBMFYSA-N 1 1 346.362 2.668 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000074315733 472985881 /nfs/dbraw/zinc/98/58/81/472985881.db2.gz CQOUPGYVLSTDDA-HNNXBMFYSA-N 1 1 331.416 2.707 10 5 EFBEMO C[N@H+]1CCC[C@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000051377022 473044217 /nfs/dbraw/zinc/04/42/17/473044217.db2.gz QOOLRDKBVMPSJW-LBPRGKRZSA-N 1 1 346.412 2.542 10 5 EFBEMO Cc1cc(NC2CC[NH+](CCN(C)C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000080568820 473048027 /nfs/dbraw/zinc/04/80/27/473048027.db2.gz BESGSVNCWWKBSJ-UHFFFAOYSA-N 1 1 340.855 2.995 10 5 EFBEMO CCOCC[N@@H+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)C[C@H]1CC ZINC000122844038 473064596 /nfs/dbraw/zinc/06/45/96/473064596.db2.gz KXRYJMZFVQVFQE-GFCCVEGCSA-N 1 1 342.827 2.580 10 5 EFBEMO CCOCC[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)C[C@H]1CC ZINC000122844038 473064600 /nfs/dbraw/zinc/06/46/00/473064600.db2.gz KXRYJMZFVQVFQE-GFCCVEGCSA-N 1 1 342.827 2.580 10 5 EFBEMO C[C@H]1C[C@H](N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123118278 473098749 /nfs/dbraw/zinc/09/87/49/473098749.db2.gz FTSYRLGCEOWADK-SWLSCSKDSA-N 1 1 346.431 2.724 10 5 EFBEMO COC(=O)/C=C/c1ccc(N[C@@H]2CC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1 ZINC000052279805 473099149 /nfs/dbraw/zinc/09/91/49/473099149.db2.gz OOAJVPIWUWIGLL-CGMDNHBQSA-N 1 1 345.399 2.820 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123118670 473099388 /nfs/dbraw/zinc/09/93/88/473099388.db2.gz FTSYRLGCEOWADK-WFASDCNBSA-N 1 1 346.431 2.724 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000123853528 473192503 /nfs/dbraw/zinc/19/25/03/473192503.db2.gz LKIUJNGLRQGUNA-RYUDHWBXSA-N 1 1 337.445 2.871 10 5 EFBEMO COc1ccc(C[N@H+]2CCC[C@H](Cc3noc(C)n3)C2)cc1[N+](=O)[O-] ZINC000161050269 473201590 /nfs/dbraw/zinc/20/15/90/473201590.db2.gz MCXZZCRLIXQAHN-CYBMUJFWSA-N 1 1 346.387 2.750 10 5 EFBEMO CC(C)C[C@H](CO)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000185323123 473394382 /nfs/dbraw/zinc/39/43/82/473394382.db2.gz PFDAJPJQCUNZDB-GFCCVEGCSA-N 1 1 343.811 2.526 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000185425317 473423917 /nfs/dbraw/zinc/42/39/17/473423917.db2.gz PPXATGXITUQOEH-NRMKIYEFSA-N 1 1 329.400 2.599 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](CNc2ccccn2)C1 ZINC000171640915 473427678 /nfs/dbraw/zinc/42/76/78/473427678.db2.gz GWASYGKSKQPWID-OAHLLOKOSA-N 1 1 342.399 2.803 10 5 EFBEMO CN1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1=O ZINC000191666034 473566761 /nfs/dbraw/zinc/56/67/61/473566761.db2.gz XQSZRICKYVIGJY-UHFFFAOYSA-N 1 1 329.356 2.519 10 5 EFBEMO CN1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1=O ZINC000191666034 473566763 /nfs/dbraw/zinc/56/67/63/473566763.db2.gz XQSZRICKYVIGJY-UHFFFAOYSA-N 1 1 329.356 2.519 10 5 EFBEMO NC(=O)c1ccc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)c([N+](=O)[O-])c1 ZINC000186240667 473625239 /nfs/dbraw/zinc/62/52/39/473625239.db2.gz OMCNIQDNSADOIF-UHFFFAOYSA-N 1 1 337.379 2.741 10 5 EFBEMO NC(=O)c1ccc(C[N@H+]2Cc3ccccc3C3(CC3)C2)c([N+](=O)[O-])c1 ZINC000186240667 473625244 /nfs/dbraw/zinc/62/52/44/473625244.db2.gz OMCNIQDNSADOIF-UHFFFAOYSA-N 1 1 337.379 2.741 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000127609719 473632346 /nfs/dbraw/zinc/63/23/46/473632346.db2.gz DJZDNRCMEPHKIX-AWEZNQCLSA-N 1 1 332.404 2.914 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000153761817 473639614 /nfs/dbraw/zinc/63/96/14/473639614.db2.gz XASMFQJQUPVBOA-RDTXWAMCSA-N 1 1 343.427 2.992 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](Cn2cncn2)C1 ZINC000116279586 473645947 /nfs/dbraw/zinc/64/59/47/473645947.db2.gz DRVRLHNHWIYEKX-GFCCVEGCSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](Cn2cncn2)C1 ZINC000116279586 473645951 /nfs/dbraw/zinc/64/59/51/473645951.db2.gz DRVRLHNHWIYEKX-GFCCVEGCSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1cc(F)ccc1OC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000153896383 473648558 /nfs/dbraw/zinc/64/85/58/473648558.db2.gz WIHZQFVMDVTSIZ-INIZCTEOSA-N 1 1 346.358 2.532 10 5 EFBEMO CCOC(=O)c1nn(C)cc1C[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000186373447 473662548 /nfs/dbraw/zinc/66/25/48/473662548.db2.gz VKUJZVYYSUQDRK-OAHLLOKOSA-N 1 1 346.387 2.746 10 5 EFBEMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179252462 473663372 /nfs/dbraw/zinc/66/33/72/473663372.db2.gz PFBXEYDMLNYCEJ-PHIMTYICSA-N 1 1 333.413 2.974 10 5 EFBEMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179252462 473663376 /nfs/dbraw/zinc/66/33/76/473663376.db2.gz PFBXEYDMLNYCEJ-PHIMTYICSA-N 1 1 333.413 2.974 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC[N@H+](C2CC2)CC1 ZINC000179487916 473690855 /nfs/dbraw/zinc/69/08/55/473690855.db2.gz QHQWSYDJVQWESU-UHFFFAOYSA-N 1 1 331.416 2.830 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2nc(CN3CC[N@H+]4CCC[C@@H]4C3)cs2)c1 ZINC000179545608 473693764 /nfs/dbraw/zinc/69/37/64/473693764.db2.gz KNOHBPINDUEGHA-MRXNPFEDSA-N 1 1 344.440 2.998 10 5 EFBEMO Cn1nccc1[C@H]1CCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000281398220 473706466 /nfs/dbraw/zinc/70/64/66/473706466.db2.gz NIADPTOOPCFCFO-OAHLLOKOSA-N 1 1 330.388 2.934 10 5 EFBEMO Cn1nccc1[C@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000281398220 473706476 /nfs/dbraw/zinc/70/64/76/473706476.db2.gz NIADPTOOPCFCFO-OAHLLOKOSA-N 1 1 330.388 2.934 10 5 EFBEMO Cn1nccc1[C@@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000281479489 473734013 /nfs/dbraw/zinc/73/40/13/473734013.db2.gz SFNUTDOUYZBJEL-DLBZAZTESA-N 1 1 330.388 2.589 10 5 EFBEMO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3cnn4ccccc34)CC2)c1 ZINC000179860897 473743827 /nfs/dbraw/zinc/74/38/27/473743827.db2.gz ZACYMROAABBXNS-UHFFFAOYSA-N 1 1 337.383 2.565 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000281568303 473768746 /nfs/dbraw/zinc/76/87/46/473768746.db2.gz MBQKCUUVZXNHLE-GJZGRUSLSA-N 1 1 349.431 2.613 10 5 EFBEMO C[N@@H+]1C[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C[C@H]2C1 ZINC000193615638 473797347 /nfs/dbraw/zinc/79/73/47/473797347.db2.gz MWPBBKPMQKASSA-TXEJJXNPSA-N 1 1 329.322 2.607 10 5 EFBEMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)C[C@H]1CCCO1 ZINC000263882778 473891804 /nfs/dbraw/zinc/89/18/04/473891804.db2.gz CHQDKOOZVVXUGV-ZYHUDNBSSA-N 1 1 341.795 2.686 10 5 EFBEMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@H]1CCCO1 ZINC000263882778 473891811 /nfs/dbraw/zinc/89/18/11/473891811.db2.gz CHQDKOOZVVXUGV-ZYHUDNBSSA-N 1 1 341.795 2.686 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000246558370 473901265 /nfs/dbraw/zinc/90/12/65/473901265.db2.gz LRVSDNNCTDAHRQ-STQMWFEESA-N 1 1 337.807 2.947 10 5 EFBEMO C[C@H](NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000174105571 473986928 /nfs/dbraw/zinc/98/69/28/473986928.db2.gz WZTMMTSTDOLNEV-YDHLFZDLSA-N 1 1 334.420 2.780 10 5 EFBEMO C[C@H](NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000174105530 473987328 /nfs/dbraw/zinc/98/73/28/473987328.db2.gz WZTMMTSTDOLNEV-VNHYZAJKSA-N 1 1 334.420 2.780 10 5 EFBEMO C[C@H](NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000174105555 473987480 /nfs/dbraw/zinc/98/74/80/473987480.db2.gz WZTMMTSTDOLNEV-IPYPFGDCSA-N 1 1 334.420 2.780 10 5 EFBEMO O=C(C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)NCC1CC1 ZINC000181294246 474022908 /nfs/dbraw/zinc/02/29/08/474022908.db2.gz KVZLYOAHBCLHDY-LJQANCHMSA-N 1 1 339.395 2.800 10 5 EFBEMO CC[C@@H]([NH2+]Cc1cc(=O)n2ccsc2n1)c1cccc([N+](=O)[O-])c1 ZINC000181528845 474045744 /nfs/dbraw/zinc/04/57/44/474045744.db2.gz ZVIKNXQSPMWQPY-CQSZACIVSA-N 1 1 344.396 2.905 10 5 EFBEMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H](c3nccs3)C2)c([N+](=O)[O-])c1 ZINC000195347003 474062933 /nfs/dbraw/zinc/06/29/33/474062933.db2.gz MFEWRBIALGYMIT-CYBMUJFWSA-N 1 1 346.412 2.530 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H]1c1ccco1 ZINC000181889232 474068015 /nfs/dbraw/zinc/06/80/15/474068015.db2.gz PPXIOGPRNIJVAO-ZIAGYGMSSA-N 1 1 332.356 2.765 10 5 EFBEMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000247113624 474069067 /nfs/dbraw/zinc/06/90/67/474069067.db2.gz FCPDZUCRTGGTDG-PWSUYJOCSA-N 1 1 338.795 2.949 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(=O)NCC(F)(F)F)C1 ZINC000275109625 474072987 /nfs/dbraw/zinc/07/29/87/474072987.db2.gz MVISZJIAZXXUPW-JQWIXIFHSA-N 1 1 345.321 2.656 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CCC[N@H+](C3CC3)CC2)cc1OC(F)F ZINC000174708862 474084217 /nfs/dbraw/zinc/08/42/17/474084217.db2.gz CJOPFRITJZWLNK-UHFFFAOYSA-N 1 1 327.331 2.871 10 5 EFBEMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000247206772 474087426 /nfs/dbraw/zinc/08/74/26/474087426.db2.gz LUEOEPHBISKJQC-PWSUYJOCSA-N 1 1 338.795 2.949 10 5 EFBEMO CCOc1ccc(C(=O)N(C)[C@H]2CC[N@@H+](CC)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000247380286 474133089 /nfs/dbraw/zinc/13/30/89/474133089.db2.gz LJSJGMJRNGKEHU-ZFWWWQNUSA-N 1 1 349.431 2.796 10 5 EFBEMO CCOc1ccc(C(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2CC)cc1[N+](=O)[O-] ZINC000175042173 474136122 /nfs/dbraw/zinc/13/61/22/474136122.db2.gz MHEASXCMXGIACK-LSDHHAIUSA-N 1 1 347.415 2.692 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000175436800 474220010 /nfs/dbraw/zinc/22/00/10/474220010.db2.gz LRVSDNNCTDAHRQ-QWHCGFSZSA-N 1 1 337.807 2.947 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@]3(O)CCCC[C@H]3C2)c2c(c1)COCO2 ZINC000247945468 474229526 /nfs/dbraw/zinc/22/95/26/474229526.db2.gz DMCSRXRTLAVSOK-MAUKXSAKSA-N 1 1 348.399 2.588 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000248124495 474263311 /nfs/dbraw/zinc/26/33/11/474263311.db2.gz VAHUFRZDWCEOSD-NVXWUHKLSA-N 1 1 325.368 2.770 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@H](C)[C@H](N2CCOCC2)C1 ZINC000182835089 474268120 /nfs/dbraw/zinc/26/81/20/474268120.db2.gz NMVKYIIXOKHCQF-RLFYNMQTSA-N 1 1 333.432 2.617 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)[C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000275745326 474303267 /nfs/dbraw/zinc/30/32/67/474303267.db2.gz COQNXZXVYVYWCS-WCQYABFASA-N 1 1 339.823 2.969 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)[C@H]1CC[N@H+](C)C[C@H]1C ZINC000275745327 474303571 /nfs/dbraw/zinc/30/35/71/474303571.db2.gz COQNXZXVYVYWCS-YPMHNXCESA-N 1 1 339.823 2.969 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265739071 474316136 /nfs/dbraw/zinc/31/61/36/474316136.db2.gz BNDIDJCPTMYDRF-CQSZACIVSA-N 1 1 333.432 2.863 10 5 EFBEMO C[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)CC1(CO)CC1 ZINC000275850302 474340605 /nfs/dbraw/zinc/34/06/05/474340605.db2.gz HTUBQXHWVPXOPD-UHFFFAOYSA-N 1 1 329.194 2.562 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1C(=O)NCc1ccco1 ZINC000183253570 474359999 /nfs/dbraw/zinc/35/99/99/474359999.db2.gz ARKCAUGLFXQTFR-KRWDZBQOSA-N 1 1 343.383 2.777 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1C(=O)NCc1ccco1 ZINC000183253570 474360005 /nfs/dbraw/zinc/36/00/05/474360005.db2.gz ARKCAUGLFXQTFR-KRWDZBQOSA-N 1 1 343.383 2.777 10 5 EFBEMO CC[NH+]1CC[C@H]([N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000283283613 474360146 /nfs/dbraw/zinc/36/01/46/474360146.db2.gz MFEQPODKVNFTGS-ZBFHGGJFSA-N 1 1 348.447 2.586 10 5 EFBEMO CC[NH+]1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000283283613 474360153 /nfs/dbraw/zinc/36/01/53/474360153.db2.gz MFEQPODKVNFTGS-ZBFHGGJFSA-N 1 1 348.447 2.586 10 5 EFBEMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000283283613 474360160 /nfs/dbraw/zinc/36/01/60/474360160.db2.gz MFEQPODKVNFTGS-ZBFHGGJFSA-N 1 1 348.447 2.586 10 5 EFBEMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000283283613 474360167 /nfs/dbraw/zinc/36/01/67/474360167.db2.gz MFEQPODKVNFTGS-ZBFHGGJFSA-N 1 1 348.447 2.586 10 5 EFBEMO CC[NH+]1CC[C@@H]([N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000283283597 474360344 /nfs/dbraw/zinc/36/03/44/474360344.db2.gz MFEQPODKVNFTGS-GOEBONIOSA-N 1 1 348.447 2.586 10 5 EFBEMO CC[NH+]1CC[C@@H]([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000283283597 474360351 /nfs/dbraw/zinc/36/03/51/474360351.db2.gz MFEQPODKVNFTGS-GOEBONIOSA-N 1 1 348.447 2.586 10 5 EFBEMO CCN1CC[C@@H]([N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000283283597 474360361 /nfs/dbraw/zinc/36/03/61/474360361.db2.gz MFEQPODKVNFTGS-GOEBONIOSA-N 1 1 348.447 2.586 10 5 EFBEMO CCN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000283283597 474360368 /nfs/dbraw/zinc/36/03/68/474360368.db2.gz MFEQPODKVNFTGS-GOEBONIOSA-N 1 1 348.447 2.586 10 5 EFBEMO CO[C@@H]1C[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC[C@@H]1C ZINC000189346631 474367156 /nfs/dbraw/zinc/36/71/56/474367156.db2.gz AXVFJXJFVZZSGA-NORZTCDRSA-N 1 1 335.404 2.587 10 5 EFBEMO CO[C@@H]1C[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC[C@@H]1C ZINC000189346631 474367162 /nfs/dbraw/zinc/36/71/62/474367162.db2.gz AXVFJXJFVZZSGA-NORZTCDRSA-N 1 1 335.404 2.587 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000183367195 474376556 /nfs/dbraw/zinc/37/65/56/474376556.db2.gz AWBGZISRFVBXPR-HOTGVXAUSA-N 1 1 340.445 2.691 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000183367195 474376562 /nfs/dbraw/zinc/37/65/62/474376562.db2.gz AWBGZISRFVBXPR-HOTGVXAUSA-N 1 1 340.445 2.691 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2CCC[N@@H+]2C[C@@H]1C ZINC000248613306 474377701 /nfs/dbraw/zinc/37/77/01/474377701.db2.gz QYNJDVQUJGQRJV-VOORUYIGSA-N 1 1 329.400 2.693 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000248614761 474377866 /nfs/dbraw/zinc/37/78/66/474377866.db2.gz IBWXLRUOFQEHLF-KBPBESRZSA-N 1 1 337.395 2.801 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H]([NH+](C)CC(=O)[O-])CC1 ZINC000248696628 474408057 /nfs/dbraw/zinc/40/80/57/474408057.db2.gz COTMJLLKSFTCNK-DZGCQCFKSA-N 1 1 335.404 2.527 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H]([NH+](C)CC(=O)[O-])CC1 ZINC000248696628 474408063 /nfs/dbraw/zinc/40/80/63/474408063.db2.gz COTMJLLKSFTCNK-DZGCQCFKSA-N 1 1 335.404 2.527 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC[C@@H]([N@H+](C)CC(=O)[O-])CC1 ZINC000248696628 474408067 /nfs/dbraw/zinc/40/80/67/474408067.db2.gz COTMJLLKSFTCNK-DZGCQCFKSA-N 1 1 335.404 2.527 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC[C@@H]([N@@H+](C)CC(=O)[O-])CC1 ZINC000248696628 474408069 /nfs/dbraw/zinc/40/80/69/474408069.db2.gz COTMJLLKSFTCNK-DZGCQCFKSA-N 1 1 335.404 2.527 10 5 EFBEMO COc1ccc([C@H]2C[C@@H](C)[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)cc1 ZINC000176250175 474421080 /nfs/dbraw/zinc/42/10/80/474421080.db2.gz VMLAPKGGPZZRSJ-HIFRSBDPSA-N 1 1 330.388 2.678 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCCN(c2ccccn2)CC1 ZINC000183784850 474428275 /nfs/dbraw/zinc/42/82/75/474428275.db2.gz PYXWWAKQZCUIDL-UHFFFAOYSA-N 1 1 342.399 2.581 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](C(F)(F)F)[C@H](CO)C1 ZINC000289797695 474430098 /nfs/dbraw/zinc/43/00/98/474430098.db2.gz SGZOKNOJTPCSLP-GXTWGEPZSA-N 1 1 332.322 2.896 10 5 EFBEMO CSc1cccc(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-] ZINC000249112141 474529270 /nfs/dbraw/zinc/52/92/70/474529270.db2.gz BULLGCQQHRQPKM-WCQYABFASA-N 1 1 337.445 2.775 10 5 EFBEMO C[N@H+]1CC[C@@H]2OCCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000284447764 474642107 /nfs/dbraw/zinc/64/21/07/474642107.db2.gz CHFSTOPUNJVKLJ-KGLIPLIRSA-N 1 1 345.321 2.523 10 5 EFBEMO C[N@H+]1CC[C@@H]2OCCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])[C@H]2C1 ZINC000284447758 474642127 /nfs/dbraw/zinc/64/21/27/474642127.db2.gz CHFSTOPUNJVKLJ-KBPBESRZSA-N 1 1 345.321 2.523 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)Nc2ccncc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000253309275 474721747 /nfs/dbraw/zinc/72/17/47/474721747.db2.gz BXUSZYOKVMWFRR-GDBMZVCRSA-N 1 1 341.371 2.557 10 5 EFBEMO COc1ncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)n1 ZINC000337190953 474768667 /nfs/dbraw/zinc/76/86/67/474768667.db2.gz SWFATSQWZWYGSY-UHFFFAOYSA-N 1 1 328.372 2.866 10 5 EFBEMO COc1ncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)n1 ZINC000337190953 474768674 /nfs/dbraw/zinc/76/86/74/474768674.db2.gz SWFATSQWZWYGSY-UHFFFAOYSA-N 1 1 328.372 2.866 10 5 EFBEMO Cc1sc(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000344626533 474773536 /nfs/dbraw/zinc/77/35/36/474773536.db2.gz YJFIRLVYNPVBDK-CYBMUJFWSA-N 1 1 325.434 2.815 10 5 EFBEMO Cc1c(C[NH2+]Cc2c(Br)cnn2C)cccc1[N+](=O)[O-] ZINC000312797902 474851830 /nfs/dbraw/zinc/85/18/30/474851830.db2.gz ANBWYQDOZSIWJU-UHFFFAOYSA-N 1 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CC[C@@H]1CN(C(C)=O)[C@@H](CC)C[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000352540171 475393552 /nfs/dbraw/zinc/39/35/52/475393552.db2.gz HUNGLGLBOMZNET-CVEARBPZSA-N 1 1 349.431 2.825 10 5 EFBEMO CC[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)[C@@H](CC)CN1C(C)=O ZINC000352540174 475394162 /nfs/dbraw/zinc/39/41/62/475394162.db2.gz HUNGLGLBOMZNET-JKSUJKDBSA-N 1 1 349.431 2.825 10 5 EFBEMO CC[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)[C@@H](CC)CN1C(C)=O ZINC000352540174 475394170 /nfs/dbraw/zinc/39/41/70/475394170.db2.gz HUNGLGLBOMZNET-JKSUJKDBSA-N 1 1 349.431 2.825 10 5 EFBEMO Cc1ccncc1C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000361424424 475438710 /nfs/dbraw/zinc/43/87/10/475438710.db2.gz ZWPDVBVIPBFZSH-UHFFFAOYSA-N 1 1 328.372 2.759 10 5 EFBEMO CC[C@H](NC(=O)[C@H]1CCCc2[nH+]ccn21)c1cccc([N+](=O)[O-])c1 ZINC000354910755 475512161 /nfs/dbraw/zinc/51/21/61/475512161.db2.gz CMHAFDBRPOTWBR-LSDHHAIUSA-N 1 1 328.372 2.936 10 5 EFBEMO C[C@H]([NH2+]Cc1cccc(N2CCOCC2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000358275875 475551759 /nfs/dbraw/zinc/55/17/59/475551759.db2.gz OUEOUPSPUVANFN-AWEZNQCLSA-N 1 1 342.399 2.677 10 5 EFBEMO CC[N@H+]1CCC[C@@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000338066833 475559733 /nfs/dbraw/zinc/55/97/33/475559733.db2.gz OITBFIRAQHBSNO-LBPRGKRZSA-N 1 1 330.388 2.538 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)ccc1[N+](=O)[O-] ZINC000352776298 475612516 /nfs/dbraw/zinc/61/25/16/475612516.db2.gz BPAIOZUMTDNHCQ-XJKSGUPXSA-N 1 1 330.388 2.883 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)cc1 ZINC000361683366 475660979 /nfs/dbraw/zinc/66/09/79/475660979.db2.gz AZTFHRPNDQSZGT-IAGOWNOFSA-N 1 1 343.358 2.909 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)cc1 ZINC000361683366 475660985 /nfs/dbraw/zinc/66/09/85/475660985.db2.gz AZTFHRPNDQSZGT-IAGOWNOFSA-N 1 1 343.358 2.909 10 5 EFBEMO CC(C)(CNc1ccncc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000340150646 475802566 /nfs/dbraw/zinc/80/25/66/475802566.db2.gz AKRPWFTWHFMXRH-UHFFFAOYSA-N 1 1 326.400 2.661 10 5 EFBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]Cc2ncccc2O)c1 ZINC000355338834 475841428 /nfs/dbraw/zinc/84/14/28/475841428.db2.gz ULVNNRYWYKGYIX-UHFFFAOYSA-N 1 1 325.271 2.587 10 5 EFBEMO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)Nc1cccc(F)c1 ZINC000343323650 475951144 /nfs/dbraw/zinc/95/11/44/475951144.db2.gz UZGFGWOIDRBJEE-UHFFFAOYSA-N 1 1 347.346 2.683 10 5 EFBEMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)Nc1cccc(F)c1 ZINC000343323650 475951150 /nfs/dbraw/zinc/95/11/50/475951150.db2.gz UZGFGWOIDRBJEE-UHFFFAOYSA-N 1 1 347.346 2.683 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](C[C@H](O)Cc1cccc(Cl)c1)CC2 ZINC000346977233 476004789 /nfs/dbraw/zinc/00/47/89/476004789.db2.gz WLWGPPALQMYYOM-MRXNPFEDSA-N 1 1 347.802 2.605 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](C[C@H](O)Cc1cccc(Cl)c1)CC2 ZINC000346977233 476004796 /nfs/dbraw/zinc/00/47/96/476004796.db2.gz WLWGPPALQMYYOM-MRXNPFEDSA-N 1 1 347.802 2.605 10 5 EFBEMO CN(C(=O)C[N@@H+]1CC[C@]2(C)[C@H](C1)C2(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000298259761 476036890 /nfs/dbraw/zinc/03/68/90/476036890.db2.gz MDTSMOPEHTZMLI-DZGCQCFKSA-N 1 1 339.342 2.535 10 5 EFBEMO CN(C(=O)C[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000298259761 476036899 /nfs/dbraw/zinc/03/68/99/476036899.db2.gz MDTSMOPEHTZMLI-DZGCQCFKSA-N 1 1 339.342 2.535 10 5 EFBEMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000347017492 476037933 /nfs/dbraw/zinc/03/79/33/476037933.db2.gz OXNAELRBVNAQRE-DOMZBBRYSA-N 1 1 349.456 2.771 10 5 EFBEMO C[C@]12CC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@H]1C2(F)F ZINC000298435919 476093372 /nfs/dbraw/zinc/09/33/72/476093372.db2.gz YRSNAUSQCNYKRZ-OLZOCXBDSA-N 1 1 327.287 2.980 10 5 EFBEMO C[C@]12CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@H]1C2(F)F ZINC000298435919 476093377 /nfs/dbraw/zinc/09/33/77/476093377.db2.gz YRSNAUSQCNYKRZ-OLZOCXBDSA-N 1 1 327.287 2.980 10 5 EFBEMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(OCC)c([N+](=O)[O-])c2)C1 ZINC000362242489 476105572 /nfs/dbraw/zinc/10/55/72/476105572.db2.gz IDWUBRQOOIKJBM-AWEZNQCLSA-N 1 1 349.431 2.797 10 5 EFBEMO Cn1cnc([N+](=O)[O-])c1N[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)cc1 ZINC000340586199 476124916 /nfs/dbraw/zinc/12/49/16/476124916.db2.gz NUVUVGYLZGYQAK-QWHCGFSZSA-N 1 1 335.795 2.839 10 5 EFBEMO O=[N+]([O-])c1cnc(NC[C@@H]2CCCC[N@H+]2Cc2ccccc2)nc1 ZINC000302167927 476191830 /nfs/dbraw/zinc/19/18/30/476191830.db2.gz SKDQZCBNZXTKMT-HNNXBMFYSA-N 1 1 327.388 2.851 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000357066244 476201468 /nfs/dbraw/zinc/20/14/68/476201468.db2.gz HBSTUKAZWPEBRI-GOSISDBHSA-N 1 1 347.415 2.734 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000357066244 476201476 /nfs/dbraw/zinc/20/14/76/476201476.db2.gz HBSTUKAZWPEBRI-GOSISDBHSA-N 1 1 347.415 2.734 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@]2(CCCOC2)C1 ZINC000357075519 476210095 /nfs/dbraw/zinc/21/00/95/476210095.db2.gz SYXITWVFAKJRDO-SFHVURJKSA-N 1 1 347.415 2.734 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000357075519 476210105 /nfs/dbraw/zinc/21/01/05/476210105.db2.gz SYXITWVFAKJRDO-SFHVURJKSA-N 1 1 347.415 2.734 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@@]2(CCCOC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000357083634 476216974 /nfs/dbraw/zinc/21/69/74/476216974.db2.gz YZQOPJBOEBEBCB-GOSISDBHSA-N 1 1 347.415 2.816 10 5 EFBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000357098034 476229415 /nfs/dbraw/zinc/22/94/15/476229415.db2.gz JJQRIABAOMNSGZ-KBXCAEBGSA-N 1 1 347.415 2.814 10 5 EFBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000357098034 476229421 /nfs/dbraw/zinc/22/94/21/476229421.db2.gz JJQRIABAOMNSGZ-KBXCAEBGSA-N 1 1 347.415 2.814 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]3COCC[C@H]32)cccc1[N+](=O)[O-] ZINC000362447010 476258162 /nfs/dbraw/zinc/25/81/62/476258162.db2.gz JVEBWDFQAHYREY-WMLDXEAASA-N 1 1 347.415 2.733 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H]4COCC[C@@H]43)n2)cc1 ZINC000362450313 476260485 /nfs/dbraw/zinc/26/04/85/476260485.db2.gz JPDXXEFDGLSBED-HIFRSBDPSA-N 1 1 344.371 2.646 10 5 EFBEMO C[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@H]1c1cccs1 ZINC000357218580 476293761 /nfs/dbraw/zinc/29/37/61/476293761.db2.gz HYTIKJNHGLZUHT-ABAIWWIYSA-N 1 1 348.428 2.797 10 5 EFBEMO C[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccs1 ZINC000357219234 476294337 /nfs/dbraw/zinc/29/43/37/476294337.db2.gz JOZVDXKZOPMZTQ-NHYWBVRUSA-N 1 1 348.428 2.797 10 5 EFBEMO C[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccs1 ZINC000357219229 476294570 /nfs/dbraw/zinc/29/45/70/476294570.db2.gz JOZVDXKZOPMZTQ-ABAIWWIYSA-N 1 1 348.428 2.797 10 5 EFBEMO CN(C)c1nc(NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc[nH+]1 ZINC000362673988 476347410 /nfs/dbraw/zinc/34/74/10/476347410.db2.gz YZCQJMXKIPQMLD-UHFFFAOYSA-N 1 1 341.293 2.504 10 5 EFBEMO O=C1C[C@H]([C@@H]2CCCC[N@@H+]2C/C=C/c2ccccc2[N+](=O)[O-])CN1 ZINC000360808535 476401961 /nfs/dbraw/zinc/40/19/61/476401961.db2.gz DQHDFBZDCOHPRR-MCXNIAKKSA-N 1 1 329.400 2.599 10 5 EFBEMO CC[C@@H](NC(=O)NCC[N@@H+]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000354166967 476475828 /nfs/dbraw/zinc/47/58/28/476475828.db2.gz VLHBLLKXAIYBEN-MRXNPFEDSA-N 1 1 332.404 2.607 10 5 EFBEMO O=C(C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)NCC(F)F ZINC000360922083 476477969 /nfs/dbraw/zinc/47/79/69/476477969.db2.gz YZNVTKRATDYUAC-KRWDZBQOSA-N 1 1 349.337 2.655 10 5 EFBEMO CCC[N@H+]1CCC[C@@H]1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000351633317 476486029 /nfs/dbraw/zinc/48/60/29/476486029.db2.gz XCJDZXNNWFUNLA-CQSZACIVSA-N 1 1 339.823 2.781 10 5 EFBEMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)CC[C@H]1CCCC[N@H+]1C ZINC000357700304 476546978 /nfs/dbraw/zinc/54/69/78/476546978.db2.gz WNJJUKPAKBFWLA-MRXNPFEDSA-N 1 1 333.432 2.860 10 5 EFBEMO CO[C@H](C)C[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000354366081 476614372 /nfs/dbraw/zinc/61/43/72/476614372.db2.gz FZNFTNKWNDNVCZ-CYBMUJFWSA-N 1 1 337.420 2.977 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429829730 476698118 /nfs/dbraw/zinc/69/81/18/476698118.db2.gz OJSUMAPEEAERFR-AWEZNQCLSA-N 1 1 333.432 2.863 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@]3(CCOC3)C2)cccc1[N+](=O)[O-] ZINC000451901847 476711752 /nfs/dbraw/zinc/71/17/52/476711752.db2.gz NKXDVAMAMVNLBH-GOSISDBHSA-N 1 1 347.415 2.734 10 5 EFBEMO COC[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000452096278 476820271 /nfs/dbraw/zinc/82/02/71/476820271.db2.gz YBKOCKIWUYBLFQ-KBPBESRZSA-N 1 1 335.404 2.670 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000456993433 476820644 /nfs/dbraw/zinc/82/06/44/476820644.db2.gz NWSVYQRBKFTPQW-KRWDZBQOSA-N 1 1 325.368 2.690 10 5 EFBEMO Cc1c(CC(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000457030143 476837362 /nfs/dbraw/zinc/83/73/62/476837362.db2.gz RSRZLPIWCGRBOL-QGZVFWFLSA-N 1 1 339.395 2.619 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](c2nc(C3CC3)no2)C1 ZINC000375465606 476854070 /nfs/dbraw/zinc/85/40/70/476854070.db2.gz OWWGSNPNTHRPDY-ZDUSSCGKSA-N 1 1 344.371 2.724 10 5 EFBEMO COC(=O)c1cc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc(C)c1[N+](=O)[O-] ZINC000370539642 476861924 /nfs/dbraw/zinc/86/19/24/476861924.db2.gz NJAJTOHTMOBUOK-TZMCWYRMSA-N 1 1 333.388 2.729 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCCCN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1 ZINC000447680282 477035458 /nfs/dbraw/zinc/03/54/58/477035458.db2.gz QOHAOJJJYKDLSD-CYBMUJFWSA-N 1 1 331.420 2.960 10 5 EFBEMO Cc1[nH+]ccn1-c1ccccc1CNc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000447694198 477037714 /nfs/dbraw/zinc/03/77/14/477037714.db2.gz PVYCWWWDRKIDPC-UHFFFAOYSA-N 1 1 348.366 2.999 10 5 EFBEMO C[N@H+]1CC[C@@]2(CCN(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)C2)C1 ZINC000366533524 477055772 /nfs/dbraw/zinc/05/57/72/477055772.db2.gz HRFRRTSILRIMBP-GOSISDBHSA-N 1 1 342.399 2.777 10 5 EFBEMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000448761321 477277897 /nfs/dbraw/zinc/27/78/97/477277897.db2.gz IXAOAFWUOJTDLP-JTQLQIEISA-N 1 1 345.321 2.685 10 5 EFBEMO Nc1nccc([C@H]2CCC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)n1 ZINC000366989604 477288532 /nfs/dbraw/zinc/28/85/32/477288532.db2.gz PXMYBEQXRACWQI-NSHDSACASA-N 1 1 347.806 2.830 10 5 EFBEMO Nc1nccc([C@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)n1 ZINC000366989604 477288540 /nfs/dbraw/zinc/28/85/40/477288540.db2.gz PXMYBEQXRACWQI-NSHDSACASA-N 1 1 347.806 2.830 10 5 EFBEMO C[N@H+]1CCC[C@H](CCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000458166820 477299137 /nfs/dbraw/zinc/29/91/37/477299137.db2.gz MKJLSFAWUIBKAX-GFCCVEGCSA-N 1 1 330.388 2.538 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@]4(C3)CCCOC4)n2)cc1 ZINC000367076008 477329356 /nfs/dbraw/zinc/32/93/56/477329356.db2.gz YTZXDDVCEBOEEM-KRWDZBQOSA-N 1 1 344.371 2.647 10 5 EFBEMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cc4cccnc4o3)C2)nc1 ZINC000449029842 477399668 /nfs/dbraw/zinc/39/96/68/477399668.db2.gz PYFRHDMBCQCCLD-CYBMUJFWSA-N 1 1 339.355 2.817 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(c2ccc(F)cn2)CC1 ZINC000367721862 477654692 /nfs/dbraw/zinc/65/46/92/477654692.db2.gz PSNVOUBHYRPHJJ-UHFFFAOYSA-N 1 1 330.363 2.760 10 5 EFBEMO Cc1cc(N2CCC[C@H]3C[N@H+](C)C[C@H]32)c2cccc([N+](=O)[O-])c2n1 ZINC000425290964 477678041 /nfs/dbraw/zinc/67/80/41/477678041.db2.gz YUBYNRYWMKZCEE-SUMWQHHRSA-N 1 1 326.400 2.982 10 5 EFBEMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000438483198 477848553 /nfs/dbraw/zinc/84/85/53/477848553.db2.gz CURNXMZLOYGCMK-QWHCGFSZSA-N 1 1 335.404 2.908 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](O)CC12CCC2 ZINC000420998841 477887430 /nfs/dbraw/zinc/88/74/30/477887430.db2.gz UIDYFVNOQRFSGW-HNNXBMFYSA-N 1 1 347.415 2.611 10 5 EFBEMO CC[C@@H]1C[C@H]([NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CCO1 ZINC000421370575 478060301 /nfs/dbraw/zinc/06/03/01/478060301.db2.gz BXFDRRPHORSFLT-OIISXLGYSA-N 1 1 344.415 2.965 10 5 EFBEMO CC[C@@H]1C[C@@H]([NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000421395448 478071916 /nfs/dbraw/zinc/07/19/16/478071916.db2.gz YKNJVPWLIKSMJP-USXIJHARSA-N 1 1 344.415 2.965 10 5 EFBEMO Cc1cc(F)ccc1C[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000488051620 478111216 /nfs/dbraw/zinc/11/12/16/478111216.db2.gz MDVBGLIVZKJQSE-INIZCTEOSA-N 1 1 348.374 2.914 10 5 EFBEMO Cn1cc(C[N@@H+](C)C2CCOCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000535080259 478197258 /nfs/dbraw/zinc/19/72/58/478197258.db2.gz OXKSOFSHULEAEI-UHFFFAOYSA-N 1 1 330.388 2.606 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H](O)COc1ccccc1F)C2 ZINC000535244785 478202862 /nfs/dbraw/zinc/20/28/62/478202862.db2.gz AXRNEBDHZQKDSG-CQSZACIVSA-N 1 1 346.358 2.532 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)COc1ccccc1F)C2 ZINC000535244785 478202865 /nfs/dbraw/zinc/20/28/65/478202865.db2.gz AXRNEBDHZQKDSG-CQSZACIVSA-N 1 1 346.358 2.532 10 5 EFBEMO COC[C@H]1CCC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1 ZINC000590663906 478281573 /nfs/dbraw/zinc/28/15/73/478281573.db2.gz YVWNBQSAHUZHBZ-ZDUSSCGKSA-N 1 1 336.388 2.630 10 5 EFBEMO O=C(Cc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000600228413 478298563 /nfs/dbraw/zinc/29/85/63/478298563.db2.gz LSVROLFCONKOPY-INIZCTEOSA-N 1 1 331.416 2.661 10 5 EFBEMO O=C(Cc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000600228415 478298596 /nfs/dbraw/zinc/29/85/96/478298596.db2.gz LSVROLFCONKOPY-MRXNPFEDSA-N 1 1 331.416 2.661 10 5 EFBEMO COc1cc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000600229094 478299136 /nfs/dbraw/zinc/29/91/36/478299136.db2.gz OZCBNUMMASWHDD-HNNXBMFYSA-N 1 1 347.415 2.740 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000600472189 478382733 /nfs/dbraw/zinc/38/27/33/478382733.db2.gz MZPDGXPCISQKMF-LBPRGKRZSA-N 1 1 337.807 2.995 10 5 EFBEMO C[C@H](C(=O)N1CC[NH2+][C@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000562958535 478393196 /nfs/dbraw/zinc/39/31/96/478393196.db2.gz IBYBOZCZUGODDB-KSSFIOAISA-N 1 1 339.395 2.871 10 5 EFBEMO CC(C)(C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000597581823 478420765 /nfs/dbraw/zinc/42/07/65/478420765.db2.gz RKDYZJKWBVLYRH-HOTGVXAUSA-N 1 1 349.406 2.517 10 5 EFBEMO CCOc1cc(NC[C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000594591822 478452138 /nfs/dbraw/zinc/45/21/38/478452138.db2.gz MKFDGTVOKHRNLP-MELADBBJSA-N 1 1 337.420 2.903 10 5 EFBEMO CCOc1cc(NC[C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000594591822 478452143 /nfs/dbraw/zinc/45/21/43/478452143.db2.gz MKFDGTVOKHRNLP-MELADBBJSA-N 1 1 337.420 2.903 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000597857597 478543958 /nfs/dbraw/zinc/54/39/58/478543958.db2.gz GIBRCXBZSDFUKN-NSHDSACASA-N 1 1 325.796 2.851 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000597857632 478544849 /nfs/dbraw/zinc/54/48/49/478544849.db2.gz HQPXYBSEWKIRSV-HNNXBMFYSA-N 1 1 344.415 2.539 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000597858159 478545081 /nfs/dbraw/zinc/54/50/81/478545081.db2.gz KWHMUMQAOOEIJM-AWEZNQCLSA-N 1 1 346.431 2.772 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(CC)[C@H]1CC[N@@H+](C)C1 ZINC000597946314 478589790 /nfs/dbraw/zinc/58/97/90/478589790.db2.gz OCJLWWSFPROMLT-WBVHZDCISA-N 1 1 333.432 2.716 10 5 EFBEMO CCN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CC[N@@H+](C)C1 ZINC000597945065 478590958 /nfs/dbraw/zinc/59/09/58/478590958.db2.gz HKSWIBPRWAZYQU-LBPRGKRZSA-N 1 1 345.321 2.780 10 5 EFBEMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000600997676 478605219 /nfs/dbraw/zinc/60/52/19/478605219.db2.gz AVPKPUYDZVKGOR-IAGOWNOFSA-N 1 1 343.427 2.760 10 5 EFBEMO C[C@@H]1CC[N@@H+](CC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000582556043 478629335 /nfs/dbraw/zinc/62/93/35/478629335.db2.gz KJADJFQHBJTWQY-GDBMZVCRSA-N 1 1 331.416 2.643 10 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478656822 /nfs/dbraw/zinc/65/68/22/478656822.db2.gz XCTIACCGYRXYOA-UHFFFAOYSA-N 1 1 346.362 2.573 10 5 EFBEMO CC(C)[N@H+]1CCC[C@H](CNc2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC000601109756 478662342 /nfs/dbraw/zinc/66/23/42/478662342.db2.gz YAXXBLOKOLJWIU-SNVBAGLBSA-N 1 1 349.357 2.879 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NCC[N@@H+](C)C1CCCC1 ZINC000601114620 478664617 /nfs/dbraw/zinc/66/46/17/478664617.db2.gz UNIRKUQZYNPHCC-UHFFFAOYSA-N 1 1 335.330 2.633 10 5 EFBEMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(c2ncc(F)cc2[N+](=O)[O-])C1 ZINC000601120717 478668300 /nfs/dbraw/zinc/66/83/00/478668300.db2.gz MXADGRKPOWPSTH-OAHLLOKOSA-N 1 1 330.363 2.840 10 5 EFBEMO CCC[N@@H+](C)C[C@H]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC000601120614 478669063 /nfs/dbraw/zinc/66/90/63/478669063.db2.gz MFYHIOLRQGUQJO-SNVBAGLBSA-N 1 1 349.357 2.515 10 5 EFBEMO CN(CC[C@H]1CCCC[N@H+]1C)c1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601120484 478669297 /nfs/dbraw/zinc/66/92/97/478669297.db2.gz HFSGHLUSVGFHJL-SNVBAGLBSA-N 1 1 349.357 2.658 10 5 EFBEMO Cc1nn(C)c(C)c1CCCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000601138875 478681489 /nfs/dbraw/zinc/68/14/89/478681489.db2.gz YWFJGKWVHLCERA-UHFFFAOYSA-N 1 1 339.399 2.960 10 5 EFBEMO C[C@@](CO)([NH2+]Cc1cnc(C2CC2)s1)c1cccc([N+](=O)[O-])c1 ZINC000601150348 478690301 /nfs/dbraw/zinc/69/03/01/478690301.db2.gz WCNWOZLKHJSKGI-INIZCTEOSA-N 1 1 333.413 2.926 10 5 EFBEMO CN(C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000601152517 478691091 /nfs/dbraw/zinc/69/10/91/478691091.db2.gz FGFDNRZVJKXGAF-QGZVFWFLSA-N 1 1 343.427 2.712 10 5 EFBEMO CO[C@H](CCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12)C(F)(F)F ZINC000601152377 478691769 /nfs/dbraw/zinc/69/17/69/478691769.db2.gz CZSQFTITWWLHPU-CYBMUJFWSA-N 1 1 329.278 2.944 10 5 EFBEMO Cc1c[nH+]ccc1OC1CCN(c2ncc(F)cc2[N+](=O)[O-])CC1 ZINC000601154492 478693555 /nfs/dbraw/zinc/69/35/55/478693555.db2.gz MHCAPKNDRMTHDQ-UHFFFAOYSA-N 1 1 332.335 2.880 10 5 EFBEMO O=[N+]([O-])c1cc(F)cnc1N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000601157790 478695982 /nfs/dbraw/zinc/69/59/82/478695982.db2.gz FPMNSJBISMZLDK-GASCZTMLSA-N 1 1 342.374 2.697 10 5 EFBEMO CC[C@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C[C@@]2(CCOC2)O1 ZINC000601157834 478696038 /nfs/dbraw/zinc/69/60/38/478696038.db2.gz GWHNOIVLIPCULU-KBXCAEBGSA-N 1 1 343.383 2.917 10 5 EFBEMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601180935 478709384 /nfs/dbraw/zinc/70/93/84/478709384.db2.gz ZWNMMNQSNIUSOF-HNNXBMFYSA-N 1 1 345.443 2.817 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCO[C@]4(CCSC4)C3)c2c1 ZINC000601181465 478710260 /nfs/dbraw/zinc/71/02/60/478710260.db2.gz KWXFWBGKRZBDSU-MRXNPFEDSA-N 1 1 331.397 2.855 10 5 EFBEMO CCC[C@@H]1CN(c2c(OC)cccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000582917110 478720322 /nfs/dbraw/zinc/72/03/22/478720322.db2.gz ZIEPKFILUFYZMF-CQSZACIVSA-N 1 1 337.420 2.541 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)c2ccc([N+](=O)[O-])c(OC(C)C)n2)[C@@H](C)C1 ZINC000564469336 478748269 /nfs/dbraw/zinc/74/82/69/478748269.db2.gz 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EFBEMO O=[N+]([O-])c1ccccc1C[N@H+](CCn1cccn1)[C@H]1CC[C@H](O)CC1 ZINC000592130288 478788893 /nfs/dbraw/zinc/78/88/93/478788893.db2.gz AGDCPXWSEWHGRB-QAQDUYKDSA-N 1 1 344.415 2.597 10 5 EFBEMO Cc1noc(C[N@@H+]2CCC[C@@]3(C2)OCc2ccccc23)c1[N+](=O)[O-] ZINC000595450691 478791942 /nfs/dbraw/zinc/79/19/42/478791942.db2.gz VDQOYMDMLQHIQU-KRWDZBQOSA-N 1 1 329.356 2.913 10 5 EFBEMO Cc1noc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)c1[N+](=O)[O-] ZINC000595450691 478791951 /nfs/dbraw/zinc/79/19/51/478791951.db2.gz VDQOYMDMLQHIQU-KRWDZBQOSA-N 1 1 329.356 2.913 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2c(F)cccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000601382901 478812199 /nfs/dbraw/zinc/81/21/99/478812199.db2.gz IUQOBQRWJNJZGT-YOEHRIQHSA-N 1 1 343.358 2.909 10 5 EFBEMO CCCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H]1CCc2ncsc2C1 ZINC000592189873 478820717 /nfs/dbraw/zinc/82/07/17/478820717.db2.gz YMHVNBDVAIFDGK-ZDUSSCGKSA-N 1 1 349.460 2.907 10 5 EFBEMO CC[C@@H]1[C@@H](C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000601413878 478825600 /nfs/dbraw/zinc/82/56/00/478825600.db2.gz KUIYPCDHWZEEJT-UONOGXRCSA-N 1 1 339.823 2.637 10 5 EFBEMO CO[C@H](C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)[C@H]1CCOC1 ZINC000595520780 478832647 /nfs/dbraw/zinc/83/26/47/478832647.db2.gz DQLQUPGNRYSMLW-SOLBZPMBSA-N 1 1 334.416 2.826 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000601460225 478842745 /nfs/dbraw/zinc/84/27/45/478842745.db2.gz QKEMNYNAFDFUTI-UHFFFAOYSA-N 1 1 332.335 2.716 10 5 EFBEMO Cc1noc(C[N@H+]2CC[C@@H](C)[C@@H](C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000595562380 478857659 /nfs/dbraw/zinc/85/76/59/478857659.db2.gz JOQXKJSNKWXBMF-PWSUYJOCSA-N 1 1 339.392 2.691 10 5 EFBEMO Cc1noc(C[N@@H+]2CC[C@@H](C)[C@@H](C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000595562380 478857668 /nfs/dbraw/zinc/85/76/68/478857668.db2.gz JOQXKJSNKWXBMF-PWSUYJOCSA-N 1 1 339.392 2.691 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598558884 478893985 /nfs/dbraw/zinc/89/39/85/478893985.db2.gz FWOFSYWBWJCBPB-HNNXBMFYSA-N 1 1 331.416 2.755 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@@](C)(C2CC2)C1 ZINC000595627213 478898431 /nfs/dbraw/zinc/89/84/31/478898431.db2.gz XCLJFJVEFBSGEF-GOSISDBHSA-N 1 1 347.415 2.733 10 5 EFBEMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000601620426 478910863 /nfs/dbraw/zinc/91/08/63/478910863.db2.gz ITWMHHUGHYRKDH-KRWDZBQOSA-N 1 1 345.443 2.958 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC3(C[C@@H]2C)CCOCC3)c1 ZINC000592525659 478931857 /nfs/dbraw/zinc/93/18/57/478931857.db2.gz CQNFORXVGCJCLT-ZDUSSCGKSA-N 1 1 348.399 2.772 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC2(CCC2)OC[C@H]1C ZINC000595680037 478932181 /nfs/dbraw/zinc/93/21/81/478932181.db2.gz GNQYBESNXMTFRC-CQSZACIVSA-N 1 1 347.415 2.875 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC2(CCC2)OC[C@H]1C ZINC000595680019 478932349 /nfs/dbraw/zinc/93/23/49/478932349.db2.gz GHHQAECEDPWHBG-CQSZACIVSA-N 1 1 347.415 2.875 10 5 EFBEMO Cc1c(NC(=O)CC[N@@H+]2CC3(CCC3)OC[C@H]2C)cccc1[N+](=O)[O-] ZINC000595683613 478934012 /nfs/dbraw/zinc/93/40/12/478934012.db2.gz WTONESULEADHPH-CYBMUJFWSA-N 1 1 347.415 2.875 10 5 EFBEMO Cc1c(NC(=O)CC[N@@H+]2C[C@]3(C)COC[C@]3(C)C2)cccc1[N+](=O)[O-] ZINC000595687917 478936970 /nfs/dbraw/zinc/93/69/70/478936970.db2.gz FTZPROJLAJACBU-HDICACEKSA-N 1 1 347.415 2.590 10 5 EFBEMO CC(C)c1[nH]nc(C(=O)N2CCC(C)([NH+]3CCCC3)CC2)c1[N+](=O)[O-] ZINC000601736984 478977184 /nfs/dbraw/zinc/97/71/84/478977184.db2.gz BAQGEKTWEWOYRF-UHFFFAOYSA-N 1 1 349.435 2.532 10 5 EFBEMO O=C(C[N@H+]1CCC[C@@H](CCF)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595755066 478978680 /nfs/dbraw/zinc/97/86/80/478978680.db2.gz FQABIVOWEQNGPT-ZDUSSCGKSA-N 1 1 335.379 2.556 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](Nc2ncccn2)C1 ZINC000583995167 478989878 /nfs/dbraw/zinc/98/98/78/478989878.db2.gz PCHZYYOENRYVBS-DNXIFWLFSA-N 1 1 339.399 2.975 10 5 EFBEMO C[C@H]([NH2+][C@H]1C[C@@H](O)C12CCC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000595783069 478995681 /nfs/dbraw/zinc/99/56/81/478995681.db2.gz QAZDPUQRETZVPD-LEWSCRJBSA-N 1 1 344.371 2.599 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC3(CCCC3=O)CC2)c1 ZINC000595818492 479015272 /nfs/dbraw/zinc/01/52/72/479015272.db2.gz PKPCEBRSERJBNS-UHFFFAOYSA-N 1 1 346.383 2.717 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](N(C)C(=O)N(C)C)C1 ZINC000595823781 479017389 /nfs/dbraw/zinc/01/73/89/479017389.db2.gz QYEOHHVYDLKTEF-DZGCQCFKSA-N 1 1 334.420 2.652 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H]2COC[C@H]2C1 ZINC000595826966 479021391 /nfs/dbraw/zinc/02/13/91/479021391.db2.gz BMKKQIPVDUBGNC-KWCYVHTRSA-N 1 1 344.371 2.674 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(c3ccon3)CC2)c1 ZINC000595828157 479021489 /nfs/dbraw/zinc/02/14/89/479021489.db2.gz JMZXCHXUTOBUBJ-UHFFFAOYSA-N 1 1 345.355 2.749 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000592751388 479025577 /nfs/dbraw/zinc/02/55/77/479025577.db2.gz ROSSWIDFTMAHKM-LBPRGKRZSA-N 1 1 346.387 2.630 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000592749445 479025780 /nfs/dbraw/zinc/02/57/80/479025780.db2.gz SREMHTZWGYOLSZ-ZDUSSCGKSA-N 1 1 330.388 2.963 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](C(=O)NC(C)C)C1 ZINC000595849321 479031980 /nfs/dbraw/zinc/03/19/80/479031980.db2.gz GKRPZTADLKDDFH-CQSZACIVSA-N 1 1 349.431 2.730 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NCc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000595870413 479042920 /nfs/dbraw/zinc/04/29/20/479042920.db2.gz BXTHBFIFKDTANI-UHFFFAOYSA-N 1 1 337.420 2.591 10 5 EFBEMO CCNc1ccc(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000598856180 479057665 /nfs/dbraw/zinc/05/76/65/479057665.db2.gz VHLFRCOOUCDZQT-ZDUSSCGKSA-N 1 1 334.420 2.629 10 5 EFBEMO C[C@@H]1C(=O)Nc2ccccc2C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000598949647 479097626 /nfs/dbraw/zinc/09/76/26/479097626.db2.gz LFPSNKZINBJAHV-CYBMUJFWSA-N 1 1 325.368 2.980 10 5 EFBEMO C[C@@H]1C(=O)Nc2ccccc2C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000598949647 479097630 /nfs/dbraw/zinc/09/76/30/479097630.db2.gz LFPSNKZINBJAHV-CYBMUJFWSA-N 1 1 325.368 2.980 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](CCCO)CC(C)(C)C)c1 ZINC000593010769 479122496 /nfs/dbraw/zinc/12/24/96/479122496.db2.gz LDNOHMCTBDFUMK-UHFFFAOYSA-N 1 1 338.404 2.612 10 5 EFBEMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000593014361 479125402 /nfs/dbraw/zinc/12/54/02/479125402.db2.gz JBWXRNWLESBRBF-JKSUJKDBSA-N 1 1 336.388 2.507 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](CCO)c2ccccc2)c1 ZINC000593019751 479128628 /nfs/dbraw/zinc/12/86/28/479128628.db2.gz JYSPOOZTVHIXEV-INIZCTEOSA-N 1 1 344.367 2.595 10 5 EFBEMO C[C@@H](CNc1ccc2cnccc2c1[N+](=O)[O-])C[NH+]1CCOCC1 ZINC000599047309 479137930 /nfs/dbraw/zinc/13/79/30/479137930.db2.gz SXDZVRMOWZAXHM-ZDUSSCGKSA-N 1 1 330.388 2.523 10 5 EFBEMO COC(=O)c1c(Cl)c(NC[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000596119248 479149774 /nfs/dbraw/zinc/14/97/74/479149774.db2.gz MFVWBZFUSXECKN-JTQLQIEISA-N 1 1 341.795 2.789 10 5 EFBEMO C[N@H+]1CCN(CCNc2ccc3cnccc3c2[N+](=O)[O-])CC1(C)C ZINC000599074068 479151328 /nfs/dbraw/zinc/15/13/28/479151328.db2.gz KEBFOKPQRHMICR-UHFFFAOYSA-N 1 1 343.431 2.581 10 5 EFBEMO COc1cc(NC[C@@H](C)C[NH+]2CCOCC2)c(Cl)cc1[N+](=O)[O-] ZINC000596135070 479157265 /nfs/dbraw/zinc/15/72/65/479157265.db2.gz QINMFVIQWJLYGE-LLVKDONJSA-N 1 1 343.811 2.637 10 5 EFBEMO C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C2(CCC2)CO1 ZINC000593090573 479167563 /nfs/dbraw/zinc/16/75/63/479167563.db2.gz ACBNEZDNKJCQCP-ZDUSSCGKSA-N 1 1 333.388 2.567 10 5 EFBEMO NC(=O)c1cccc([N+](=O)[O-])c1NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000599128313 479171796 /nfs/dbraw/zinc/17/17/96/479171796.db2.gz WKECZLONORQWFL-CYBMUJFWSA-N 1 1 332.404 2.513 10 5 EFBEMO CCN(C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000596167398 479175610 /nfs/dbraw/zinc/17/56/10/479175610.db2.gz GNZCWGJLDZNATR-CZUORRHYSA-N 1 1 334.420 2.782 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@@H]2CNc2ncc([N+](=O)[O-])cc2F)cc1 ZINC000599139936 479177409 /nfs/dbraw/zinc/17/74/09/479177409.db2.gz PITABBMLZSMJMJ-CYBMUJFWSA-N 1 1 346.362 2.824 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2ncc([N+](=O)[O-])cc2F)cc1 ZINC000599139936 479177414 /nfs/dbraw/zinc/17/74/14/479177414.db2.gz PITABBMLZSMJMJ-CYBMUJFWSA-N 1 1 346.362 2.824 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593115652 479183387 /nfs/dbraw/zinc/18/33/87/479183387.db2.gz CRNAQERQSARCKG-CQSZACIVSA-N 1 1 325.315 2.573 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593115652 479183389 /nfs/dbraw/zinc/18/33/89/479183389.db2.gz CRNAQERQSARCKG-CQSZACIVSA-N 1 1 325.315 2.573 10 5 EFBEMO O=[N+]([O-])c1ccc2c(ccnc2NC[C@H]2CC[N@H+]2C2CCCC2)c1 ZINC000599163558 479189620 /nfs/dbraw/zinc/18/96/20/479189620.db2.gz DJUXABYAHNQYQU-MRXNPFEDSA-N 1 1 326.400 2.994 10 5 EFBEMO COC(=O)c1c(Cl)c(NCC[N@H+]2CC=CCC2)ccc1[N+](=O)[O-] ZINC000596221381 479208182 /nfs/dbraw/zinc/20/81/82/479208182.db2.gz BRWLMPJRUIIEGV-UHFFFAOYSA-N 1 1 339.779 2.709 10 5 EFBEMO COC(=O)c1c(Cl)c(NCC[N@@H+]2CC=CCC2)ccc1[N+](=O)[O-] ZINC000596221381 479208187 /nfs/dbraw/zinc/20/81/87/479208187.db2.gz BRWLMPJRUIIEGV-UHFFFAOYSA-N 1 1 339.779 2.709 10 5 EFBEMO CC[C@H]1C[N@H+](C)CCN1c1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl ZINC000596247870 479222783 /nfs/dbraw/zinc/22/27/83/479222783.db2.gz SGYHEINUNONGAF-JTQLQIEISA-N 1 1 341.795 2.565 10 5 EFBEMO CC[C@H]1C[N@@H+](C)CCN1c1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl ZINC000596247870 479222785 /nfs/dbraw/zinc/22/27/85/479222785.db2.gz SGYHEINUNONGAF-JTQLQIEISA-N 1 1 341.795 2.565 10 5 EFBEMO COC(=O)c1cnc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000599270226 479228439 /nfs/dbraw/zinc/22/84/39/479228439.db2.gz CYYCMOFFLXUAJX-UHFFFAOYSA-N 1 1 344.371 2.582 10 5 EFBEMO COC(=O)c1cnc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000599270226 479228446 /nfs/dbraw/zinc/22/84/46/479228446.db2.gz CYYCMOFFLXUAJX-UHFFFAOYSA-N 1 1 344.371 2.582 10 5 EFBEMO C[C@@H]1[C@H](C)N(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)[C@@H](C)C[N@H+]1C ZINC000593188851 479231089 /nfs/dbraw/zinc/23/10/89/479231089.db2.gz CYXYWDNJDXPAAN-XQQFMLRXSA-N 1 1 344.415 2.558 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NCCC[N@@H+](C)CC(C)C ZINC000593204502 479239194 /nfs/dbraw/zinc/23/91/94/479239194.db2.gz XUFXAABIBKAMTI-UHFFFAOYSA-N 1 1 337.420 2.701 10 5 EFBEMO O=[N+]([O-])c1ccccc1NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000596422885 479289483 /nfs/dbraw/zinc/28/94/83/479289483.db2.gz JDWCHWXSROJZLO-MRXNPFEDSA-N 1 1 327.384 2.774 10 5 EFBEMO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCCN2Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000593324047 479296222 /nfs/dbraw/zinc/29/62/22/479296222.db2.gz XLRMKDUJDAJVHI-XYPHTWIQSA-N 1 1 337.395 2.595 10 5 EFBEMO CC[C@H](NC(=O)N(CC)[C@H]1CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000596456928 479302445 /nfs/dbraw/zinc/30/24/45/479302445.db2.gz UZOKCRWXMFILQW-HOTGVXAUSA-N 1 1 334.420 2.782 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](C(F)F)C1 ZINC000611180117 479304447 /nfs/dbraw/zinc/30/44/47/479304447.db2.gz SCLNYONJYFNBFT-NSHDSACASA-N 1 1 327.331 2.819 10 5 EFBEMO COc1ccc(OCC[NH+]2CC3(C2)CC(F)(F)C3)c([N+](=O)[O-])c1 ZINC000611180351 479305374 /nfs/dbraw/zinc/30/53/74/479305374.db2.gz FIMCEAQJXGZNTF-UHFFFAOYSA-N 1 1 328.315 2.713 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000596517459 479325561 /nfs/dbraw/zinc/32/55/61/479325561.db2.gz IYQIBAGQDXJHBL-UHFFFAOYSA-N 1 1 336.436 2.557 10 5 EFBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599552926 479331388 /nfs/dbraw/zinc/33/13/88/479331388.db2.gz KTERIODNSZQNMK-XQQFMLRXSA-N 1 1 335.429 2.892 10 5 EFBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599552926 479331393 /nfs/dbraw/zinc/33/13/93/479331393.db2.gz KTERIODNSZQNMK-XQQFMLRXSA-N 1 1 335.429 2.892 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@]3(CCCOC3)C1)OCCO2 ZINC000611273869 479334298 /nfs/dbraw/zinc/33/42/98/479334298.db2.gz UUIJWQHEFDNWFI-SFHVURJKSA-N 1 1 348.399 2.759 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593460010 479351091 /nfs/dbraw/zinc/35/10/91/479351091.db2.gz YXNHTFMDVQFVIS-BETUJISGSA-N 1 1 337.395 2.656 10 5 EFBEMO COc1cc(C[N@@H+]2Cc3c[nH]nc3CC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000596597609 479354214 /nfs/dbraw/zinc/35/42/14/479354214.db2.gz UTYPDNAWRMJHHF-UHFFFAOYSA-N 1 1 330.388 2.911 10 5 EFBEMO COc1cc(C[N@H+]2Cc3c[nH]nc3CC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000596597609 479354221 /nfs/dbraw/zinc/35/42/21/479354221.db2.gz UTYPDNAWRMJHHF-UHFFFAOYSA-N 1 1 330.388 2.911 10 5 EFBEMO CC[N@@H+](CCCNc1ncc([N+](=O)[O-])cc1C(N)=O)C1CCCCC1 ZINC000593488514 479363341 /nfs/dbraw/zinc/36/33/41/479363341.db2.gz KLIKEYPKTPXMBP-UHFFFAOYSA-N 1 1 349.435 2.545 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@@H]21 ZINC000599649565 479368327 /nfs/dbraw/zinc/36/83/27/479368327.db2.gz BNPKKYOHNYLFAW-ZACQAIPSSA-N 1 1 332.400 2.801 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@H]2CCC[C@@H]21 ZINC000599661164 479377474 /nfs/dbraw/zinc/37/74/74/479377474.db2.gz SKWYYFYTBXWVPY-KFWWJZLASA-N 1 1 348.399 2.767 10 5 EFBEMO C[C@H](CNc1cc(N)c([N+](=O)[O-])c(CO)c1)[N@@H+](C)Cc1ccccc1 ZINC000587974959 479377689 /nfs/dbraw/zinc/37/76/89/479377689.db2.gz FJNMVICFWHDFRE-CYBMUJFWSA-N 1 1 344.415 2.602 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000599663473 479378116 /nfs/dbraw/zinc/37/81/16/479378116.db2.gz ZXLCPIFJLGTLEK-ZNMIVQPWSA-N 1 1 348.399 2.637 10 5 EFBEMO Nc1cc(NC[C@@H]2CCC[N@H+]2C2CCCCC2)cc(CO)c1[N+](=O)[O-] ZINC000588039372 479386225 /nfs/dbraw/zinc/38/62/25/479386225.db2.gz RWXRYULLRDVDOG-INIZCTEOSA-N 1 1 348.447 2.878 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@H](c3ccncn3)C2)ccc1[N+](=O)[O-] ZINC000611515336 479403318 /nfs/dbraw/zinc/40/33/18/479403318.db2.gz 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ZINC000764466771 576461146 /nfs/dbraw/zinc/46/11/46/576461146.db2.gz QTAZDZDUAPMSCM-SMDDNHRTSA-N 1 1 337.807 2.739 10 5 EFBEMO CC[N@H+]1CC[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000770008097 577397447 /nfs/dbraw/zinc/39/74/47/577397447.db2.gz JCYKANIFAGJRIY-SNVBAGLBSA-N 1 1 326.784 2.712 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@]3(CCCOC3)C2)c([N+](=O)[O-])c1 ZINC000774903413 581503695 /nfs/dbraw/zinc/50/36/95/581503695.db2.gz NCWJHNPEVPOCKV-MRXNPFEDSA-N 1 1 335.360 2.896 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@]3(CCCOC3)C2)c([N+](=O)[O-])c1 ZINC000774903410 581503713 /nfs/dbraw/zinc/50/37/13/581503713.db2.gz NCWJHNPEVPOCKV-INIZCTEOSA-N 1 1 335.360 2.896 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)c([N+](=O)[O-])c1 ZINC000774910509 581503933 /nfs/dbraw/zinc/50/39/33/581503933.db2.gz CFIMNSORQZUTMM-JSGCOSHPSA-N 1 1 335.360 2.752 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])c1 ZINC000774910511 581503977 /nfs/dbraw/zinc/50/39/77/581503977.db2.gz CFIMNSORQZUTMM-TZMCWYRMSA-N 1 1 335.360 2.752 10 5 EFBEMO [NH3+]C[C@@H]1CC2(CO1)CCN(Cc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC000923450875 1261688176 /nfs/dbraw/zinc/68/81/76/1261688176.db2.gz XUODNUDNXUDLQR-AWEZNQCLSA-N 1 1 339.823 2.578 10 5 EFBEMO C[C@H]1CN(Cc2cc([N+](=O)[O-])ccc2Br)CC[C@H]1C[NH3+] ZINC000923494414 1261779534 /nfs/dbraw/zinc/77/95/34/1261779534.db2.gz WYRJFBOKXSIWFZ-QWRGUYRKSA-N 1 1 342.237 2.774 10 5 EFBEMO COc1cc(C[NH2+][C@H]2CCCc3cccnc32)c([N+](=O)[O-])cc1O ZINC000922881342 1267076712 /nfs/dbraw/zinc/07/67/12/1267076712.db2.gz NOGLNDJGSSFXQG-ZDUSSCGKSA-N 1 1 329.356 2.871 10 5 EFBEMO COC(=O)/C=C\c1ccc(NCC[N@H+]2CCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000742427924 1270048407 /nfs/dbraw/zinc/04/84/07/1270048407.db2.gz UJCPFOBMKPJSFQ-FWPCIQOSSA-N 1 1 333.388 2.677 10 5 EFBEMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000744161075 1270912398 /nfs/dbraw/zinc/91/23/98/1270912398.db2.gz WULRCGKNQXXSHW-DOOHLRMFSA-N 1 1 343.383 2.971 10 5 EFBEMO C[N@H+](CCc1nc(-c2ccccc2)no1)Cc1cccnc1[N+](=O)[O-] ZINC001170217603 1278892577 /nfs/dbraw/zinc/89/25/77/1278892577.db2.gz QWTPJXSHJYMBKX-UHFFFAOYSA-N 1 1 339.355 2.714 10 5 EFBEMO C[N@@H+](CCc1nc(-c2ccccc2)no1)Cc1cccnc1[N+](=O)[O-] ZINC001170217603 1278892582 /nfs/dbraw/zinc/89/25/82/1278892582.db2.gz QWTPJXSHJYMBKX-UHFFFAOYSA-N 1 1 339.355 2.714 10 5 EFBEMO Cc1nc(F)ccc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000787179646 1275706832 /nfs/dbraw/zinc/70/68/32/1275706832.db2.gz ZRNSGFRDXIWNTO-ZDUSSCGKSA-N 1 1 331.351 2.519 10 5 EFBEMO Cc1nc(F)ccc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000787179646 1275706837 /nfs/dbraw/zinc/70/68/37/1275706837.db2.gz ZRNSGFRDXIWNTO-ZDUSSCGKSA-N 1 1 331.351 2.519 10 5 EFBEMO C/C(=C/C(=O)N1CC[C@]2(C1)CCC[N@H+](C)C2)c1ccc([N+](=O)[O-])cc1 ZINC000818178950 1276478996 /nfs/dbraw/zinc/47/89/96/1276478996.db2.gz VSMWYYPOLAQPSI-LJQBUTKESA-N 1 1 343.427 2.942 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]2C[N@H+](C)C[C@H]21 ZINC000819718008 1276890258 /nfs/dbraw/zinc/89/02/58/1276890258.db2.gz BKQXLIISHHMEAO-UJDGICINSA-N 1 1 329.400 2.551 10 5 EFBEMO CC(C)[N@H+]1CC[C@@H](CNC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001136430834 1277511606 /nfs/dbraw/zinc/51/16/06/1277511606.db2.gz IFTCHKHRMFMSPS-ZDUSSCGKSA-N 1 1 339.823 2.637 10 5 EFBEMO C[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccns1 ZINC001175113208 1287314099 /nfs/dbraw/zinc/31/40/99/1287314099.db2.gz YKRCKOVBVOTAFG-MRVPVSSYSA-N 1 1 340.792 2.994 10 5 EFBEMO C/C(=C/C(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000844642733 1279164135 /nfs/dbraw/zinc/16/41/35/1279164135.db2.gz KNLSWDBDEPQKED-WERPAELLSA-N 1 1 331.416 2.938 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCC[C@@]4(CC4(F)F)C3)n2)c1 ZINC000844748405 1279217090 /nfs/dbraw/zinc/21/70/90/1279217090.db2.gz SEKTVCGPIMDEKV-OAHLLOKOSA-N 1 1 349.341 2.932 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@@]4(CC4(F)F)C3)n2)c1 ZINC000844748405 1279217097 /nfs/dbraw/zinc/21/70/97/1279217097.db2.gz SEKTVCGPIMDEKV-OAHLLOKOSA-N 1 1 349.341 2.932 10 5 EFBEMO C[C@]12CC[N@H+](Cn3cnc(-c4cccc([N+](=O)[O-])c4)n3)C[C@H]1C2(F)F ZINC000793544497 1279739669 /nfs/dbraw/zinc/73/96/69/1279739669.db2.gz LJQIPVBSCXQHHE-HIFRSBDPSA-N 1 1 349.341 2.788 10 5 EFBEMO C[C@]12CC[N@@H+](Cn3cnc(-c4cccc([N+](=O)[O-])c4)n3)C[C@H]1C2(F)F ZINC000793544497 1279739676 /nfs/dbraw/zinc/73/96/76/1279739676.db2.gz LJQIPVBSCXQHHE-HIFRSBDPSA-N 1 1 349.341 2.788 10 5 EFBEMO C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001175301177 1287370492 /nfs/dbraw/zinc/37/04/92/1287370492.db2.gz OAHLIGBHKFXACP-JNIYBQFBSA-N 1 1 332.360 2.546 10 5 EFBEMO COC[C@H](C)C[N@@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000793613355 1279774251 /nfs/dbraw/zinc/77/42/51/1279774251.db2.gz MBDUXDZIPOMMCV-SNVBAGLBSA-N 1 1 343.221 2.998 10 5 EFBEMO COC[C@H](C)C[N@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000793613355 1279774257 /nfs/dbraw/zinc/77/42/57/1279774257.db2.gz MBDUXDZIPOMMCV-SNVBAGLBSA-N 1 1 343.221 2.998 10 5 EFBEMO C[C@H](NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872019581 1287401348 /nfs/dbraw/zinc/40/13/48/1287401348.db2.gz WXIQZYRMUUQPPB-MJBXVCDLSA-N 1 1 339.411 2.884 10 5 EFBEMO C[C@H]([NH2+]C[C@@]1(N(C)C)CCSC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872039483 1287408378 /nfs/dbraw/zinc/40/83/78/1287408378.db2.gz FXCVOCUAFAKCLA-NHYWBVRUSA-N 1 1 327.425 2.822 10 5 EFBEMO CCO[C@@H](CC[NH+](C)C)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872041667 1287409369 /nfs/dbraw/zinc/40/93/69/1287409369.db2.gz JRBJBPQIXUEEPF-OLZOCXBDSA-N 1 1 327.400 2.741 10 5 EFBEMO C[C@H]([NH2+][C@@H](CO)C[C@@H](O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052499 1287413346 /nfs/dbraw/zinc/41/33/46/1287413346.db2.gz SNUBTJLOIBBWMU-DXCKQFNASA-N 1 1 348.374 2.869 10 5 EFBEMO CCOC(=O)N1CC[C@H]([NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872064355 1287417237 /nfs/dbraw/zinc/41/72/37/1287417237.db2.gz YCYADNODMIPSMZ-MNOVXSKESA-N 1 1 325.340 2.615 10 5 EFBEMO CCOC(=O)N1CC[C@@H]([NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872064352 1287417988 /nfs/dbraw/zinc/41/79/88/1287417988.db2.gz YCYADNODMIPSMZ-GHMZBOCLSA-N 1 1 325.340 2.615 10 5 EFBEMO C[C@@H]([NH2+]CC1(S(C)(=O)=O)CCCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872069966 1287419928 /nfs/dbraw/zinc/41/99/28/1287419928.db2.gz AQYUBSBZCBGAQC-LLVKDONJSA-N 1 1 344.408 2.742 10 5 EFBEMO CCC[C@@H](C)C(=O)NCC[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872073521 1287420826 /nfs/dbraw/zinc/42/08/26/1287420826.db2.gz QHSQALIFBWHXRS-VXGBXAGGSA-N 1 1 325.384 2.937 10 5 EFBEMO C[C@H]([NH2+]C1CCN([C@H]2CCOC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872088404 1287425181 /nfs/dbraw/zinc/42/51/81/1287425181.db2.gz NYAWAZARDQZODC-JSGCOSHPSA-N 1 1 337.395 2.638 10 5 EFBEMO CC[N@H+]1C[C@@H](C)N(C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC001137931382 1280979483 /nfs/dbraw/zinc/97/94/83/1280979483.db2.gz PBWHLCOIMJWNJL-NWDGAFQWSA-N 1 1 339.823 2.732 10 5 EFBEMO CN1CCCC[C@@H]([N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1=O ZINC000872265258 1287509223 /nfs/dbraw/zinc/50/92/23/1287509223.db2.gz MTKKFWTXCGSHLF-CYBMUJFWSA-N 1 1 325.796 2.691 10 5 EFBEMO CN1CCCC[C@@H]([N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1=O ZINC000872265258 1287509230 /nfs/dbraw/zinc/50/92/30/1287509230.db2.gz MTKKFWTXCGSHLF-CYBMUJFWSA-N 1 1 325.796 2.691 10 5 EFBEMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H](C3CC3)C2)nc1-c1ccncc1 ZINC000808229447 1281598529 /nfs/dbraw/zinc/59/85/29/1281598529.db2.gz BBQSQIDBGPKKFF-OAHLLOKOSA-N 1 1 327.388 2.933 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC001148630424 1281697913 /nfs/dbraw/zinc/69/79/13/1281697913.db2.gz LFMVKWLJCAUEKW-UHFFFAOYSA-N 1 1 342.827 2.681 10 5 EFBEMO [NH3+]CCN(Cc1cnc(-c2ccccc2)[nH]1)c1ccc([N+](=O)[O-])cc1 ZINC000809734423 1282413369 /nfs/dbraw/zinc/41/33/69/1282413369.db2.gz GLHWDLLLNVVKCA-UHFFFAOYSA-N 1 1 337.383 2.950 10 5 EFBEMO C[C@@H]1OCC[C@H]1[N@H+](CCO)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809997926 1282733538 /nfs/dbraw/zinc/73/35/38/1282733538.db2.gz IZKJEYYXCDKPSE-TVQRCGJNSA-N 1 1 349.214 2.873 10 5 EFBEMO C[C@@H]1OCC[C@H]1[N@@H+](CCO)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809997926 1282733549 /nfs/dbraw/zinc/73/35/49/1282733549.db2.gz IZKJEYYXCDKPSE-TVQRCGJNSA-N 1 1 349.214 2.873 10 5 EFBEMO Cc1c(CNC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000810701424 1283538096 /nfs/dbraw/zinc/53/80/96/1283538096.db2.gz RCEXVORSZIMLTB-KRWDZBQOSA-N 1 1 337.395 2.732 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000812842271 1285468957 /nfs/dbraw/zinc/46/89/57/1285468957.db2.gz SFAZDOXHDGHZAJ-KRWDZBQOSA-N 1 1 335.379 2.696 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000812842272 1285469034 /nfs/dbraw/zinc/46/90/34/1285469034.db2.gz SFAZDOXHDGHZAJ-QGZVFWFLSA-N 1 1 335.379 2.696 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000747831288 1285579205 /nfs/dbraw/zinc/57/92/05/1285579205.db2.gz LVICILGUUVPLQV-HUUCEWRRSA-N 1 1 344.415 2.959 10 5 EFBEMO C[C@H](C(=O)OC[C@H](C)[N+](=O)[O-])[NH+]1CCC(Cc2ccccc2)CC1 ZINC000813101908 1285651911 /nfs/dbraw/zinc/65/19/11/1285651911.db2.gz LFMNCEAHHNWJQY-LSDHHAIUSA-N 1 1 334.416 2.538 10 5 EFBEMO CCO[C@H](CC)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173901 1285703723 /nfs/dbraw/zinc/70/37/23/1285703723.db2.gz LTYFQZQKKGCTPN-JKSUJKDBSA-N 1 1 336.388 2.527 10 5 EFBEMO CCO[C@H](CC)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173901 1285703729 /nfs/dbraw/zinc/70/37/29/1285703729.db2.gz LTYFQZQKKGCTPN-JKSUJKDBSA-N 1 1 336.388 2.527 10 5 EFBEMO CSCCCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173982 1285703990 /nfs/dbraw/zinc/70/39/90/1285703990.db2.gz NLEQQDXXLVXETG-HNNXBMFYSA-N 1 1 338.429 2.856 10 5 EFBEMO CSCCCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173982 1285703998 /nfs/dbraw/zinc/70/39/98/1285703998.db2.gz NLEQQDXXLVXETG-HNNXBMFYSA-N 1 1 338.429 2.856 10 5 EFBEMO CC[C@@H]1CC[C@@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)O1 ZINC000813173887 1285704014 /nfs/dbraw/zinc/70/40/14/1285704014.db2.gz LXPULRQPRRKYED-IKGGRYGDSA-N 1 1 348.399 2.670 10 5 EFBEMO CC[C@@H]1CC[C@@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)O1 ZINC000813173887 1285704026 /nfs/dbraw/zinc/70/40/26/1285704026.db2.gz LXPULRQPRRKYED-IKGGRYGDSA-N 1 1 348.399 2.670 10 5 EFBEMO O=C(CC[C@H]1CCCO1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173490 1285704749 /nfs/dbraw/zinc/70/47/49/1285704749.db2.gz COXHMVIABJJWNK-SJORKVTESA-N 1 1 348.399 2.672 10 5 EFBEMO O=C(CC[C@H]1CCCO1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173490 1285704755 /nfs/dbraw/zinc/70/47/55/1285704755.db2.gz COXHMVIABJJWNK-SJORKVTESA-N 1 1 348.399 2.672 10 5 EFBEMO COc1cc(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)cc([N+](=O)[O-])c1C ZINC001134280498 1286527484 /nfs/dbraw/zinc/52/74/84/1286527484.db2.gz ZKCZFOOPNUEBOH-OAHLLOKOSA-N 1 1 349.431 2.714 10 5 EFBEMO COc1cc(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)cc([N+](=O)[O-])c1C ZINC001134280498 1286527487 /nfs/dbraw/zinc/52/74/87/1286527487.db2.gz ZKCZFOOPNUEBOH-OAHLLOKOSA-N 1 1 349.431 2.714 10 5 EFBEMO O=C(CC[N@H+]1CCCC[C@@H]1[C@H]1CCCO1)Nc1ccccc1[N+](=O)[O-] ZINC001176927495 1288176939 /nfs/dbraw/zinc/17/69/39/1288176939.db2.gz SLENAVGMHCNJHN-IAGOWNOFSA-N 1 1 347.415 2.957 10 5 EFBEMO Cc1cccnc1[C@H](C)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001176899214 1288183442 /nfs/dbraw/zinc/18/34/42/1288183442.db2.gz WUSJCCWXHPPDSY-ZDUSSCGKSA-N 1 1 328.372 2.896 10 5 EFBEMO C[C@H]1CC[N@@H+](CC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000816845587 1288301387 /nfs/dbraw/zinc/30/13/87/1288301387.db2.gz WETWGSODYYCHCK-NSHDSACASA-N 1 1 325.796 2.548 10 5 EFBEMO C[C@H]1CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC001136772418 1289425205 /nfs/dbraw/zinc/42/52/05/1289425205.db2.gz BEEJLBVQCGRMAS-JTQLQIEISA-N 1 1 343.836 2.503 10 5 EFBEMO C[C@H]1CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC001136772418 1289425207 /nfs/dbraw/zinc/42/52/07/1289425207.db2.gz BEEJLBVQCGRMAS-JTQLQIEISA-N 1 1 343.836 2.503 10 5 EFBEMO C[C@H](OC(=O)CCCC[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000803513219 1312739935 /nfs/dbraw/zinc/73/99/35/1312739935.db2.gz VVFLRFXZZGIZHV-AWEZNQCLSA-N 1 1 336.388 2.702 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(NCC[N@H+]2CCC[C@@H]2C)cc1C ZINC001185565914 1290712444 /nfs/dbraw/zinc/71/24/44/1290712444.db2.gz WMNMTEWYIAYJDV-ZDUSSCGKSA-N 1 1 335.404 2.976 10 5 EFBEMO CCC[C@]1(CO)CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001194781677 1293708283 /nfs/dbraw/zinc/70/82/83/1293708283.db2.gz HHVVCBSDZRUOLG-KRWDZBQOSA-N 1 1 346.387 2.629 10 5 EFBEMO CCC[C@]1(CO)CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001194781677 1293708287 /nfs/dbraw/zinc/70/82/87/1293708287.db2.gz HHVVCBSDZRUOLG-KRWDZBQOSA-N 1 1 346.387 2.629 10 5 EFBEMO C[C@](CO)([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC001196907694 1294410961 /nfs/dbraw/zinc/41/09/61/1294410961.db2.gz MQLWKUHVZOMNME-MRXNPFEDSA-N 1 1 349.318 2.639 10 5 EFBEMO C[C@@](CO)([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC001196907692 1294411009 /nfs/dbraw/zinc/41/10/09/1294411009.db2.gz MQLWKUHVZOMNME-INIZCTEOSA-N 1 1 349.318 2.639 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(O)(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC001198675987 1295196481 /nfs/dbraw/zinc/19/64/81/1295196481.db2.gz BYCVATHPIYSMHS-CQSZACIVSA-N 1 1 349.431 2.713 10 5 EFBEMO CC(C)(C)n1cncc1[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1 ZINC001198789909 1295231140 /nfs/dbraw/zinc/23/11/40/1295231140.db2.gz APCDBTQBBDGNNA-CQSZACIVSA-N 1 1 346.435 2.622 10 5 EFBEMO COc1ccc(OCC[N@H+]2CCCC[C@@]23CCOC3)c([N+](=O)[O-])c1 ZINC001198761844 1295239631 /nfs/dbraw/zinc/23/96/31/1295239631.db2.gz RLTRHUKZADNJRX-KRWDZBQOSA-N 1 1 336.388 2.627 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1ccn(C)c1)Cc1ccccc1[N+](=O)[O-] ZINC001490323798 1298768456 /nfs/dbraw/zinc/76/84/56/1298768456.db2.gz OAERWBLVYRXUGG-UHFFFAOYSA-N 1 1 344.415 2.575 10 5 EFBEMO C[C@]12COC[C@@H]1C[N@@H+](Cc1cccc([N+](=O)[O-])c1Br)C2 ZINC000852535554 1299743531 /nfs/dbraw/zinc/74/35/31/1299743531.db2.gz FLCAHAMHTVJKAR-FZMZJTMJSA-N 1 1 341.205 2.826 10 5 EFBEMO C[C@]12COC[C@@H]1C[N@H+](Cc1cccc([N+](=O)[O-])c1Br)C2 ZINC000852535554 1299743528 /nfs/dbraw/zinc/74/35/28/1299743528.db2.gz FLCAHAMHTVJKAR-FZMZJTMJSA-N 1 1 341.205 2.826 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c1 ZINC000852759663 1299871138 /nfs/dbraw/zinc/87/11/38/1299871138.db2.gz SAIMASOBJVKQMM-KURKYZTESA-N 1 1 332.400 2.521 10 5 EFBEMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC000853587881 1300180721 /nfs/dbraw/zinc/18/07/21/1300180721.db2.gz BBRAKIMKOKZALH-ZDUSSCGKSA-N 1 1 331.372 2.972 10 5 EFBEMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@H](C2CCC2)C1 ZINC000853587881 1300180728 /nfs/dbraw/zinc/18/07/28/1300180728.db2.gz BBRAKIMKOKZALH-ZDUSSCGKSA-N 1 1 331.372 2.972 10 5 EFBEMO O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[N@@H+](CCC1CC1)CC1CC1 ZINC000853604470 1300189507 /nfs/dbraw/zinc/18/95/07/1300189507.db2.gz ALTRGHCVYGDCHS-UHFFFAOYSA-N 1 1 343.383 2.660 10 5 EFBEMO CCC[N@H+]1CC[C@H](Nc2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])C1 ZINC000853906713 1300333108 /nfs/dbraw/zinc/33/31/08/1300333108.db2.gz ORLYGSKOOSQMGP-VSKVDJIOSA-N 1 1 333.388 2.677 10 5 EFBEMO Nc1ccc(NC(=O)CC[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000854497222 1300592775 /nfs/dbraw/zinc/59/27/75/1300592775.db2.gz KVFQPQZTKZCMLK-UHFFFAOYSA-N 1 1 340.383 2.564 10 5 EFBEMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860010671 1301673843 /nfs/dbraw/zinc/67/38/43/1301673843.db2.gz GUENBNGMTAAALA-SGTLLEGYSA-N 1 1 339.395 2.961 10 5 EFBEMO O=C(NCC[N@@H+]1CC=CCC1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000861455803 1302136456 /nfs/dbraw/zinc/13/64/56/1302136456.db2.gz ULKRDMPGQYJZBL-UHFFFAOYSA-N 1 1 325.368 2.740 10 5 EFBEMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000863033174 1302528470 /nfs/dbraw/zinc/52/84/70/1302528470.db2.gz SUNAYUHEKXTSQV-CYBMUJFWSA-N 1 1 335.379 2.789 10 5 EFBEMO Cc1nn(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)c2ncc([N+](=O)[O-])cc12 ZINC000794653876 1302905216 /nfs/dbraw/zinc/90/52/16/1302905216.db2.gz BFAXOTMTNNPQQH-SKDRFNHKSA-N 1 1 343.309 2.878 10 5 EFBEMO Cc1nn(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)c2ncc([N+](=O)[O-])cc12 ZINC000794653876 1302905228 /nfs/dbraw/zinc/90/52/28/1302905228.db2.gz BFAXOTMTNNPQQH-SKDRFNHKSA-N 1 1 343.309 2.878 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3ccc([N+](=O)[O-])cc3Br)CC[C@@H]21 ZINC000866207074 1303562678 /nfs/dbraw/zinc/56/26/78/1303562678.db2.gz UZKRXVWGBGYNRP-GWCFXTLKSA-N 1 1 340.221 2.888 10 5 EFBEMO Cc1cc(N2CC[C@H]3[C@H](CC[N@@H+]3C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000866209787 1303564126 /nfs/dbraw/zinc/56/41/26/1303564126.db2.gz WBCMGMYBPCIILH-HIFRSBDPSA-N 1 1 326.400 2.982 10 5 EFBEMO Cc1cc(N2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000866209785 1303564289 /nfs/dbraw/zinc/56/42/89/1303564289.db2.gz WBCMGMYBPCIILH-DZGCQCFKSA-N 1 1 326.400 2.982 10 5 EFBEMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@H]2[C@H](CC[N@H+]2C)C1 ZINC000866209568 1303564395 /nfs/dbraw/zinc/56/43/95/1303564395.db2.gz UBWAWXHKRVUOJH-WBMJQRKESA-N 1 1 342.399 2.682 10 5 EFBEMO CC(C)(O)C[N@@H+]1CC[C@H](N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000866413234 1303629092 /nfs/dbraw/zinc/62/90/92/1303629092.db2.gz QKDIZNOMETZNDH-SUMWQHHRSA-N 1 1 347.459 2.752 10 5 EFBEMO CC(C)(O)C[N@H+]1CC[C@H](N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000866413234 1303629097 /nfs/dbraw/zinc/62/90/97/1303629097.db2.gz QKDIZNOMETZNDH-SUMWQHHRSA-N 1 1 347.459 2.752 10 5 EFBEMO C[C@]([NH3+])(C(=O)N(CCC1CC1)CC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000867987549 1304061344 /nfs/dbraw/zinc/06/13/44/1304061344.db2.gz NGUPPDXBBIFUKH-GOSISDBHSA-N 1 1 331.416 2.807 10 5 EFBEMO C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CCC1(C)C ZINC000871153811 1305843428 /nfs/dbraw/zinc/84/34/28/1305843428.db2.gz MIFWSABHZPEVOT-UHFFFAOYSA-N 1 1 339.823 2.733 10 5 EFBEMO C/C(=C\C(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000752388328 1311154421 /nfs/dbraw/zinc/15/44/21/1311154421.db2.gz FSORGPCSDDZIOD-ATGUSINASA-N 1 1 331.416 2.798 10 5 EFBEMO C/C(=C\C(=O)OC[C@@H]1C[N@@H+](C(C)C)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC000802135622 1311381881 /nfs/dbraw/zinc/38/18/81/1311381881.db2.gz ZSUJNANCMBXFAH-SHRNQRGKSA-N 1 1 348.399 2.651 10 5 EFBEMO O=C(NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)C1(F)CCCC1 ZINC001277101276 1311616558 /nfs/dbraw/zinc/61/65/58/1311616558.db2.gz AHQZIBYIIIUEOA-UHFFFAOYSA-N 1 1 341.408 2.677 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]([N@@H+](C)CC)C1 ZINC001160160866 1311657090 /nfs/dbraw/zinc/65/70/90/1311657090.db2.gz SDYQUZYAMGLPDD-NVXWUHKLSA-N 1 1 333.432 2.716 10 5 EFBEMO Cn1cc([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)n1 ZINC001162597742 1312132611 /nfs/dbraw/zinc/13/26/11/1312132611.db2.gz KDDFIVSYARHARD-RISCZKNCSA-N 1 1 335.433 2.885 10 5 EFBEMO CN(C[C@@H]1CCC[N@H+]1C)c1cccc(Br)c1[N+](=O)[O-] ZINC001163545856 1312334103 /nfs/dbraw/zinc/33/41/03/1312334103.db2.gz UROSURIFKOBPKB-JTQLQIEISA-N 1 1 328.210 2.888 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@H](C(C)(C)C)C1 ZINC001163930253 1312409367 /nfs/dbraw/zinc/40/93/67/1312409367.db2.gz PZGGTJSTLJQKMJ-HNNXBMFYSA-N 1 1 337.395 2.845 10 5 EFBEMO CC[C@@H](c1ccc(F)cc1)[NH+]1CCN(c2nn(C)cc2[N+](=O)[O-])CC1 ZINC001164068667 1312441061 /nfs/dbraw/zinc/44/10/61/1312441061.db2.gz WYWHQNHPKJBGBJ-HNNXBMFYSA-N 1 1 347.394 2.741 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC001261260144 1316399498 /nfs/dbraw/zinc/39/94/98/1316399498.db2.gz DNGNHUWJURMFQX-HOCLYGCPSA-N 1 1 337.395 2.523 10 5 EFBEMO Cc1cc(C(=O)NCCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])ccn1 ZINC001265049509 1316701714 /nfs/dbraw/zinc/70/17/14/1316701714.db2.gz LYMGUKXQDIZKDI-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO C[N@@H+](CCCNC(=O)C1CC(F)(F)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001265825288 1316885286 /nfs/dbraw/zinc/88/52/86/1316885286.db2.gz YIYGAWLIDXJRDF-UHFFFAOYSA-N 1 1 341.358 2.578 10 5 EFBEMO Cc1cc(C(=O)NCCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)co1 ZINC001265831587 1316887091 /nfs/dbraw/zinc/88/70/91/1316887091.db2.gz LANVUIHVJNORGD-UHFFFAOYSA-N 1 1 331.372 2.748 10 5 EFBEMO Cc1cocc1C(=O)NCCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001265904963 1316909130 /nfs/dbraw/zinc/90/91/30/1316909130.db2.gz VCOVYLCMHVVWDB-UHFFFAOYSA-N 1 1 331.372 2.748 10 5 EFBEMO Cc1coc(C(=O)NCCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC001265908135 1316909579 /nfs/dbraw/zinc/90/95/79/1316909579.db2.gz LYYKNLFSVKGUFA-UHFFFAOYSA-N 1 1 331.372 2.748 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1cccnc1)Cc1cccc([N+](=O)[O-])c1 ZINC001266014956 1316953673 /nfs/dbraw/zinc/95/36/73/1316953673.db2.gz OZUMIMWRVZUPDJ-UHFFFAOYSA-N 1 1 342.399 2.632 10 5 EFBEMO CCC1([NH2+]Cc2ccc(C)cc2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001281004427 1317960483 /nfs/dbraw/zinc/96/04/83/1317960483.db2.gz NXPGAHMUTSDUBP-IAGOWNOFSA-N 1 1 345.443 2.521 10 5 EFBEMO C/C=C(/C)C(=O)NCC1=CC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001284900450 1320586321 /nfs/dbraw/zinc/58/63/21/1320586321.db2.gz WPZUTPCRTJYBLV-BNNQUZSASA-N 1 1 329.400 2.809 10 5 EFBEMO C/C=C(/C)C(=O)NCC1=CC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001284900450 1320586323 /nfs/dbraw/zinc/58/63/23/1320586323.db2.gz WPZUTPCRTJYBLV-BNNQUZSASA-N 1 1 329.400 2.809 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC001289202937 1321802703 /nfs/dbraw/zinc/80/27/03/1321802703.db2.gz BWJFAQVGOQLUGG-OAHLLOKOSA-N 1 1 349.431 2.796 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC001289202937 1321802707 /nfs/dbraw/zinc/80/27/07/1321802707.db2.gz BWJFAQVGOQLUGG-OAHLLOKOSA-N 1 1 349.431 2.796 10 5 EFBEMO C[N@H+](CCNC(=O)c1occ2c1CCC2)Cc1cccc([N+](=O)[O-])c1 ZINC001492358669 1324450748 /nfs/dbraw/zinc/45/07/48/1324450748.db2.gz AWZMVFZBHDJGIJ-UHFFFAOYSA-N 1 1 343.383 2.538 10 5 EFBEMO C[N@@H+](CCNC(=O)c1occ2c1CCC2)Cc1cccc([N+](=O)[O-])c1 ZINC001492358669 1324450753 /nfs/dbraw/zinc/45/07/53/1324450753.db2.gz AWZMVFZBHDJGIJ-UHFFFAOYSA-N 1 1 343.383 2.538 10 5 EFBEMO O=C(CC[N@H+]1CC[C@H](F)C1)N1CCCCc2ccc([N+](=O)[O-])cc21 ZINC001301122408 1324524001 /nfs/dbraw/zinc/52/40/01/1324524001.db2.gz RDJKXQWVDXCQTJ-AWEZNQCLSA-N 1 1 335.379 2.698 10 5 EFBEMO C[N@@H+](CC(=O)Nc1nc(-c2ccc([N+](=O)[O-])cc2)c[nH]1)CC(C)(C)C ZINC001306866184 1324726992 /nfs/dbraw/zinc/72/69/92/1324726992.db2.gz VBXVIEQIPRWUOX-UHFFFAOYSA-N 1 1 345.403 2.901 10 5 EFBEMO O=[N+]([O-])c1c(NC[C@@H]2CCC[N@@H+]2CCCO)cccc1C(F)(F)F ZINC001307125649 1324743206 /nfs/dbraw/zinc/74/32/06/1324743206.db2.gz ONNKOTWHQKNEIM-NSHDSACASA-N 1 1 347.337 2.872 10 5 EFBEMO COc1ccc2ncc([N+](=O)[O-])c(N3CC[N@@H+](C)C(C)(C)C3)c2c1 ZINC001307154991 1324745846 /nfs/dbraw/zinc/74/58/46/1324745846.db2.gz HZXZNICXZUPLBG-UHFFFAOYSA-N 1 1 330.388 2.682 10 5 EFBEMO CCOC(=O)[C@@H]1C[C@H]1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001307781120 1324779821 /nfs/dbraw/zinc/77/98/21/1324779821.db2.gz VVDCMCQYDHTUGQ-YQQAZPJKSA-N 1 1 332.400 2.973 10 5 EFBEMO CC(C)C[C@H]1C[N@@H+](C)CCN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001308099353 1324792470 /nfs/dbraw/zinc/79/24/70/1324792470.db2.gz GBKZCCVEGUWNHU-HNNXBMFYSA-N 1 1 336.392 2.665 10 5 EFBEMO CC(C)C[C@@H]1C[N@@H+](C)CCN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001308098898 1324792977 /nfs/dbraw/zinc/79/29/77/1324792977.db2.gz AMOLBCGIVAAUPC-CQSZACIVSA-N 1 1 331.420 2.633 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1cccs1)Cc1ccc([N+](=O)[O-])cc1 ZINC001317473962 1324795353 /nfs/dbraw/zinc/79/53/53/1324795353.db2.gz BDPUENFWEMFYFE-UHFFFAOYSA-N 1 1 333.413 2.908 10 5 EFBEMO CCC[C@H]1CCC[N@@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC001308133310 1324795917 /nfs/dbraw/zinc/79/59/17/1324795917.db2.gz HBQJIVOIKJIYOF-ZDUSSCGKSA-N 1 1 326.418 2.633 10 5 EFBEMO CCC[C@H]1CCC[N@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC001308133310 1324795921 /nfs/dbraw/zinc/79/59/21/1324795921.db2.gz HBQJIVOIKJIYOF-ZDUSSCGKSA-N 1 1 326.418 2.633 10 5 EFBEMO Cc1cccnc1[C@@H](C)[NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001308152401 1324797228 /nfs/dbraw/zinc/79/72/28/1324797228.db2.gz AUSQRYDSHJAUAJ-CYBMUJFWSA-N 1 1 340.383 2.538 10 5 EFBEMO C[N@H+](CCCNC(=O)Cc1ccccc1)Cc1csc([N+](=O)[O-])c1 ZINC001316832084 1325192342 /nfs/dbraw/zinc/19/23/42/1325192342.db2.gz SFHAYMUGPJUZQA-UHFFFAOYSA-N 1 1 347.440 2.837 10 5 EFBEMO C[N@@H+](CCCNC(=O)Cc1ccccc1)Cc1csc([N+](=O)[O-])c1 ZINC001316832084 1325192348 /nfs/dbraw/zinc/19/23/48/1325192348.db2.gz SFHAYMUGPJUZQA-UHFFFAOYSA-N 1 1 347.440 2.837 10 5 EFBEMO CC(C)[N@@H+](CCCNC(=O)c1ccc[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC001317675897 1328271750 /nfs/dbraw/zinc/27/17/50/1328271750.db2.gz MUYWEWHKNSVCLZ-UHFFFAOYSA-N 1 1 344.415 2.953 10 5 EFBEMO CC(C(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1)=C1CCC1 ZINC001318119247 1328500813 /nfs/dbraw/zinc/50/08/13/1328500813.db2.gz PWABWEYKNVLTSW-UHFFFAOYSA-N 1 1 329.400 2.643 10 5 EFBEMO CC(C)C(C)(C)C(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001318126819 1328502064 /nfs/dbraw/zinc/50/20/64/1328502064.db2.gz LDBLGHRCULRIFG-UHFFFAOYSA-N 1 1 333.432 2.825 10 5 EFBEMO Cc1noc(C[NH2+][C@H]2CCN(C)[C@@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001328410768 1330590181 /nfs/dbraw/zinc/59/01/81/1330590181.db2.gz VHQOUELKTKIVMZ-XJKSGUPXSA-N 1 1 334.351 2.565 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]3CC[C@@H](O)[C@@H]32)c(Br)c1 ZINC001329371409 1330699030 /nfs/dbraw/zinc/69/90/30/1330699030.db2.gz HALDUIYYIVQOMK-CUOATXAZSA-N 1 1 341.205 2.703 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]3CC[C@@H](O)[C@@H]32)c(Br)c1 ZINC001329371409 1330699034 /nfs/dbraw/zinc/69/90/34/1330699034.db2.gz HALDUIYYIVQOMK-CUOATXAZSA-N 1 1 341.205 2.703 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@H]2CNc2ccc(N)cc2[N+](=O)[O-])cc1 ZINC001329760161 1330734233 /nfs/dbraw/zinc/73/42/33/1330734233.db2.gz UHCUOMULYBVKIT-HNNXBMFYSA-N 1 1 342.399 2.872 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@H]2CNc2nc(C)ccc2[N+](=O)[O-])cc1 ZINC001331313081 1330820742 /nfs/dbraw/zinc/82/07/42/1330820742.db2.gz RLEOLXWEYPYDKB-HNNXBMFYSA-N 1 1 342.399 2.993 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@H]2CNc2nc(C)ccc2[N+](=O)[O-])cc1 ZINC001331313081 1330820744 /nfs/dbraw/zinc/82/07/44/1330820744.db2.gz RLEOLXWEYPYDKB-HNNXBMFYSA-N 1 1 342.399 2.993 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)OC[C@H]1CC[N@H+]1C1CCOCC1 ZINC001344932688 1332496060 /nfs/dbraw/zinc/49/60/60/1332496060.db2.gz VLIQSRTXSDIJRX-OAHLLOKOSA-N 1 1 348.399 2.622 10 5 EFBEMO C[C@H](CNC(=O)[C@H]1CC[C@H]2C[C@@H](C)C[N@H+]2C1)c1ccccc1[N+](=O)[O-] ZINC001347446347 1332745917 /nfs/dbraw/zinc/74/59/17/1332745917.db2.gz ULLNKTHXCUVYLP-WCVJEAGWSA-N 1 1 345.443 2.935 10 5 EFBEMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21 ZINC001347718228 1332768639 /nfs/dbraw/zinc/76/86/39/1332768639.db2.gz YFPQUGGHMVZCKF-MELADBBJSA-N 1 1 332.404 2.673 10 5 EFBEMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C2CCCC2)[C@H](C)C1 ZINC001347813133 1332775078 /nfs/dbraw/zinc/77/50/78/1332775078.db2.gz FTAMRDSZFRLTNS-CYBMUJFWSA-N 1 1 346.431 2.725 10 5 EFBEMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@@H]12 ZINC001348127771 1332801981 /nfs/dbraw/zinc/80/19/81/1332801981.db2.gz RNQADTQCZODIPH-UAXWRAGISA-N 1 1 349.456 2.532 10 5 EFBEMO C[N@H+]1C[C@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])c4ccccc34)[C@H]2C1 ZINC001350245705 1333053091 /nfs/dbraw/zinc/05/30/91/1333053091.db2.gz KPKVQIVOZCZDOC-PXAZEXFGSA-N 1 1 340.383 2.916 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001350387645 1333072939 /nfs/dbraw/zinc/07/29/39/1333072939.db2.gz SPIWHLVGBJTWOT-MRXNPFEDSA-N 1 1 346.431 2.535 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC3(COC3)C2)c(Br)c1 ZINC001350395586 1333075098 /nfs/dbraw/zinc/07/50/98/1333075098.db2.gz ZPLYNKRVZNDVLL-UHFFFAOYSA-N 1 1 327.178 2.580 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCC3(COC3)C2)c(Br)c1 ZINC001350395586 1333075102 /nfs/dbraw/zinc/07/51/02/1333075102.db2.gz ZPLYNKRVZNDVLL-UHFFFAOYSA-N 1 1 327.178 2.580 10 5 EFBEMO CNc1ccc(C(=O)N2CC[N@@H+](C3CCCC3)[C@H](C)C2)cc1[N+](=O)[O-] ZINC001350603226 1333102324 /nfs/dbraw/zinc/10/23/24/1333102324.db2.gz PLEFFZCZDBAUBD-CYBMUJFWSA-N 1 1 346.431 2.725 10 5 EFBEMO C[C@@H]1C[C@H]2CC[C@@H](C(=O)N(C)CCc3ccccc3[N+](=O)[O-])C[N@H+]2C1 ZINC001352188953 1333419614 /nfs/dbraw/zinc/41/96/14/1333419614.db2.gz HSAPJTCNYNWJAI-DJIMGWMZSA-N 1 1 345.443 2.716 10 5 EFBEMO C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC[N@H+]1C1CCCC1 ZINC001352970304 1333837658 /nfs/dbraw/zinc/83/76/58/1333837658.db2.gz QFQWUVOHABHMPE-GFCCVEGCSA-N 1 1 335.379 2.823 10 5 EFBEMO CC[C@@H]1C[C@H](C)C[N@H+]1CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848481264 1334737753 /nfs/dbraw/zinc/73/77/53/1334737753.db2.gz XLVJTKUVNPDCRU-YSVLISHTSA-N 1 1 331.416 2.989 10 5 EFBEMO CC(C)OCCC[N@@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848481290 1334738201 /nfs/dbraw/zinc/73/82/01/1334738201.db2.gz XOLYDBOHVROGJL-QGZVFWFLSA-N 1 1 349.431 2.615 10 5 EFBEMO CC(C)[C@H]1CC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848481972 1334738423 /nfs/dbraw/zinc/73/84/23/1334738423.db2.gz IVUAJHLYBZMSCH-RDJZCZTQSA-N 1 1 331.416 2.846 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCC[C@H]3COCC[C@H]32)c1 ZINC000848482669 1334740432 /nfs/dbraw/zinc/74/04/32/1334740432.db2.gz SSYGXKHNZDQUDB-WMLDXEAASA-N 1 1 342.399 2.917 10 5 EFBEMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC2(CCC2)C1 ZINC000848482565 1334740497 /nfs/dbraw/zinc/74/04/97/1334740497.db2.gz QPYKMNXQINBLMC-INIZCTEOSA-N 1 1 329.400 2.744 10 5 EFBEMO C[N@@H+](CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O)C1CC(C)(C)C1 ZINC000848488552 1334746188 /nfs/dbraw/zinc/74/61/88/1334746188.db2.gz LFMIEBJNAYLCAQ-INIZCTEOSA-N 1 1 331.416 2.989 10 5 EFBEMO O=C(Nc1ccc([N+](=O)[O-])cc1F)c1cnn(-c2cc[nH+]cc2)c1 ZINC001355952774 1334915885 /nfs/dbraw/zinc/91/58/85/1334915885.db2.gz BHBMZHCFVWNEBG-UHFFFAOYSA-N 1 1 327.275 2.567 10 5 EFBEMO C[C@@H]([NH2+]CC(=O)Nc1cccnc1Cl)c1ccccc1[N+](=O)[O-] ZINC000775578205 1335959308 /nfs/dbraw/zinc/95/93/08/1335959308.db2.gz TZKVRQVDXIQVQE-SNVBAGLBSA-N 1 1 334.763 2.933 10 5 EFBEMO C[N@@H+](CCNC(=O)Cc1cccc(F)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC001492841010 1358752466 /nfs/dbraw/zinc/75/24/66/1358752466.db2.gz FVHDUJOOQSZNRL-UHFFFAOYSA-N 1 1 345.374 2.525 10 5 EFBEMO Cc1nc(C)c(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)s1 ZINC001492850277 1359374708 /nfs/dbraw/zinc/37/47/08/1359374708.db2.gz WBACQUCPHLZSKV-UHFFFAOYSA-N 1 1 348.428 2.530 10 5 EFBEMO Cc1nc(C)c(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)s1 ZINC001492850277 1359374712 /nfs/dbraw/zinc/37/47/12/1359374712.db2.gz WBACQUCPHLZSKV-UHFFFAOYSA-N 1 1 348.428 2.530 10 5 EFBEMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CCN(C(=O)CCCF)CC1 ZINC001506964599 1406515293 /nfs/dbraw/zinc/51/52/93/1406515293.db2.gz UEYGAGSMMWVKBI-UHFFFAOYSA-N 1 1 337.395 2.767 10 5 EFBEMO O=[N+]([O-])c1cc(CO)c(N[C@H]2CC[N@@H+](CC3CCCC3)C2)cc1F ZINC001458220845 1395426417 /nfs/dbraw/zinc/42/64/17/1395426417.db2.gz QZFYCFQYLIRSPX-AWEZNQCLSA-N 1 1 337.395 2.903 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCC[C@H]1CCC[N@@H+](C)C1 ZINC001458432305 1395466433 /nfs/dbraw/zinc/46/64/33/1395466433.db2.gz QDGNWTGZAFNXPY-CYBMUJFWSA-N 1 1 335.404 2.834 10 5 EFBEMO C[C@H](CN1CCOCC1)C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001460128208 1396005972 /nfs/dbraw/zinc/00/59/72/1396005972.db2.gz INHKBKQUGZZIIP-SJLPKXTDSA-N 1 1 347.459 2.743 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCCC[C@@]23CCOC3)o1 ZINC001460961840 1396274946 /nfs/dbraw/zinc/27/49/46/1396274946.db2.gz TXGTUEPGOVBNCM-KRWDZBQOSA-N 1 1 344.371 2.790 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCCC[C@@]23CCOC3)o1 ZINC001460961840 1396274953 /nfs/dbraw/zinc/27/49/53/1396274953.db2.gz TXGTUEPGOVBNCM-KRWDZBQOSA-N 1 1 344.371 2.790 10 5 EFBEMO Cn1cncc1C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC001460961469 1396275021 /nfs/dbraw/zinc/27/50/21/1396275021.db2.gz FQAZXQKPNSNOJS-UHFFFAOYSA-N 1 1 341.371 2.849 10 5 EFBEMO CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC001465535916 1396688610 /nfs/dbraw/zinc/68/86/10/1396688610.db2.gz BGUFPKRHANJHCK-AWEZNQCLSA-N 1 1 346.431 2.631 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C2CC2)C[C@@H](C)C1 ZINC001468523915 1396964781 /nfs/dbraw/zinc/96/47/81/1396964781.db2.gz ZMXATZHNWJECDA-LLVKDONJSA-N 1 1 335.379 2.599 10 5 EFBEMO C[C@@H](CNC(=O)NCC[N@H+]1CCC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC001471464192 1397174408 /nfs/dbraw/zinc/17/44/08/1397174408.db2.gz HGYSPSRIBQNWNM-AWEZNQCLSA-N 1 1 348.447 2.729 10 5 EFBEMO Cc1[nH]c(C2CCN(C(=O)c3cc([N+](=O)[O-])cc(C)n3)CC2)[nH+]c1C ZINC001471911167 1397222235 /nfs/dbraw/zinc/22/22/35/1397222235.db2.gz IOZNLFALQFOLQC-UHFFFAOYSA-N 1 1 343.387 2.658 10 5 EFBEMO C[N@H+]1C[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C(C)(C)C1 ZINC001472025943 1397236111 /nfs/dbraw/zinc/23/61/11/1397236111.db2.gz ITDKOELXLHWTCL-LBPRGKRZSA-N 1 1 345.321 2.684 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(NC[C@H]2CC[N@H+](C3CC3)C2)cc1C ZINC001472654832 1397266776 /nfs/dbraw/zinc/26/67/76/1397266776.db2.gz NCGJSCZJJPKDAQ-CYBMUJFWSA-N 1 1 347.415 2.976 10 5 EFBEMO O=C(NCC[N@@H+](CCC1CCCCCC1)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001493371552 1398647964 /nfs/dbraw/zinc/64/79/64/1398647964.db2.gz ZMCLFUBUMVAIFU-IAGOWNOFSA-N 1 1 337.464 2.593 10 5 EFBEMO O=C(NCC[N@H+](CCC1CCCCCC1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001493371552 1398647969 /nfs/dbraw/zinc/64/79/69/1398647969.db2.gz ZMCLFUBUMVAIFU-IAGOWNOFSA-N 1 1 337.464 2.593 10 5 EFBEMO O=C(NCC[N@@H+](CCC1CCCCCC1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001493371552 1398647973 /nfs/dbraw/zinc/64/79/73/1398647973.db2.gz ZMCLFUBUMVAIFU-IAGOWNOFSA-N 1 1 337.464 2.593 10 5 EFBEMO CC(C)[N@@H+](CCCNC(=O)C(C)(F)F)Cc1cccc([N+](=O)[O-])c1 ZINC001493848725 1398920422 /nfs/dbraw/zinc/92/04/22/1398920422.db2.gz OMZNSMCKTOVHNE-UHFFFAOYSA-N 1 1 343.374 2.967 10 5 EFBEMO CC(C)[N@@H+](CCCNC(=O)c1ccc[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC001493852383 1398924772 /nfs/dbraw/zinc/92/47/72/1398924772.db2.gz VAZZMTLWSBEGSW-UHFFFAOYSA-N 1 1 344.415 2.953 10 5 EFBEMO O=C(CCCC1CC1)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001494585945 1399389387 /nfs/dbraw/zinc/38/93/87/1399389387.db2.gz WJRDUVUHSPVQTN-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)C1(CF)CCC1 ZINC001496784719 1400981990 /nfs/dbraw/zinc/98/19/90/1400981990.db2.gz AIAHOACSRATTAV-UHFFFAOYSA-N 1 1 337.395 2.625 10 5 EFBEMO CC(C)N(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccon1 ZINC001507766760 1407148862 /nfs/dbraw/zinc/14/88/62/1407148862.db2.gz FRDKNTWKQXRSLK-UHFFFAOYSA-N 1 1 346.387 2.565 10 5 EFBEMO O=C(/C=C/c1ccco1)NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001497520074 1401433252 /nfs/dbraw/zinc/43/32/52/1401433252.db2.gz ZRIAFIUDHQGNOX-DJKAJFNQSA-N 1 1 347.396 2.725 10 5 EFBEMO O=C(/C=C\c1ccco1)NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001497520075 1401433609 /nfs/dbraw/zinc/43/36/09/1401433609.db2.gz ZRIAFIUDHQGNOX-NRUGGMJCSA-N 1 1 347.396 2.725 10 5 EFBEMO O=C(NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1)C1C=CC=CC=C1 ZINC001497589893 1401477736 /nfs/dbraw/zinc/47/77/36/1401477736.db2.gz CVYMEBOXYWPPAO-AATRIKPKSA-N 1 1 345.424 2.717 10 5 EFBEMO CC/C=C(\C)C(=O)N1C[C@@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001501209213 1403493633 /nfs/dbraw/zinc/49/36/33/1403493633.db2.gz WWXPTGWVHYIBEL-HUKDTRKISA-N 1 1 343.427 2.841 10 5 EFBEMO C/C=C(\C)C(=O)NCC1=CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001508200243 1407340264 /nfs/dbraw/zinc/34/02/64/1407340264.db2.gz KBMGLCQLTXZJFN-LZWSPWQCSA-N 1 1 329.400 2.809 10 5 EFBEMO O=C(NC1(C[NH2+]CC2CCCCC2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001506506461 1405873823 /nfs/dbraw/zinc/87/38/23/1405873823.db2.gz XPSQGGZDXXYZMS-HZPDHXFCSA-N 1 1 337.464 2.641 10 5 EFBEMO CC[N@H+]1[C@H](C)CN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC001557270412 1415116404 /nfs/dbraw/zinc/11/64/04/1415116404.db2.gz JARGMRVQMRGVML-TXEJJXNPSA-N 1 1 341.358 2.628 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC001557270412 1415116408 /nfs/dbraw/zinc/11/64/08/1415116408.db2.gz JARGMRVQMRGVML-TXEJJXNPSA-N 1 1 341.358 2.628 10 5 EFBEMO COC(=O)Cc1ccc(NCCCC[N@@H+](C)C2CC2)c([N+](=O)[O-])c1 ZINC001559207178 1415229961 /nfs/dbraw/zinc/22/99/61/1415229961.db2.gz CUMRGCQWEVJHLP-UHFFFAOYSA-N 1 1 335.404 2.597 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(NC[C@H]2CCCC[N@H+]2C)cc1C ZINC001559296171 1415238194 /nfs/dbraw/zinc/23/81/94/1415238194.db2.gz FDHYDHIDHIHZME-CYBMUJFWSA-N 1 1 335.404 2.976 10 5 EFBEMO C[N@H+]1C[C@@]23CN(c4c([N+](=O)[O-])cccc4[N+](=O)[O-])C[C@]2(C1)CCCC3 ZINC001559305104 1415238654 /nfs/dbraw/zinc/23/86/54/1415238654.db2.gz VMMBATHTZZAWSF-CALCHBBNSA-N 1 1 346.387 2.815 10 5 EFBEMO CC1(C)CC[C@@H](CO)[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001560021490 1415261313 /nfs/dbraw/zinc/26/13/13/1415261313.db2.gz LZXHLAVWVMNYIC-LBPRGKRZSA-N 1 1 346.387 2.628 10 5 EFBEMO CC1(C)CC[C@@H](CO)[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001560021490 1415261317 /nfs/dbraw/zinc/26/13/17/1415261317.db2.gz LZXHLAVWVMNYIC-LBPRGKRZSA-N 1 1 346.387 2.628 10 5 EFBEMO COC1(c2nccn2C)CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC001560116039 1415262911 /nfs/dbraw/zinc/26/29/11/1415262911.db2.gz QAUHHMLGOFCODF-UHFFFAOYSA-N 1 1 348.378 2.605 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[NH2+]C2([C@H]3CCCCO3)CC2)o1 ZINC001560171451 1415266310 /nfs/dbraw/zinc/26/63/10/1415266310.db2.gz VOBFRTMWDJEPFN-CQSZACIVSA-N 1 1 344.371 2.836 10 5 EFBEMO CCOc1cc(C[N@H+]2CC[C@@H](c3cnccn3)C2)ccc1[N+](=O)[O-] ZINC001560176746 1415266333 /nfs/dbraw/zinc/26/63/33/1415266333.db2.gz GLJPSWAMPDPXMR-CQSZACIVSA-N 1 1 328.372 2.773 10 5 EFBEMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001565913622 1415448710 /nfs/dbraw/zinc/44/87/10/1415448710.db2.gz GYEPOVVWQZEAOH-BXUZGUMPSA-N 1 1 339.823 2.589 10 5 EFBEMO C[N@@H+](CCCNC(=O)C1(C2CC2)CC1)Cc1ccccc1[N+](=O)[O-] ZINC001566463836 1415562940 /nfs/dbraw/zinc/56/29/40/1415562940.db2.gz MTLASEKGAQPKFW-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO CCCC1(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccc([N+](=O)[O-])cc4)C[C@H]32)CC1 ZINC001566975316 1415884818 /nfs/dbraw/zinc/88/48/18/1415884818.db2.gz JDGOSUYQOATKJY-FVQHAEBGSA-N 1 1 343.427 2.722 10 5 EFBEMO Cc1ccc(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC001567316026 1416068279 /nfs/dbraw/zinc/06/82/79/1416068279.db2.gz IZQUTPZXVNKMQS-UHFFFAOYSA-N 1 1 327.384 2.765 10 5 EFBEMO Cc1ccc(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC001567316026 1416068282 /nfs/dbraw/zinc/06/82/82/1416068282.db2.gz IZQUTPZXVNKMQS-UHFFFAOYSA-N 1 1 327.384 2.765 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ccccc1O)Cc1ccc([N+](=O)[O-])cc1 ZINC001567327242 1416074837 /nfs/dbraw/zinc/07/48/37/1416074837.db2.gz KORTWOZTAMUMAT-UHFFFAOYSA-N 1 1 343.383 2.552 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1c[nH]cc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001567433327 1416136734 /nfs/dbraw/zinc/13/67/34/1416136734.db2.gz XOUYNEIRJGBIFT-UHFFFAOYSA-N 1 1 344.415 2.873 10 5 EFBEMO O=C(CC(F)(F)F)NCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001567438032 1416138125 /nfs/dbraw/zinc/13/81/25/1416138125.db2.gz WONGKUHZAZDDJB-UHFFFAOYSA-N 1 1 345.321 2.628 10 5 EFBEMO CC(C)[N@@H+](CCCNC(=O)C(F)F)Cc1cccc([N+](=O)[O-])c1 ZINC001567636034 1416220252 /nfs/dbraw/zinc/22/02/52/1416220252.db2.gz OJKFTACIPPYABD-UHFFFAOYSA-N 1 1 329.347 2.577 10 5 EFBEMO Cc1[nH]c(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c(C)[nH+]1 ZINC001646075093 1416609205 /nfs/dbraw/zinc/60/92/05/1416609205.db2.gz UUJPPSIFXQGTRP-UHFFFAOYSA-N 1 1 346.390 2.951 10 5 EFBEMO CCOc1ccc(C(=O)NCCNc2ccc(C)c[nH+]2)cc1[N+](=O)[O-] ZINC001646254505 1416639003 /nfs/dbraw/zinc/63/90/03/1416639003.db2.gz AGONEJKDVKYNIE-UHFFFAOYSA-N 1 1 344.371 2.539 10 5 EFBEMO Cc1ccc(CNC(=O)NCC[N@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC001684706438 1416728657 /nfs/dbraw/zinc/72/86/57/1416728657.db2.gz KUUSYXAQINPNID-UHFFFAOYSA-N 1 1 348.447 2.967 10 5 EFBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)CC(C)(F)F ZINC001698994462 1417362285 /nfs/dbraw/zinc/36/22/85/1417362285.db2.gz MBKRTCYVKLJPLH-UHFFFAOYSA-N 1 1 329.347 2.530 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)CC(C)(F)F ZINC001698994462 1417362293 /nfs/dbraw/zinc/36/22/93/1417362293.db2.gz MBKRTCYVKLJPLH-UHFFFAOYSA-N 1 1 329.347 2.530 10 5 EFBEMO C[N@@H+](CCCNC(=O)[C@H]1C[C@H]2C[C@H]2C1)Cc1ccccc1[N+](=O)[O-] ZINC001712966327 1418304156 /nfs/dbraw/zinc/30/41/56/1418304156.db2.gz AHDVMXUZDSWWMI-ZSHCYNCHSA-N 1 1 331.416 2.579 10 5 EFBEMO Cc1coc(C)c1C(=O)NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC001716680042 1418956718 /nfs/dbraw/zinc/95/67/18/1418956718.db2.gz KGBGZNBBAODXJY-UHFFFAOYSA-N 1 1 349.412 2.918 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)C(C)(C)F ZINC001724838039 1425051920 /nfs/dbraw/zinc/05/19/20/1425051920.db2.gz DKKVWYXWPOYHEP-UHFFFAOYSA-N 1 1 325.384 2.623 10 5 EFBEMO Cc1ccc(C)c(C[N@H+](C)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C(C)C)c1 ZINC001725729566 1425800932 /nfs/dbraw/zinc/80/09/32/1425800932.db2.gz ZBZVKLCBJGAIPK-QZTJIDSGSA-N 1 1 347.459 2.637 10 5 EFBEMO Cc1ccc(C)c(C[N@@H+](C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)c1 ZINC001725729566 1425800938 /nfs/dbraw/zinc/80/09/38/1425800938.db2.gz ZBZVKLCBJGAIPK-QZTJIDSGSA-N 1 1 347.459 2.637 10 5 EFBEMO Cc1ccc(C)c(C[N@H+](C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)c1 ZINC001725729566 1425800942 /nfs/dbraw/zinc/80/09/42/1425800942.db2.gz ZBZVKLCBJGAIPK-QZTJIDSGSA-N 1 1 347.459 2.637 10 5 EFBEMO C[C@H](O)C1CC[NH+](Cc2cccc([N+](=O)[O-])c2Br)CC1 ZINC000235552367 717939293 /nfs/dbraw/zinc/93/92/93/717939293.db2.gz IESHYIHKQTVDFI-JTQLQIEISA-N 1 1 343.221 2.950 10 5 EFBEMO CC[C@@H](NC(=O)N(C)[C@@H]1CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000893449129 715519360 /nfs/dbraw/zinc/51/93/60/715519360.db2.gz FMWXASHASQZIMG-HZPDHXFCSA-N 1 1 334.420 2.782 10 5 EFBEMO CC[C@@H](NC(=O)NCC[N@H+]1CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000893449886 715527187 /nfs/dbraw/zinc/52/71/87/715527187.db2.gz KBHAGSFAWMSATR-XJKSGUPXSA-N 1 1 334.420 2.829 10 5 EFBEMO C[C@H]1C[C@@H](NCc2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000162209679 716777844 /nfs/dbraw/zinc/77/78/44/716777844.db2.gz AOTNWHSPRHCVDL-GWCFXTLKSA-N 1 1 342.237 2.930 10 5 EFBEMO CC[N@@H+]1CC[C@@H]1CNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000893871903 720135701 /nfs/dbraw/zinc/13/57/01/720135701.db2.gz IIVNRDAYGOWNHM-SECBINFHSA-N 1 1 332.187 2.726 10 5 EFBEMO CC[N@H+]1CC[C@@H]1CNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000893871903 720135704 /nfs/dbraw/zinc/13/57/04/720135704.db2.gz IIVNRDAYGOWNHM-SECBINFHSA-N 1 1 332.187 2.726 10 5 EFBEMO COC(=O)[C@H]1[C@H](C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)C1(F)F ZINC000893946355 720178518 /nfs/dbraw/zinc/17/85/18/720178518.db2.gz ZKZRIZACGDBQKM-UONOGXRCSA-N 1 1 340.326 2.614 10 5 EFBEMO COC(=O)[C@H]1[C@H](C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)C1(F)F ZINC000893946355 720178523 /nfs/dbraw/zinc/17/85/23/720178523.db2.gz ZKZRIZACGDBQKM-UONOGXRCSA-N 1 1 340.326 2.614 10 5 EFBEMO C[C@H]1C[N@H+](CCCOC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000893394767 721363857 /nfs/dbraw/zinc/36/38/57/721363857.db2.gz XGSGYLAQLSXIOS-NSHDSACASA-N 1 1 342.779 2.516 10 5 EFBEMO C[C@H]1C[N@@H+](CCCOC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000893394767 721363862 /nfs/dbraw/zinc/36/38/62/721363862.db2.gz XGSGYLAQLSXIOS-NSHDSACASA-N 1 1 342.779 2.516 10 5 EFBEMO C[N@H+]1CC[C@H](C(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000895940515 723065282 /nfs/dbraw/zinc/06/52/82/723065282.db2.gz RFOHOZBWVIJEDM-ROUUACIJSA-N 1 1 339.395 2.904 10 5 EFBEMO CC(=O)c1c(N[C@@H]2CCC[N@@H+]3CCSC[C@H]23)cccc1[N+](=O)[O-] ZINC000895563907 724197800 /nfs/dbraw/zinc/19/78/00/724197800.db2.gz FNQJMWGYWJJHGH-IUODEOHRSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1c(N[C@@H]2CCC[N@H+]3CCSC[C@H]23)cccc1[N+](=O)[O-] ZINC000895563907 724197803 /nfs/dbraw/zinc/19/78/03/724197803.db2.gz FNQJMWGYWJJHGH-IUODEOHRSA-N 1 1 335.429 2.789 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000913760140 725851091 /nfs/dbraw/zinc/85/10/91/725851091.db2.gz HGXJLPBISZDJMM-CABZTGNLSA-N 1 1 341.770 2.554 10 5 EFBEMO C[C@@H]1[C@H](C)N(C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)CC[N@@H+]1C ZINC000907204650 726884296 /nfs/dbraw/zinc/88/42/96/726884296.db2.gz FKWCVXCSCDAGBC-NEPJUHHUSA-N 1 1 339.823 2.732 10 5 EFBEMO COC(=O)/C=C/c1ccc(NC[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000915211480 726898718 /nfs/dbraw/zinc/89/87/18/726898718.db2.gz UAIHRPCERBSHSE-RRFAQUSLSA-N 1 1 345.399 2.677 10 5 EFBEMO COC(=O)/C=C\c1ccc(NC[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000915211482 726898762 /nfs/dbraw/zinc/89/87/62/726898762.db2.gz UAIHRPCERBSHSE-UMSKNGNOSA-N 1 1 345.399 2.677 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=S)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000741491316 726911128 /nfs/dbraw/zinc/91/11/28/726911128.db2.gz ONIAVSAMSKDLHQ-IUODEOHRSA-N 1 1 336.461 2.954 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=S)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000741491320 726911214 /nfs/dbraw/zinc/91/12/14/726911214.db2.gz ONIAVSAMSKDLHQ-WFASDCNBSA-N 1 1 336.461 2.954 10 5 EFBEMO COc1ccc(C[NH2+][C@H](C)c2cn3c(n2)CCCC3)cc1[N+](=O)[O-] ZINC000924840172 727559443 /nfs/dbraw/zinc/55/94/43/727559443.db2.gz BEUHEBCNKBAOAD-GFCCVEGCSA-N 1 1 330.388 2.987 10 5 EFBEMO CC[N@H+]1[C@H](C)CN(C(=O)c2c(F)c(C)cc([N+](=O)[O-])c2F)C[C@@H]1C ZINC000912023126 727642078 /nfs/dbraw/zinc/64/20/78/727642078.db2.gz DAWSBPNDRSJBFA-PHIMTYICSA-N 1 1 341.358 2.736 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(C(=O)c2c(F)c(C)cc([N+](=O)[O-])c2F)C[C@@H]1C ZINC000912023126 727642081 /nfs/dbraw/zinc/64/20/81/727642081.db2.gz DAWSBPNDRSJBFA-PHIMTYICSA-N 1 1 341.358 2.736 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000912284356 727687947 /nfs/dbraw/zinc/68/79/47/727687947.db2.gz PXFJJRVSPHCXNE-SNVBAGLBSA-N 1 1 343.786 2.990 10 5 EFBEMO O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[C@@H]([NH+]2CCC2)C1 ZINC000912924456 727761612 /nfs/dbraw/zinc/76/16/12/727761612.db2.gz WDBANQMJDYNUSH-CYBMUJFWSA-N 1 1 331.397 2.730 10 5 EFBEMO O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[C@H]([NH+]2CCC2)C1 ZINC000912924457 727761750 /nfs/dbraw/zinc/76/17/50/727761750.db2.gz WDBANQMJDYNUSH-ZDUSSCGKSA-N 1 1 331.397 2.730 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@]2(C)C[N@H+](C)C[C@]2(C)C1 ZINC000913281119 727814422 /nfs/dbraw/zinc/81/44/22/727814422.db2.gz LNSLFIOMBDPSEL-NPKYINPLSA-N 1 1 343.427 2.798 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@]2(C)C[N@H+](C)C[C@]2(C)C1 ZINC000913281118 727814479 /nfs/dbraw/zinc/81/44/79/727814479.db2.gz LNSLFIOMBDPSEL-NIKHWINYSA-N 1 1 343.427 2.798 10 5 EFBEMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3cc([N+](=O)[O-])ccc3Cl)C[C@@]2(C)C1 ZINC000913296252 727818354 /nfs/dbraw/zinc/81/83/54/727818354.db2.gz XYGCCSQAYSCQJU-IYBDPMFKSA-N 1 1 337.807 2.662 10 5 EFBEMO CCC[N@H+]1CCC[C@@H]1C(=O)NCc1cc(F)c(Cl)c([N+](=O)[O-])c1 ZINC000913385552 727830969 /nfs/dbraw/zinc/83/09/69/727830969.db2.gz ABSGLENHJYBSBZ-GFCCVEGCSA-N 1 1 343.786 2.878 10 5 EFBEMO CC[N@@H+](CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O)C1CCCCC1 ZINC000058590680 728196084 /nfs/dbraw/zinc/19/60/84/728196084.db2.gz ORILZCPQPFGTSI-UHFFFAOYSA-N 1 1 331.372 2.803 10 5 EFBEMO Cc1noc(C[NH2+][C@](C)(CO)Cc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC001560182614 1126208659 /nfs/dbraw/zinc/20/86/59/1126208659.db2.gz GRDQYGJUJJJXOX-HNNXBMFYSA-N 1 1 339.779 2.628 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)CC(C)(F)F ZINC001570207643 1086052136 /nfs/dbraw/zinc/05/21/36/1086052136.db2.gz XWNGIJASDXVKBP-UHFFFAOYSA-N 1 1 343.374 2.920 10 5 EFBEMO CCCCCC[N@H+]1Cc2ccc(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2C1 ZINC001570311089 1086139065 /nfs/dbraw/zinc/13/90/65/1086139065.db2.gz NUVFXXKGRWOQHW-QZTJIDSGSA-N 1 1 345.443 2.864 10 5 EFBEMO CCCCCC[N@@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1 ZINC001570311089 1086139069 /nfs/dbraw/zinc/13/90/69/1086139069.db2.gz NUVFXXKGRWOQHW-QZTJIDSGSA-N 1 1 345.443 2.864 10 5 EFBEMO CCCCCC[N@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1 ZINC001570311089 1086139077 /nfs/dbraw/zinc/13/90/77/1086139077.db2.gz NUVFXXKGRWOQHW-QZTJIDSGSA-N 1 1 345.443 2.864 10 5 EFBEMO O=C(CC1CC1)NCC1=CC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001571679804 1087040664 /nfs/dbraw/zinc/04/06/64/1087040664.db2.gz OJAUIXHOTLOZID-UHFFFAOYSA-N 1 1 329.400 2.643 10 5 EFBEMO O=C(CC1CC1)NCC1=CC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001571679804 1087040669 /nfs/dbraw/zinc/04/06/69/1087040669.db2.gz OJAUIXHOTLOZID-UHFFFAOYSA-N 1 1 329.400 2.643 10 5 EFBEMO CC[N@H+]1C[C@H](NC(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)C(C)(C)C1 ZINC001646593017 1087900791 /nfs/dbraw/zinc/90/07/91/1087900791.db2.gz QYSYELNTWDBURX-PMPSAXMXSA-N 1 1 331.416 2.545 10 5 EFBEMO CC1(C)CC[N@@H+](CCNC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001647814946 1089885012 /nfs/dbraw/zinc/88/50/12/1089885012.db2.gz VMDUVUNLACZNBH-UHFFFAOYSA-N 1 1 339.823 2.639 10 5 EFBEMO CC[NH+](CC)CC[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccccc1 ZINC001648042317 1089933700 /nfs/dbraw/zinc/93/37/00/1089933700.db2.gz PQVNRVJUBGBKKC-AWEZNQCLSA-N 1 1 345.403 2.521 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(c4ncccn4)CC3)nc2c1 ZINC001648374826 1092208107 /nfs/dbraw/zinc/20/81/07/1092208107.db2.gz TUBSQEDZDOQFPU-UHFFFAOYSA-N 1 1 339.355 2.906 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@]2(CO)c2ccccc2)cc1 ZINC001648634706 1092243407 /nfs/dbraw/zinc/24/34/07/1092243407.db2.gz JIODEFFRSJFTGP-RTBURBONSA-N 1 1 342.395 2.612 10 5 EFBEMO CC(C)c1ccc2c(c1)CC[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)C2 ZINC001648672408 1092249253 /nfs/dbraw/zinc/24/92/53/1092249253.db2.gz AUJXMNPQPVWQRC-UHFFFAOYSA-N 1 1 341.411 2.938 10 5 EFBEMO C[N@H+](CCNC(=O)c1ccc(F)c(F)c1)Cc1cccc([N+](=O)[O-])c1 ZINC001267198839 1093165444 /nfs/dbraw/zinc/16/54/44/1093165444.db2.gz AHMNWNHKHDAZRB-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccc(F)c(F)c1)Cc1cccc([N+](=O)[O-])c1 ZINC001267198839 1093165448 /nfs/dbraw/zinc/16/54/48/1093165448.db2.gz AHMNWNHKHDAZRB-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO CC[N@H+](CCNC(=O)c1ccncc1C)Cc1ccccc1[N+](=O)[O-] ZINC001267241375 1093339590 /nfs/dbraw/zinc/33/95/90/1093339590.db2.gz VEHOFBDFMNBJFU-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ccncc1C)Cc1ccccc1[N+](=O)[O-] ZINC001267241375 1093339597 /nfs/dbraw/zinc/33/95/97/1093339597.db2.gz VEHOFBDFMNBJFU-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO CC1(CC(=O)NCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CC1 ZINC001267330011 1093593337 /nfs/dbraw/zinc/59/33/37/1093593337.db2.gz XZHGCEGXSQVNMT-UHFFFAOYSA-N 1 1 331.416 2.866 10 5 EFBEMO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@H]3COC[C@@H]3C2)c1Br ZINC000690777021 1094571384 /nfs/dbraw/zinc/57/13/84/1094571384.db2.gz SYBQYBFMJCJBKU-NEPJUHHUSA-N 1 1 341.205 2.826 10 5 EFBEMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c1Br ZINC000690777021 1094571391 /nfs/dbraw/zinc/57/13/91/1094571391.db2.gz SYBQYBFMJCJBKU-NEPJUHHUSA-N 1 1 341.205 2.826 10 5 EFBEMO CC(C)c1ncc(CNC(=O)CCOc2ccccc2[N+](=O)[O-])[nH]1 ZINC001597806147 1094625744 /nfs/dbraw/zinc/62/57/44/1094625744.db2.gz HNLPIZRBFMKLDJ-UHFFFAOYSA-N 1 1 332.360 2.527 10 5 EFBEMO CC(C)n1cccc1C(=O)NCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001480947223 1094715300 /nfs/dbraw/zinc/71/53/00/1094715300.db2.gz NCSFRBJADKNJHB-UHFFFAOYSA-N 1 1 344.415 2.839 10 5 EFBEMO C/C(=C/C(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000785336964 1094834691 /nfs/dbraw/zinc/83/46/91/1094834691.db2.gz MNHCUXPLWALKPY-WEGGENQUSA-N 1 1 329.400 2.741 10 5 EFBEMO CCC(=CC(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)CC ZINC001267679318 1095427878 /nfs/dbraw/zinc/42/78/78/1095427878.db2.gz ZEVUFIALLSJCRD-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO CC(C)(C)/C=C/C(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001267679365 1095431057 /nfs/dbraw/zinc/43/10/57/1095431057.db2.gz OZJDIROXABLKMK-CMDGGOBGSA-N 1 1 331.416 2.745 10 5 EFBEMO CC1(C(=O)NCC2C[NH+](Cc3cccc([N+](=O)[O-])c3)C2)CCCC1 ZINC001267685661 1095452311 /nfs/dbraw/zinc/45/23/11/1095452311.db2.gz FMXJZVMHDMTPAK-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO CC[N@@H+](CCNC(=O)/C=C\c1ccc[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC001480972031 1095626615 /nfs/dbraw/zinc/62/66/15/1095626615.db2.gz ZLQNWOLRNLRZQK-YFHOEESVSA-N 1 1 342.399 2.574 10 5 EFBEMO O=C(CCC1CCC1)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001481619194 1095693833 /nfs/dbraw/zinc/69/38/33/1095693833.db2.gz FVJSCKUDSAYBRW-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC001611165641 1098985767 /nfs/dbraw/zinc/98/57/67/1098985767.db2.gz QYGKZYXVGDHYGS-RHSMWYFYSA-N 1 1 333.432 2.887 10 5 EFBEMO C/C(=C\C(=O)NCC[N@@H+]1CCC[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785266179 1099238744 /nfs/dbraw/zinc/23/87/44/1099238744.db2.gz KMQUUVSKTFRXGA-YEQVNJDRSA-N 1 1 331.416 2.846 10 5 EFBEMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@H](O)[C@H]3CCCC[C@H]32)cc1 ZINC001620524138 1099358274 /nfs/dbraw/zinc/35/82/74/1099358274.db2.gz LUALHQVVLRTRBT-KSZLIROESA-N 1 1 334.416 2.989 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCC[C@@H]2c2ncccn2)cc1 ZINC001620549160 1099360572 /nfs/dbraw/zinc/36/05/72/1099360572.db2.gz SNVCMTZVOZQLMI-CVEARBPZSA-N 1 1 328.372 2.645 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCC[C@@H]2c2ncccn2)cc1 ZINC001620549160 1099360583 /nfs/dbraw/zinc/36/05/83/1099360583.db2.gz SNVCMTZVOZQLMI-CVEARBPZSA-N 1 1 328.372 2.645 10 5 EFBEMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CCc1ccc2c(c1)OCO2 ZINC001620586653 1099362766 /nfs/dbraw/zinc/36/27/66/1099362766.db2.gz AJZPYKRFWOXDKH-UHFFFAOYSA-N 1 1 344.367 2.877 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCO1 ZINC001620669120 1099367479 /nfs/dbraw/zinc/36/74/79/1099367479.db2.gz MEMDWNCMLJXKCT-SJORKVTESA-N 1 1 347.415 2.875 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCC[C@@H]1[C@@H]1CCCO1 ZINC001620669120 1099367492 /nfs/dbraw/zinc/36/74/92/1099367492.db2.gz MEMDWNCMLJXKCT-SJORKVTESA-N 1 1 347.415 2.875 10 5 EFBEMO Cc1cccnc1[C@H](C)[NH2+][C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC001620664261 1099369195 /nfs/dbraw/zinc/36/91/95/1099369195.db2.gz BNBMMNISUBDVGQ-BBRMVZONSA-N 1 1 340.383 2.754 10 5 EFBEMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC001624762358 1099728182 /nfs/dbraw/zinc/72/81/82/1099728182.db2.gz ZUFVBTRBURLDOP-ZDUSSCGKSA-N 1 1 330.388 2.679 10 5 EFBEMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CC[N@H+]1CC[C@@H](F)C1 ZINC001626725192 1099910014 /nfs/dbraw/zinc/91/00/14/1099910014.db2.gz HWEJYUFYMOLOIW-OAHLLOKOSA-N 1 1 337.395 2.766 10 5 EFBEMO C[N@@H+](CCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1)C1CCCC1 ZINC001627526019 1100006276 /nfs/dbraw/zinc/00/62/76/1100006276.db2.gz PWDXRGKRRBDLDN-UHFFFAOYSA-N 1 1 343.786 2.992 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1cccc([N+](=O)[O-])c1N)C1CCCCC1 ZINC001628574337 1100114195 /nfs/dbraw/zinc/11/41/95/1100114195.db2.gz BWCJOOKKNMIKER-UHFFFAOYSA-N 1 1 348.447 2.952 10 5 EFBEMO CC1(C)CCC[N@H+]1CCNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001629756044 1100244439 /nfs/dbraw/zinc/24/44/39/1100244439.db2.gz GPTOONZHSTWOPM-UHFFFAOYSA-N 1 1 339.823 2.781 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC001631057444 1100365885 /nfs/dbraw/zinc/36/58/85/1100365885.db2.gz NPHHVNMRIAFYMZ-UONOGXRCSA-N 1 1 349.431 2.844 10 5 EFBEMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC001632478526 1100477157 /nfs/dbraw/zinc/47/71/57/1100477157.db2.gz ZJXHZJYZCISOBK-GFCCVEGCSA-N 1 1 330.388 2.679 10 5 EFBEMO Nc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC001635295066 1100653159 /nfs/dbraw/zinc/65/31/59/1100653159.db2.gz PJTVGUZYKFKEBL-HNNXBMFYSA-N 1 1 346.431 2.704 10 5 EFBEMO CCCC[N@@H+](C)CCNc1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] ZINC001639453019 1100952130 /nfs/dbraw/zinc/95/21/30/1100952130.db2.gz AILVCIBJCCYFJS-CLFYSBASSA-N 1 1 335.404 2.925 10 5 EFBEMO COc1ccc2ncc([N+](=O)[O-])c(N[C@H](C)C[N@@H+](C)C(C)C)c2c1 ZINC001639883655 1100992396 /nfs/dbraw/zinc/99/23/96/1100992396.db2.gz ULZDRNZMZAOTBN-GFCCVEGCSA-N 1 1 332.404 2.714 10 5 EFBEMO COc1ccc2ncc([N+](=O)[O-])c(N3C[C@@H]4C[N@H+](C)CC[C@@H]4C3)c2c1 ZINC001640110696 1101015437 /nfs/dbraw/zinc/01/54/37/1101015437.db2.gz ZEYMSITVYSIXDR-OLZOCXBDSA-N 1 1 342.399 2.540 10 5 EFBEMO CCc1[nH+]ccn1CCNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC001640407809 1101044033 /nfs/dbraw/zinc/04/40/33/1101044033.db2.gz LAFRYKZDLSHRJW-UHFFFAOYSA-N 1 1 329.282 2.880 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001641399845 1101133060 /nfs/dbraw/zinc/13/30/60/1101133060.db2.gz OHZJDNRQAORPIE-AWEZNQCLSA-N 1 1 349.406 2.894 10 5 EFBEMO CC[N@H+]1CCC[C@H](CNc2c3cc(OC)ccc3ncc2[N+](=O)[O-])C1 ZINC001642153976 1101192958 /nfs/dbraw/zinc/19/29/58/1101192958.db2.gz FXMONKCTYPACLQ-CYBMUJFWSA-N 1 1 344.415 2.717 10 5 EFBEMO NC(=O)c1cc(NC[C@@H]2CC[N@H+]2C2CCCCCC2)ccc1[N+](=O)[O-] ZINC001643071685 1101268774 /nfs/dbraw/zinc/26/87/74/1101268774.db2.gz RTGFOTFRNCSFIB-HNNXBMFYSA-N 1 1 346.431 2.903 10 5 EFBEMO Cn1cc[nH+]c1CCNc1c2cc(Cl)ccc2ncc1[N+](=O)[O-] ZINC001643182755 1101277621 /nfs/dbraw/zinc/27/76/21/1101277621.db2.gz JKWLBRAIRGQHFA-UHFFFAOYSA-N 1 1 331.763 2.606 10 5 EFBEMO CCc1cc(N[C@H]2CC[N@@H+](C)[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001651435126 1101328987 /nfs/dbraw/zinc/32/89/87/1101328987.db2.gz QOSUSOQUUWNPNP-WBMJQRKESA-N 1 1 341.415 2.541 10 5 EFBEMO CC1(C(=O)NCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCC1 ZINC001266604429 1101382474 /nfs/dbraw/zinc/38/24/74/1101382474.db2.gz DVBXYQIOEHSOAY-UHFFFAOYSA-N 1 1 331.416 2.866 10 5 EFBEMO CC[C@@H](NC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC001670667297 1101462514 /nfs/dbraw/zinc/46/25/14/1101462514.db2.gz FLDAEFNZORWGLY-XLNGHYISSA-N 1 1 346.431 2.685 10 5 EFBEMO COC(=O)[C@@H](C)C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001652424223 1101488239 /nfs/dbraw/zinc/48/82/39/1101488239.db2.gz SFZLCZQVVHTQIB-ZDUSSCGKSA-N 1 1 336.388 2.637 10 5 EFBEMO CC[N@H+]1C[C@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C(C)(C)C1 ZINC001652603496 1101519718 /nfs/dbraw/zinc/51/97/18/1101519718.db2.gz MPNKDLKZMWTGIR-ZDUSSCGKSA-N 1 1 341.358 2.533 10 5 EFBEMO COCC(C)(C)[NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001653317307 1101609945 /nfs/dbraw/zinc/60/99/45/1101609945.db2.gz UUYPPTRCUQJNIN-UHFFFAOYSA-N 1 1 340.767 2.813 10 5 EFBEMO CN(Cc1cc([N+](=O)[O-])ccc1Br)C[C@H]1CCC[N@H+]1C ZINC001653950231 1101664119 /nfs/dbraw/zinc/66/41/19/1101664119.db2.gz RCMVDTQRKABVKL-CYBMUJFWSA-N 1 1 342.237 2.883 10 5 EFBEMO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC001654574650 1101734547 /nfs/dbraw/zinc/73/45/47/1101734547.db2.gz HGORORKBXHFUAF-INIZCTEOSA-N 1 1 340.383 2.734 10 5 EFBEMO Cc1cncc([C@@H]2CCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC001654574650 1101734555 /nfs/dbraw/zinc/73/45/55/1101734555.db2.gz HGORORKBXHFUAF-INIZCTEOSA-N 1 1 340.383 2.734 10 5 EFBEMO COC(=O)c1cc(C(=O)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(C)[nH]1 ZINC001654745467 1101751793 /nfs/dbraw/zinc/75/17/93/1101751793.db2.gz CUYZKJMDRDEXGG-SNVBAGLBSA-N 1 1 345.355 2.551 10 5 EFBEMO CC[N@H+](CCNC(=O)c1ccsc1)Cc1ccccc1[N+](=O)[O-] ZINC001266375480 1101776465 /nfs/dbraw/zinc/77/64/65/1101776465.db2.gz PEHHODJBCQXOLU-UHFFFAOYSA-N 1 1 333.413 2.908 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ccsc1)Cc1ccccc1[N+](=O)[O-] ZINC001266375480 1101776471 /nfs/dbraw/zinc/77/64/71/1101776471.db2.gz PEHHODJBCQXOLU-UHFFFAOYSA-N 1 1 333.413 2.908 10 5 EFBEMO Nc1nnc([C@H]2CCC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)o1 ZINC001655202713 1101794549 /nfs/dbraw/zinc/79/45/49/1101794549.db2.gz KRJNZAAOJUTEBZ-VIFPVBQESA-N 1 1 337.767 2.593 10 5 EFBEMO Nc1nnc([C@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)o1 ZINC001655202713 1101794556 /nfs/dbraw/zinc/79/45/56/1101794556.db2.gz KRJNZAAOJUTEBZ-VIFPVBQESA-N 1 1 337.767 2.593 10 5 EFBEMO CC[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001655897883 1101908785 /nfs/dbraw/zinc/90/87/85/1101908785.db2.gz AESQGUQHADBSAM-GFCCVEGCSA-N 1 1 349.460 2.895 10 5 EFBEMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001655897883 1101908787 /nfs/dbraw/zinc/90/87/87/1101908787.db2.gz AESQGUQHADBSAM-GFCCVEGCSA-N 1 1 349.460 2.895 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC=CC12CCCCC2 ZINC001655916158 1101910684 /nfs/dbraw/zinc/91/06/84/1101910684.db2.gz SSIQXWQLFQISLM-HNNXBMFYSA-N 1 1 332.400 2.909 10 5 EFBEMO CC[N@H+](CCNC(=O)[C@H]1C[C@H]2C[C@H]2C1)Cc1ccccc1[N+](=O)[O-] ZINC001266411409 1101932717 /nfs/dbraw/zinc/93/27/17/1101932717.db2.gz UIASCTMSHARPJT-ZSHCYNCHSA-N 1 1 331.416 2.579 10 5 EFBEMO CC[N@@H+](CCNC(=O)[C@H]1C[C@H]2C[C@H]2C1)Cc1ccccc1[N+](=O)[O-] ZINC001266411409 1101932724 /nfs/dbraw/zinc/93/27/24/1101932724.db2.gz UIASCTMSHARPJT-ZSHCYNCHSA-N 1 1 331.416 2.579 10 5 EFBEMO C[N@@H+](CCCC(=O)OC(C)(C)C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001656392383 1102046391 /nfs/dbraw/zinc/04/63/91/1102046391.db2.gz VPIHHKAFDBPNOL-HNNXBMFYSA-N 1 1 338.404 2.682 10 5 EFBEMO Cc1c(CN2CCC(O)(C[NH+]3CCCCC3)CC2)cccc1[N+](=O)[O-] ZINC001656474737 1102104066 /nfs/dbraw/zinc/10/40/66/1102104066.db2.gz NKMBTINKGASTTA-UHFFFAOYSA-N 1 1 347.459 2.716 10 5 EFBEMO CC[N@H+]1CCN(Cc2cc([N+](=O)[O-])ccc2Br)C[C@@H]1C ZINC001657825768 1102412878 /nfs/dbraw/zinc/41/28/78/1102412878.db2.gz NOQLDKXAUCYZEW-NSHDSACASA-N 1 1 342.237 2.883 10 5 EFBEMO Cc1cccnc1C(=O)NCCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001660094082 1102595989 /nfs/dbraw/zinc/59/59/89/1102595989.db2.gz AYXKWFJSZGBCGS-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1c(C)cc(C)cc1C ZINC001266560163 1102748718 /nfs/dbraw/zinc/74/87/18/1102748718.db2.gz BXCNFRKBUHSGDQ-SJLPKXTDSA-N 1 1 347.459 2.605 10 5 EFBEMO CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1c(C)cc(C)cc1C ZINC001266560163 1102748728 /nfs/dbraw/zinc/74/87/28/1102748728.db2.gz BXCNFRKBUHSGDQ-SJLPKXTDSA-N 1 1 347.459 2.605 10 5 EFBEMO CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1c(C)cc(C)cc1C ZINC001266560163 1102748740 /nfs/dbraw/zinc/74/87/40/1102748740.db2.gz BXCNFRKBUHSGDQ-SJLPKXTDSA-N 1 1 347.459 2.605 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1[nH]ccc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001266560569 1102752223 /nfs/dbraw/zinc/75/22/23/1102752223.db2.gz RRQGVLCYTACCFP-UHFFFAOYSA-N 1 1 344.415 2.873 10 5 EFBEMO CC[N@H+](CCNC(=O)c1[nH]c(C)cc1C)Cc1ccccc1[N+](=O)[O-] ZINC001663397349 1104083777 /nfs/dbraw/zinc/08/37/77/1104083777.db2.gz YMCZHWXQQYJKHR-UHFFFAOYSA-N 1 1 344.415 2.792 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1[nH]c(C)cc1C)Cc1ccccc1[N+](=O)[O-] ZINC001663397349 1104083786 /nfs/dbraw/zinc/08/37/86/1104083786.db2.gz YMCZHWXQQYJKHR-UHFFFAOYSA-N 1 1 344.415 2.792 10 5 EFBEMO CCC[N@H+](CCNC(=O)c1ccccn1)Cc1ccccc1[N+](=O)[O-] ZINC001663648936 1104182374 /nfs/dbraw/zinc/18/23/74/1104182374.db2.gz FJKCLJWQSASYCM-UHFFFAOYSA-N 1 1 342.399 2.632 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1ccccn1)Cc1ccccc1[N+](=O)[O-] ZINC001663648936 1104182381 /nfs/dbraw/zinc/18/23/81/1104182381.db2.gz FJKCLJWQSASYCM-UHFFFAOYSA-N 1 1 342.399 2.632 10 5 EFBEMO C[N@H+]1CCCC[C@H]1CCn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O ZINC000906498715 1104244389 /nfs/dbraw/zinc/24/43/89/1104244389.db2.gz CRHRIOBGRUQKHS-HNNXBMFYSA-N 1 1 342.399 2.693 10 5 EFBEMO CC1(C(=O)NCC2([NH2+]Cc3csc([N+](=O)[O-])c3)CC2)CCCC1 ZINC001670829574 1104548405 /nfs/dbraw/zinc/54/84/05/1104548405.db2.gz RAATVNUWIDWVRU-UHFFFAOYSA-N 1 1 337.445 2.975 10 5 EFBEMO CC[S@](=O)CC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000733900390 1104579417 /nfs/dbraw/zinc/57/94/17/1104579417.db2.gz OXIVGEKFDVIEMS-QFIPXVFZSA-N 1 1 339.442 2.577 10 5 EFBEMO O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)c1cc(F)ccc1[N+](=O)[O-] ZINC000081290568 1104781812 /nfs/dbraw/zinc/78/18/12/1104781812.db2.gz RCLRXRTXTSCFKG-AWEZNQCLSA-N 1 1 335.379 2.728 10 5 EFBEMO CC(C)(C)CCC[NH2+]Cc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001666333083 1104927253 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CCC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000343558894 145237581 /nfs/dbraw/zinc/23/75/81/145237581.db2.gz CULRCOOBUVLWHM-CQSZACIVSA-N 1 1 335.404 2.598 10 5 EFBEMO CN(C(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F)[C@@H]1CCC[N@@H+](C)C1 ZINC000349128893 146057262 /nfs/dbraw/zinc/05/72/62/146057262.db2.gz LKJYZCCMIKDBSR-SNVBAGLBSA-N 1 1 345.321 2.780 10 5 EFBEMO C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000355738095 147049447 /nfs/dbraw/zinc/04/94/47/147049447.db2.gz HHBFGSYWWZNQOX-MCIONIFRSA-N 1 1 340.445 2.735 10 5 EFBEMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000355738095 147049449 /nfs/dbraw/zinc/04/94/49/147049449.db2.gz HHBFGSYWWZNQOX-MCIONIFRSA-N 1 1 340.445 2.735 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](Cc3ccncc3)C2)c1 ZINC000360344692 148336244 /nfs/dbraw/zinc/33/62/44/148336244.db2.gz OJAXJCNOEGBGOP-MRXNPFEDSA-N 1 1 327.384 2.933 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1C[C@H]2CCCC[C@H]21 ZINC000368082480 150031136 /nfs/dbraw/zinc/03/11/36/150031136.db2.gz WDFCZKIFUGHILB-LALPHHSUSA-N 1 1 333.388 2.805 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1C[C@H]2CCCC[C@H]21 ZINC000368082480 150031140 /nfs/dbraw/zinc/03/11/40/150031140.db2.gz WDFCZKIFUGHILB-LALPHHSUSA-N 1 1 333.388 2.805 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@H]1CCc2[nH]cnc2C1)C1CC1 ZINC000368102144 150036329 /nfs/dbraw/zinc/03/63/29/150036329.db2.gz MOTOWCXAODOPED-HOCLYGCPSA-N 1 1 326.400 2.786 10 5 EFBEMO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCc3[nH]cnc3C2)cc1[N+](=O)[O-] ZINC000368102911 150038835 /nfs/dbraw/zinc/03/88/35/150038835.db2.gz QRDHMUAJKIXCGT-WCQYABFASA-N 1 1 330.388 2.925 10 5 EFBEMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@H](Cc3ccncc3)C2)c1 ZINC000368151210 150051275 /nfs/dbraw/zinc/05/12/75/150051275.db2.gz ZHHFHCKZOPOUJL-QAPCUYQASA-N 1 1 327.384 2.588 10 5 EFBEMO C[C@H]1[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CC(=O)N1Cc1ccccc1 ZINC000374279952 151313219 /nfs/dbraw/zinc/31/32/19/151313219.db2.gz MLKFWKAZLZCHQR-SWLSCSKDSA-N 1 1 345.424 2.936 10 5 EFBEMO C[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@H]1CCCO1 ZINC000122999305 222197772 /nfs/dbraw/zinc/19/77/72/222197772.db2.gz VXURRWMPYBXZJT-LLVKDONJSA-N 1 1 329.194 2.968 10 5 EFBEMO CSc1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000123114982 222218446 /nfs/dbraw/zinc/21/84/46/222218446.db2.gz GHLJXRPZVJUPOA-DGCLKSJQSA-N 1 1 337.445 2.871 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000123152309 222224657 /nfs/dbraw/zinc/22/46/57/222224657.db2.gz BUXVFZHZXSBZBH-NEPJUHHUSA-N 1 1 336.392 2.550 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000123152506 222225232 /nfs/dbraw/zinc/22/52/32/222225232.db2.gz BUXVFZHZXSBZBH-RYUDHWBXSA-N 1 1 336.392 2.550 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000123746554 222326592 /nfs/dbraw/zinc/32/65/92/222326592.db2.gz IEOQQJKOBVAWKI-QWRGUYRKSA-N 1 1 325.796 2.803 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000123490987 222285514 /nfs/dbraw/zinc/28/55/14/222285514.db2.gz CTXDEJQGMJVWLA-ZDUSSCGKSA-N 1 1 342.399 2.747 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272466487 266274342 /nfs/dbraw/zinc/27/43/42/266274342.db2.gz FCZFFZVLBJUQJX-LBPRGKRZSA-N 1 1 341.358 2.677 10 5 EFBEMO COc1ccc(NC(=O)NCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000272761430 266374509 /nfs/dbraw/zinc/37/45/09/266374509.db2.gz ALTIWTNLPXRDEX-LBPRGKRZSA-N 1 1 336.392 2.599 10 5 EFBEMO COC(=O)c1cc(N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)cc(C)c1[N+](=O)[O-] ZINC000277042962 267104665 /nfs/dbraw/zinc/10/46/65/267104665.db2.gz PIDOHMQDOAQMBN-CZUORRHYSA-N 1 1 347.415 2.610 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCCc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000269738836 273089800 /nfs/dbraw/zinc/08/98/00/273089800.db2.gz YDCSEDLIEWFXJL-GOEBONIOSA-N 1 1 348.447 2.509 10 5 EFBEMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000270408109 273094267 /nfs/dbraw/zinc/09/42/67/273094267.db2.gz IGTFYSQZECEUNY-AOOOYVTPSA-N 1 1 345.321 2.778 10 5 EFBEMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000270408109 273094268 /nfs/dbraw/zinc/09/42/68/273094268.db2.gz IGTFYSQZECEUNY-AOOOYVTPSA-N 1 1 345.321 2.778 10 5 EFBEMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000270408114 273094277 /nfs/dbraw/zinc/09/42/77/273094277.db2.gz IGTFYSQZECEUNY-NXEZZACHSA-N 1 1 345.321 2.778 10 5 EFBEMO NC(=O)N[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000271237042 273102692 /nfs/dbraw/zinc/10/26/92/273102692.db2.gz BFCJDHGEJDKKRP-NSHDSACASA-N 1 1 346.412 2.566 10 5 EFBEMO CC1(C)C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000280310754 273314236 /nfs/dbraw/zinc/31/42/36/273314236.db2.gz PNMHPIAKPDWCGP-SUQGKYDKSA-N 1 1 332.400 2.878 10 5 EFBEMO CC1(C)C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000280310754 273314237 /nfs/dbraw/zinc/31/42/37/273314237.db2.gz PNMHPIAKPDWCGP-SUQGKYDKSA-N 1 1 332.400 2.878 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC=C(c2ccnn2C)CC1 ZINC000285529723 274018939 /nfs/dbraw/zinc/01/89/39/274018939.db2.gz HGIPXYDEUSFCHH-UHFFFAOYSA-N 1 1 328.372 2.626 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC=C(c2ccnn2C)CC1 ZINC000285529723 274018941 /nfs/dbraw/zinc/01/89/41/274018941.db2.gz HGIPXYDEUSFCHH-UHFFFAOYSA-N 1 1 328.372 2.626 10 5 EFBEMO O=C(CC[N@@H+]1CCC[C@H]1c1cc[nH]n1)Nc1cc([N+](=O)[O-])ccc1F ZINC000285575832 274029011 /nfs/dbraw/zinc/02/90/11/274029011.db2.gz ARFATBFHBSXKGV-HNNXBMFYSA-N 1 1 347.350 2.623 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@H]1c1cc[nH]n1)Nc1cc([N+](=O)[O-])ccc1F ZINC000285575832 274029012 /nfs/dbraw/zinc/02/90/12/274029012.db2.gz ARFATBFHBSXKGV-HNNXBMFYSA-N 1 1 347.350 2.623 10 5 EFBEMO CO[C@@H](C)C[NH+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000182045979 274056530 /nfs/dbraw/zinc/05/65/30/274056530.db2.gz UNIAYWUDNYPVCE-NSHDSACASA-N 1 1 347.337 2.771 10 5 EFBEMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000355789552 274385117 /nfs/dbraw/zinc/38/51/17/274385117.db2.gz XIEGERBGVNEKTO-MCIONIFRSA-N 1 1 331.416 2.850 10 5 EFBEMO C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cn1)c1ccccc1[N+](=O)[O-] ZINC000342302876 274510920 /nfs/dbraw/zinc/51/09/20/274510920.db2.gz OMOFNPLMYGNEEU-JTQLQIEISA-N 1 1 334.763 2.933 10 5 EFBEMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3cc[nH]n3)CC2)c([N+](=O)[O-])c1 ZINC000193851777 275035333 /nfs/dbraw/zinc/03/53/33/275035333.db2.gz PWMUIVSQGDWUHV-UHFFFAOYSA-N 1 1 331.332 2.606 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000248043183 277169069 /nfs/dbraw/zinc/16/90/69/277169069.db2.gz MKHXACAEXBAECP-DLBZAZTESA-N 1 1 325.368 2.770 10 5 EFBEMO C[N@H+]1CC[C@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000192766075 290226620 /nfs/dbraw/zinc/22/66/20/290226620.db2.gz GFHSFFFAEQDJFH-RDJZCZTQSA-N 1 1 340.383 2.551 10 5 EFBEMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000130229534 293158455 /nfs/dbraw/zinc/15/84/55/293158455.db2.gz WKYMSTLYNSCRCY-NSHDSACASA-N 1 1 341.371 2.647 10 5 EFBEMO CC(=O)N[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000153853070 293397262 /nfs/dbraw/zinc/39/72/62/293397262.db2.gz QZILJKYZKVFXAI-HNNXBMFYSA-N 1 1 343.383 2.955 10 5 EFBEMO CC(=O)N[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000153868270 293398281 /nfs/dbraw/zinc/39/82/81/293398281.db2.gz RTMZAABUYSBSOQ-AWEZNQCLSA-N 1 1 343.383 2.955 10 5 EFBEMO COc1ccc(C[NH2+]Cc2cn(C)nc2C(F)F)cc1[N+](=O)[O-] ZINC000291176449 294300306 /nfs/dbraw/zinc/30/03/06/294300306.db2.gz KHTCRRLCWIRTSH-UHFFFAOYSA-N 1 1 326.303 2.564 10 5 EFBEMO CC[N@H+]1CC[C@H](CNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000291369414 294361308 /nfs/dbraw/zinc/36/13/08/294361308.db2.gz AGTAFMQOXHSEQQ-SECBINFHSA-N 1 1 346.214 2.973 10 5 EFBEMO CN(C)c1[nH+]cc(CNc2c3ccccc3ncc2[N+](=O)[O-])n1C ZINC000291925391 294524289 /nfs/dbraw/zinc/52/42/89/294524289.db2.gz LUCTZLSMKPYAQI-UHFFFAOYSA-N 1 1 326.360 2.555 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000294543521 295183707 /nfs/dbraw/zinc/18/37/07/295183707.db2.gz QKOFBLXMNKXGQL-AWEZNQCLSA-N 1 1 347.415 2.548 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCOC[C@H](O)C2)s1 ZINC000294902639 295243426 /nfs/dbraw/zinc/24/34/26/295243426.db2.gz XJUBFXGZTWURHF-GFCCVEGCSA-N 1 1 334.397 2.516 10 5 EFBEMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000297932960 310941582 /nfs/dbraw/zinc/94/15/82/310941582.db2.gz VDGSVBCLKAJBGF-UWVGGRQHSA-N 1 1 345.321 2.778 10 5 EFBEMO COc1cc(F)c([N+](=O)[O-])c(N2C[C@@H]3C[N@H+]4CCCC[C@H]4[C@H]3C2)c1 ZINC000301477703 311139374 /nfs/dbraw/zinc/13/93/74/311139374.db2.gz PRFFHKAOEKAXGL-WHOFXGATSA-N 1 1 335.379 2.663 10 5 EFBEMO CC(C)C[C@@H](CNc1cc(F)ccc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000302824896 311203229 /nfs/dbraw/zinc/20/32/29/311203229.db2.gz XSDXLAXXQQQPFU-AWEZNQCLSA-N 1 1 325.384 2.893 10 5 EFBEMO CCC[C@@H](C)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000330650756 311326886 /nfs/dbraw/zinc/32/68/86/311326886.db2.gz HRXOBWYLIBLMEX-GFCCVEGCSA-N 1 1 325.434 2.850 10 5 EFBEMO Cc1sc(C(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000330663211 311327515 /nfs/dbraw/zinc/32/75/15/311327515.db2.gz STOPUYSJJWXTGO-GHMZBOCLSA-N 1 1 325.434 2.815 10 5 EFBEMO C[C@H](O)[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000414575975 312051602 /nfs/dbraw/zinc/05/16/02/312051602.db2.gz FSVBSRFCYSBQGN-BLLLJJGKSA-N 1 1 348.424 2.905 10 5 EFBEMO C[C@H](O)[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000414575975 312051604 /nfs/dbraw/zinc/05/16/04/312051604.db2.gz FSVBSRFCYSBQGN-BLLLJJGKSA-N 1 1 348.424 2.905 10 5 EFBEMO NC(=O)c1coc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000417315413 312208203 /nfs/dbraw/zinc/20/82/03/312208203.db2.gz BKFQWZGXHMWUDA-INIZCTEOSA-N 1 1 329.356 2.844 10 5 EFBEMO CCOc1cc(C[N@@H+]2CCC[C@@H]2C(=O)N(CC)CC)ccc1[N+](=O)[O-] ZINC000492464361 314000028 /nfs/dbraw/zinc/00/00/28/314000028.db2.gz SITHQLFDDLUHHJ-MRXNPFEDSA-N 1 1 349.431 2.826 10 5 EFBEMO CCOc1cc(C[N@H+]2CCC[C@@H]2C(=O)N(CC)CC)ccc1[N+](=O)[O-] ZINC000492464361 314000031 /nfs/dbraw/zinc/00/00/31/314000031.db2.gz SITHQLFDDLUHHJ-MRXNPFEDSA-N 1 1 349.431 2.826 10 5 EFBEMO COc1cc(C[NH2+][C@H](CO)c2sccc2C)c([N+](=O)[O-])cc1F ZINC000494624320 314614424 /nfs/dbraw/zinc/61/44/24/314614424.db2.gz GMXYSCLYFSYXMK-GFCCVEGCSA-N 1 1 340.376 2.936 10 5 EFBEMO Cc1ccc([C@@H](C)NC(=O)Cn2c[nH+]c3c2CCCC3)cc1[N+](=O)[O-] ZINC000542722344 317823486 /nfs/dbraw/zinc/82/34/86/317823486.db2.gz GHHXIKFTEUZYFZ-CYBMUJFWSA-N 1 1 342.399 2.856 10 5 EFBEMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000548125646 318076361 /nfs/dbraw/zinc/07/63/61/318076361.db2.gz ARPREAONFNRUBZ-OAHLLOKOSA-N 1 1 348.447 2.730 10 5 EFBEMO COc1cccc([N+](=O)[O-])c1N1CCN(c2cc(C)cc[nH+]2)CC1 ZINC000565433015 318970906 /nfs/dbraw/zinc/97/09/06/318970906.db2.gz NXIJIUHJDGNSBS-UHFFFAOYSA-N 1 1 328.372 2.633 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC[C@@H]3C3(O)CC3)n2)cc1 ZINC000568363821 319275680 /nfs/dbraw/zinc/27/56/80/319275680.db2.gz LAQFKPYLDWZYSR-CQSZACIVSA-N 1 1 344.371 2.524 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H](Nc2ncccn2)C1 ZINC000580312857 324139136 /nfs/dbraw/zinc/13/91/36/324139136.db2.gz JFLQTDRTUYGEBC-VFQAQYNWSA-N 1 1 325.372 2.584 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@H](Nc2ncccn2)C1 ZINC000580312855 324139736 /nfs/dbraw/zinc/13/97/36/324139736.db2.gz JFLQTDRTUYGEBC-BYPUDFOVSA-N 1 1 325.372 2.584 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1C ZINC000124515186 473254409 /nfs/dbraw/zinc/25/44/09/473254409.db2.gz CHCQVIIJJAZKRD-QWRGUYRKSA-N 1 1 325.796 2.803 10 5 EFBEMO C[C@H]1C[C@H](N(C)C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000124572647 473265883 /nfs/dbraw/zinc/26/58/83/473265883.db2.gz YNDLMYCBWJDULQ-CMPLNLGQSA-N 1 1 325.796 2.803 10 5 EFBEMO Cc1cc(N2CC[C@H](C[N@H+](C)Cc3cccnc3)C2)ncc1[N+](=O)[O-] ZINC000190449954 473278723 /nfs/dbraw/zinc/27/87/23/473278723.db2.gz UCXHTYWPNDGFQD-MRXNPFEDSA-N 1 1 341.415 2.652 10 5 EFBEMO Cc1cc([N+](=O)[O-])cnc1N1CC[C@@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000190450535 473278750 /nfs/dbraw/zinc/27/87/50/473278750.db2.gz CJZUWXZYXMGKHO-INIZCTEOSA-N 1 1 341.415 2.652 10 5 EFBEMO Cc1nc(N2CC[C@@H](C[N@H+](C)Cc3cccnc3)C2)ccc1[N+](=O)[O-] ZINC000190450018 473278829 /nfs/dbraw/zinc/27/88/29/473278829.db2.gz XSFRVFAAGZUHTP-INIZCTEOSA-N 1 1 341.415 2.652 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000176976366 473279134 /nfs/dbraw/zinc/27/91/34/473279134.db2.gz YJCSAPSDFYSSGH-CYBMUJFWSA-N 1 1 337.445 2.873 10 5 EFBEMO Cc1nc(N2CC[C@H](C[N@H+](C)Cc3cccnc3)C2)ccc1[N+](=O)[O-] ZINC000190449998 473279474 /nfs/dbraw/zinc/27/94/74/473279474.db2.gz XSFRVFAAGZUHTP-MRXNPFEDSA-N 1 1 341.415 2.652 10 5 EFBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000177216560 473334035 /nfs/dbraw/zinc/33/40/35/473334035.db2.gz CAVDHKHYTBASBZ-OAHLLOKOSA-N 1 1 328.372 2.713 10 5 EFBEMO CCc1nnc(C2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)[nH]1 ZINC000190686041 473360721 /nfs/dbraw/zinc/36/07/21/473360721.db2.gz UUYBWVZLKYKTCY-UHFFFAOYSA-N 1 1 329.404 2.697 10 5 EFBEMO CCc1nc(C2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)n[nH]1 ZINC000190686041 473360724 /nfs/dbraw/zinc/36/07/24/473360724.db2.gz UUYBWVZLKYKTCY-UHFFFAOYSA-N 1 1 329.404 2.697 10 5 EFBEMO CCc1n[nH]c(C2CC[NH+](CCOc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000190704556 473367627 /nfs/dbraw/zinc/36/76/27/473367627.db2.gz VPUGSAQGZCTJME-UHFFFAOYSA-N 1 1 345.403 2.534 10 5 EFBEMO CCc1nc(C2CC[NH+](CCOc3ccc([N+](=O)[O-])cc3)CC2)n[nH]1 ZINC000190704556 473367630 /nfs/dbraw/zinc/36/76/30/473367630.db2.gz VPUGSAQGZCTJME-UHFFFAOYSA-N 1 1 345.403 2.534 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(Cc2[nH+]ccn2C)CC1 ZINC000162633124 473365633 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10 5 EFBEMO Cc1nc(C[C@@H]2CCC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)no1 ZINC000089718273 472493130 /nfs/dbraw/zinc/49/31/30/472493130.db2.gz PADDMFQFGMCHLA-LBPRGKRZSA-N 1 1 334.351 2.880 10 5 EFBEMO Cc1nc(C[C@@H]2CCC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)no1 ZINC000089718273 472493135 /nfs/dbraw/zinc/49/31/35/472493135.db2.gz PADDMFQFGMCHLA-LBPRGKRZSA-N 1 1 334.351 2.880 10 5 EFBEMO COCC[NH2+][C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000058161334 472509767 /nfs/dbraw/zinc/50/97/67/472509767.db2.gz JHWVPWDIWRODSR-QGZVFWFLSA-N 1 1 343.383 2.819 10 5 EFBEMO COC(=O)[C@@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089892685 472535971 /nfs/dbraw/zinc/53/59/71/472535971.db2.gz JLNNBSCXJRWXTB-CYBMUJFWSA-N 1 1 345.355 2.635 10 5 EFBEMO COC(=O)[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089892685 472535975 /nfs/dbraw/zinc/53/59/75/472535975.db2.gz JLNNBSCXJRWXTB-CYBMUJFWSA-N 1 1 345.355 2.635 10 5 EFBEMO CN(C[C@@H]1CC[N@@H+](C)C1)c1ccc(Br)cc1[N+](=O)[O-] 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EFBEMO COc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c1 ZINC000341063777 474933223 /nfs/dbraw/zinc/93/32/23/474933223.db2.gz FCYVOLINCFTIII-BETUJISGSA-N 1 1 335.404 2.596 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000341069231 474939119 /nfs/dbraw/zinc/93/91/19/474939119.db2.gz OKAVDUXSGSPUAS-BETUJISGSA-N 1 1 335.404 2.596 10 5 EFBEMO CCCC[N@@H+](C)C[C@@H](C)Nc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-] ZINC000341127609 475003092 /nfs/dbraw/zinc/00/30/92/475003092.db2.gz TXDNGBKYFTXTJF-GFCCVEGCSA-N 1 1 338.408 2.617 10 5 EFBEMO Cc1cc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)ncn1 ZINC000292544529 475079813 /nfs/dbraw/zinc/07/98/13/475079813.db2.gz QFZHKUKVZQXGPN-UHFFFAOYSA-N 1 1 328.372 2.737 10 5 EFBEMO Cc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2C)nc(N2CCCC2)n1 ZINC000292740816 475177852 /nfs/dbraw/zinc/17/78/52/475177852.db2.gz HIHWWPTXVIVFJI-UHFFFAOYSA-N 1 1 341.415 2.892 10 5 EFBEMO COC(=O)/C=C/c1ccc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])c1 ZINC000296059568 475182827 /nfs/dbraw/zinc/18/28/27/475182827.db2.gz RAEMHKBHODYUHQ-HCAHTGKVSA-N 1 1 345.399 2.818 10 5 EFBEMO COc1cccc(N2C[C@@H]([NH2+]Cc3csc([N+](=O)[O-])c3)CC2=O)c1 ZINC000337761628 475303321 /nfs/dbraw/zinc/30/33/21/475303321.db2.gz WUCJYDPKQCDYRY-LBPRGKRZSA-N 1 1 347.396 2.560 10 5 EFBEMO Cc1c(Br)c(N[C@H]2CC[N@@H+](C(C)C)C2)ncc1[N+](=O)[O-] ZINC000347429981 475312089 /nfs/dbraw/zinc/31/20/89/475312089.db2.gz MPXZORKOEHDAHK-JTQLQIEISA-N 1 1 343.225 2.955 10 5 EFBEMO Cc1c(Br)c(N[C@H]2CC[N@H+](C(C)C)C2)ncc1[N+](=O)[O-] ZINC000347429981 475312097 /nfs/dbraw/zinc/31/20/97/475312097.db2.gz MPXZORKOEHDAHK-JTQLQIEISA-N 1 1 343.225 2.955 10 5 EFBEMO Cc1cc(Cl)c(C(=O)N2[C@H](C)C[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000296642435 475409089 /nfs/dbraw/zinc/40/90/89/475409089.db2.gz WSLQMTZJRHMCEU-PHIMTYICSA-N 1 1 325.796 2.721 10 5 EFBEMO Cc1cc(Cl)c(C(=O)N2[C@H](C)C[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000296642435 475409095 /nfs/dbraw/zinc/40/90/95/475409095.db2.gz WSLQMTZJRHMCEU-PHIMTYICSA-N 1 1 325.796 2.721 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@@H](O)C2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000361420446 475434798 /nfs/dbraw/zinc/43/47/98/475434798.db2.gz NLDAPYLENQNSRR-CYBMUJFWSA-N 1 1 346.330 2.550 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@@H](O)C2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000361420446 475434805 /nfs/dbraw/zinc/43/48/05/475434805.db2.gz NLDAPYLENQNSRR-CYBMUJFWSA-N 1 1 346.330 2.550 10 5 EFBEMO CC1=CC[N@H+](CCNCc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000358149310 475440635 /nfs/dbraw/zinc/44/06/35/475440635.db2.gz YWYNPHOEWHUSGR-UHFFFAOYSA-N 1 1 341.358 2.938 10 5 EFBEMO CC1=CC[N@@H+](CCNCc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000358149310 475440643 /nfs/dbraw/zinc/44/06/43/475440643.db2.gz YWYNPHOEWHUSGR-UHFFFAOYSA-N 1 1 341.358 2.938 10 5 EFBEMO CC[C@@H](NC(=O)NCC[N@@H+]1CC=C(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000358162332 475451576 /nfs/dbraw/zinc/45/15/76/475451576.db2.gz HFDBRMAHUHUXMA-QGZVFWFLSA-N 1 1 346.431 2.997 10 5 EFBEMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@H]1CCCN1c1cccnn1 ZINC000352617521 475462867 /nfs/dbraw/zinc/46/28/67/475462867.db2.gz DTZVUHBFPVOBDN-OAHLLOKOSA-N 1 1 345.378 2.625 10 5 EFBEMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@H]1CCCN1c1cccnn1 ZINC000352617521 475462873 /nfs/dbraw/zinc/46/28/73/475462873.db2.gz DTZVUHBFPVOBDN-OAHLLOKOSA-N 1 1 345.378 2.625 10 5 EFBEMO Cc1ccc([C@@H](C)NC(=O)NCC[N@@H+]2CC=C(C)CC2)cc1[N+](=O)[O-] ZINC000358188719 475471688 /nfs/dbraw/zinc/47/16/88/475471688.db2.gz LNEUYSPETFGNQO-OAHLLOKOSA-N 1 1 346.431 2.915 10 5 EFBEMO CC1=CC[N@@H+](CCNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000358192292 475476115 /nfs/dbraw/zinc/47/61/15/475476115.db2.gz PLKNFPXGPJMKJL-CQSZACIVSA-N 1 1 332.404 2.607 10 5 EFBEMO CC[C@@H](NC(=O)[C@@H]1CCCc2[nH+]ccn21)c1cccc([N+](=O)[O-])c1 ZINC000354910752 475511191 /nfs/dbraw/zinc/51/11/91/475511191.db2.gz CMHAFDBRPOTWBR-CABCVRRESA-N 1 1 328.372 2.936 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCCC[C@H]3CCO)n2)cc1 ZINC000342071453 475547577 /nfs/dbraw/zinc/54/75/77/475547577.db2.gz XSKMFASVMPRZHQ-AWEZNQCLSA-N 1 1 346.387 2.772 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000355128564 475686596 /nfs/dbraw/zinc/68/65/96/475686596.db2.gz CNZDIPSFDVJJGZ-OCCSQVGLSA-N 1 1 336.388 2.613 10 5 EFBEMO C[C@H](NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000297457539 475764645 /nfs/dbraw/zinc/76/46/45/475764645.db2.gz CCBXPMSVNNMFJX-HEHGZKQESA-N 1 1 334.420 2.780 10 5 EFBEMO CN(C(=O)C(C)(C)c1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000340188180 475839147 /nfs/dbraw/zinc/83/91/47/475839147.db2.gz DSPUCRVQEFJITH-AWEZNQCLSA-N 1 1 331.416 2.568 10 5 EFBEMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000297877241 475911520 /nfs/dbraw/zinc/91/15/20/475911520.db2.gz RFSIYWMZCBKUON-AOOOYVTPSA-N 1 1 345.321 2.778 10 5 EFBEMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000297877241 475911528 /nfs/dbraw/zinc/91/15/28/475911528.db2.gz RFSIYWMZCBKUON-AOOOYVTPSA-N 1 1 345.321 2.778 10 5 EFBEMO O=[N+]([O-])c1cnn(CC[NH+]2CC(c3nc4ccccc4s3)C2)c1 ZINC000358813867 475960331 /nfs/dbraw/zinc/96/03/31/475960331.db2.gz OJJVZBOTGIJEFB-UHFFFAOYSA-N 1 1 329.385 2.500 10 5 EFBEMO Cc1ccc(C[N@H+]2CCC[C@H](C(=O)N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000353578890 476094548 /nfs/dbraw/zinc/09/45/48/476094548.db2.gz VEGGOBWCBSBPOF-INIZCTEOSA-N 1 1 331.416 2.738 10 5 EFBEMO Cn1ccnc1[C@H]([NH2+]CC1(CCO)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000353629379 476137290 /nfs/dbraw/zinc/13/72/90/476137290.db2.gz FOUUPKJBKXYBEI-MRXNPFEDSA-N 1 1 344.415 2.560 10 5 EFBEMO Cn1ccnc1[C@@H]([NH2+]CC1(CCO)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000353629378 476137312 /nfs/dbraw/zinc/13/73/12/476137312.db2.gz FOUUPKJBKXYBEI-INIZCTEOSA-N 1 1 344.415 2.560 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c([N+](=O)[O-])cc1F ZINC000362312846 476161742 /nfs/dbraw/zinc/16/17/42/476161742.db2.gz BDCNQQHCAOAJIS-OLZOCXBDSA-N 1 1 338.379 2.991 10 5 EFBEMO CO[C@@H]1CC[C@H]([NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000353668089 476171767 /nfs/dbraw/zinc/17/17/67/476171767.db2.gz FPNDNGOXOOBXMP-NUEKZKHPSA-N 1 1 330.388 2.575 10 5 EFBEMO CO[C@@H]1CC[C@H]([NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000353668088 476172375 /nfs/dbraw/zinc/17/23/75/476172375.db2.gz FPNDNGOXOOBXMP-IMJJTQAJSA-N 1 1 330.388 2.575 10 5 EFBEMO C[C@@H]1C[C@H](N(C)C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000340660243 476186632 /nfs/dbraw/zinc/18/66/32/476186632.db2.gz IVMAFYNPKOVCAQ-ZIAGYGMSSA-N 1 1 333.432 2.814 10 5 EFBEMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000357077815 476211416 /nfs/dbraw/zinc/21/14/16/476211416.db2.gz XLHSPWZZNMCNTH-KSSFIOAISA-N 1 1 347.415 2.814 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000362454431 476263366 /nfs/dbraw/zinc/26/33/66/476263366.db2.gz QIGNRNFCYLTCTG-YOEHRIQHSA-N 1 1 347.415 2.733 10 5 EFBEMO COC(=O)c1cc(N2CCC3(CCC[N@H+]3C)CC2)cc(C)c1[N+](=O)[O-] ZINC000368880692 476377737 /nfs/dbraw/zinc/37/77/37/476377737.db2.gz AOIDODXGIHRPLF-UHFFFAOYSA-N 1 1 347.415 2.754 10 5 EFBEMO C[N@H+]1CCC[C@@H](CNc2ccncc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000360992150 476529168 /nfs/dbraw/zinc/52/91/68/476529168.db2.gz ZYEYNCHKBUAXQS-LRDDRELGSA-N 1 1 332.429 2.968 10 5 EFBEMO C[C@]1(c2ccc(F)cc2)CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000369864092 476562310 /nfs/dbraw/zinc/56/23/10/476562310.db2.gz NOVAVANUVXJGSO-SFHVURJKSA-N 1 1 345.374 2.559 10 5 EFBEMO COc1ccc(OC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000377947310 476651889 /nfs/dbraw/zinc/65/18/89/476651889.db2.gz JQCQLEUWQHJHKI-INIZCTEOSA-N 1 1 340.351 2.721 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)s2)C[C@H]1C ZINC000354424302 476654356 /nfs/dbraw/zinc/65/43/56/476654356.db2.gz IYDKRBNVRNMNTP-PWSUYJOCSA-N 1 1 325.434 2.910 10 5 EFBEMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])o1 ZINC000363348483 476661701 /nfs/dbraw/zinc/66/17/01/476661701.db2.gz HVFAFTPZTRORLG-AWEZNQCLSA-N 1 1 343.383 2.924 10 5 EFBEMO Cc1ccccc1[C@@]1(F)CC[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000370150254 476679774 /nfs/dbraw/zinc/67/97/74/476679774.db2.gz QYJSUENHUUTCDN-GOSISDBHSA-N 1 1 345.374 2.636 10 5 EFBEMO Cc1ccccc1[C@@]1(F)CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000370150254 476679779 /nfs/dbraw/zinc/67/97/79/476679779.db2.gz QYJSUENHUUTCDN-GOSISDBHSA-N 1 1 345.374 2.636 10 5 EFBEMO O=C1C[C@H]([C@H]2CCCC[N@@H+]2Cc2ccc(Cl)cc2[N+](=O)[O-])CN1 ZINC000378322935 476693248 /nfs/dbraw/zinc/69/32/48/476693248.db2.gz YILVZTLPAVQDGJ-GXTWGEPZSA-N 1 1 337.807 2.739 10 5 EFBEMO Cc1noc(C)c1CO[C@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000375171595 476701481 /nfs/dbraw/zinc/70/14/81/476701481.db2.gz QBOSIHXUYOXQSK-HNNXBMFYSA-N 1 1 331.372 2.991 10 5 EFBEMO Cc1noc(C)c1CO[C@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000375171595 476701487 /nfs/dbraw/zinc/70/14/87/476701487.db2.gz QBOSIHXUYOXQSK-HNNXBMFYSA-N 1 1 331.372 2.991 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H](c4ccncn4)C3)nc2c1 ZINC000370236504 476715152 /nfs/dbraw/zinc/71/51/52/476715152.db2.gz PAQPTHQBRPQKKR-LBPRGKRZSA-N 1 1 339.355 2.906 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H](c4ccncn4)C3)nc2c1 ZINC000370236504 476715162 /nfs/dbraw/zinc/71/51/62/476715162.db2.gz PAQPTHQBRPQKKR-LBPRGKRZSA-N 1 1 339.355 2.906 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@]4(CCOC4)C3)n2)c1 ZINC000451909426 476719391 /nfs/dbraw/zinc/71/93/91/476719391.db2.gz ZOGJRAPAYAWIIG-QGZVFWFLSA-N 1 1 344.371 2.647 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@]4(CCOC4)C3)n2)c1 ZINC000451909426 476719397 /nfs/dbraw/zinc/71/93/97/476719397.db2.gz ZOGJRAPAYAWIIG-QGZVFWFLSA-N 1 1 344.371 2.647 10 5 EFBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC2(CCOCC2)[C@H]1C ZINC000375240013 476733431 /nfs/dbraw/zinc/73/34/31/476733431.db2.gz HFSNIROPFXUPCR-UONOGXRCSA-N 1 1 347.415 2.813 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000375281683 476755893 /nfs/dbraw/zinc/75/58/93/476755893.db2.gz WEAWKOXLOXZYTF-SFHVURJKSA-N 1 1 347.415 2.734 10 5 EFBEMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000370396854 476789786 /nfs/dbraw/zinc/78/97/86/476789786.db2.gz RUAICZORYGGDEN-LJQANCHMSA-N 1 1 339.395 2.857 10 5 EFBEMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC(C)=C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000430283305 476802526 /nfs/dbraw/zinc/80/25/26/476802526.db2.gz JAXDNOCKEFGBIZ-YPMHNXCESA-N 1 1 333.388 2.828 10 5 EFBEMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC(C)=C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000430283305 476802536 /nfs/dbraw/zinc/80/25/36/476802536.db2.gz JAXDNOCKEFGBIZ-YPMHNXCESA-N 1 1 333.388 2.828 10 5 EFBEMO Cc1ccc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000456986850 476817831 /nfs/dbraw/zinc/81/78/31/476817831.db2.gz JMKDZPIFMYTQTL-MRXNPFEDSA-N 1 1 325.368 2.690 10 5 EFBEMO Cc1ccc(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000456986849 476818676 /nfs/dbraw/zinc/81/86/76/476818676.db2.gz JMKDZPIFMYTQTL-INIZCTEOSA-N 1 1 325.368 2.690 10 5 EFBEMO Cc1cc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000456991183 476821179 /nfs/dbraw/zinc/82/11/79/476821179.db2.gz LYKGIWBMLKCKEB-QGZVFWFLSA-N 1 1 325.368 2.690 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)O[C@@H](C)[C@H]1C ZINC000446081658 476824301 /nfs/dbraw/zinc/82/43/01/476824301.db2.gz WESDADANFMYGLJ-MJBXVCDLSA-N 1 1 335.404 2.730 10 5 EFBEMO COC[C@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000452105095 476826809 /nfs/dbraw/zinc/82/68/09/476826809.db2.gz OVPYYHDDVNRUEI-AWEZNQCLSA-N 1 1 335.404 2.672 10 5 EFBEMO COC(=O)c1cc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc(C)c1[N+](=O)[O-] ZINC000370539640 476862348 /nfs/dbraw/zinc/86/23/48/476862348.db2.gz NJAJTOHTMOBUOK-JSGCOSHPSA-N 1 1 333.388 2.729 10 5 EFBEMO CCOc1ccc(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000457077345 476862435 /nfs/dbraw/zinc/86/24/35/476862435.db2.gz CHWVPDXFLAEULI-CQSZACIVSA-N 1 1 335.404 2.548 10 5 EFBEMO COC(=O)COc1ccc(C[N@@H+]2CC(C)=C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000430877232 476929505 /nfs/dbraw/zinc/92/95/05/476929505.db2.gz WAHSIUYSBPULST-GFCCVEGCSA-N 1 1 334.372 2.545 10 5 EFBEMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@H]([NH3+])c1ccccc1 ZINC000423237001 476972870 /nfs/dbraw/zinc/97/28/70/476972870.db2.gz HTRIOZXQOHPGCU-DYVFJYSZSA-N 1 1 342.399 2.602 10 5 EFBEMO C[NH+](C)CCOCCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000447590835 477018554 /nfs/dbraw/zinc/01/85/54/477018554.db2.gz FSNKFIJILKMUQP-LJQANCHMSA-N 1 1 343.427 2.852 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NC[C@@H]1CCC[N@H+]1C ZINC000447816150 477065525 /nfs/dbraw/zinc/06/55/25/477065525.db2.gz IZKOJGQCIXMWHZ-VIFPVBQESA-N 1 1 327.768 2.541 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](c2ccncn2)C1 ZINC000366617657 477099182 /nfs/dbraw/zinc/09/91/82/477099182.db2.gz LEWCYZYIIWAWNA-ZDUSSCGKSA-N 1 1 328.372 2.773 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)cn1 ZINC000432944787 477292033 /nfs/dbraw/zinc/29/20/33/477292033.db2.gz UZBCRLLOOSYPMJ-UHFFFAOYSA-N 1 1 327.388 2.907 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@]3(C2)CCCOC3)cccc1[N+](=O)[O-] ZINC000367067472 477325535 /nfs/dbraw/zinc/32/55/35/477325535.db2.gz NFOAQBGTKCINGG-SFHVURJKSA-N 1 1 347.415 2.734 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCO[C@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000411848347 477391374 /nfs/dbraw/zinc/39/13/74/477391374.db2.gz NDVZTIHHHWTQDR-KRWDZBQOSA-N 1 1 347.415 2.733 10 5 EFBEMO CC(C)[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1CCC(=O)N1 ZINC000412095499 477410466 /nfs/dbraw/zinc/41/04/66/477410466.db2.gz XTAIXDPHDGIAGK-ZDUSSCGKSA-N 1 1 325.796 2.737 10 5 EFBEMO COC(=O)[C@@H]1CSCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000412087488 477411040 /nfs/dbraw/zinc/41/10/40/477411040.db2.gz VWUSIFLJQFBISI-NSHDSACASA-N 1 1 344.820 2.586 10 5 EFBEMO COC(=O)[C@@H]1CSCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000412087488 477411046 /nfs/dbraw/zinc/41/10/46/477411046.db2.gz VWUSIFLJQFBISI-NSHDSACASA-N 1 1 344.820 2.586 10 5 EFBEMO O=[N+]([O-])c1ccc(NCc2ccccc2C[N@@H+]2CCC[C@H]2CO)cn1 ZINC000436344128 477466769 /nfs/dbraw/zinc/46/67/69/477466769.db2.gz WVRKHNHPJABQBK-KRWDZBQOSA-N 1 1 342.399 2.559 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)C1CC1 ZINC000368102145 477784775 /nfs/dbraw/zinc/78/47/75/477784775.db2.gz MOTOWCXAODOPED-ZBFHGGJFSA-N 1 1 326.400 2.786 10 5 EFBEMO CCOc1ccc(NC(=O)C[N@H+]2CC[C@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000438479758 477849736 /nfs/dbraw/zinc/84/97/36/477849736.db2.gz CRXHJVRRSBNKMC-ZDUSSCGKSA-N 1 1 335.404 2.910 10 5 EFBEMO O=C(C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O)Nc1ccccc1[N+](=O)[O-] ZINC000451350866 477968955 /nfs/dbraw/zinc/96/89/55/477968955.db2.gz ZYHNTRPWCKILSG-UNEWFSDZSA-N 1 1 347.415 2.549 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H]2[C@@H]3C=C[C@@H](C3)[C@]2(C)C1 ZINC000451358113 477972132 /nfs/dbraw/zinc/97/21/32/477972132.db2.gz BDELWOWZLFMWLM-QZNHQWIBSA-N 1 1 341.411 2.986 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@](O)(CO)C3)s2)cc1 ZINC000459664334 478029437 /nfs/dbraw/zinc/02/94/37/478029437.db2.gz AYJBHVNKIQYOKR-QGZVFWFLSA-N 1 1 348.424 2.643 10 5 EFBEMO C[C@@H]1C[N@@H+](CCN(C)c2c3ccccc3ncc2[N+](=O)[O-])C[C@H](C)O1 ZINC000487767061 478071189 /nfs/dbraw/zinc/07/11/89/478071189.db2.gz FZMWSSIAQBCEMY-OKILXGFUSA-N 1 1 344.415 2.688 10 5 EFBEMO C[C@@H]1C[N@H+](CCN(C)c2c3ccccc3ncc2[N+](=O)[O-])C[C@H](C)O1 ZINC000487767061 478071197 /nfs/dbraw/zinc/07/11/97/478071197.db2.gz FZMWSSIAQBCEMY-OKILXGFUSA-N 1 1 344.415 2.688 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441281247 478204196 /nfs/dbraw/zinc/20/41/96/478204196.db2.gz TWLWQCYEFOSCGR-RBSFLKMASA-N 1 1 347.415 2.670 10 5 EFBEMO C[N@H+]1CCC[C@H](NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000590808388 478349267 /nfs/dbraw/zinc/34/92/67/478349267.db2.gz OFLCPFWSEZOVRT-CVEARBPZSA-N 1 1 346.431 2.578 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000600469415 478383118 /nfs/dbraw/zinc/38/31/18/478383118.db2.gz BABPMEKTOLTMQM-ZDUSSCGKSA-N 1 1 337.807 2.995 10 5 EFBEMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000597576376 478417595 /nfs/dbraw/zinc/41/75/95/478417595.db2.gz BUTSQSQFBGEGCP-UONOGXRCSA-N 1 1 347.346 2.599 10 5 EFBEMO CC(C)(C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000597581825 478419851 /nfs/dbraw/zinc/41/98/51/478419851.db2.gz RKDYZJKWBVLYRH-HZPDHXFCSA-N 1 1 349.406 2.517 10 5 EFBEMO CCc1ccc([C@H]([NH2+]C[C@](C)(CO)OC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000594511774 478420421 /nfs/dbraw/zinc/42/04/21/478420421.db2.gz OOCRQAFSQHXIGA-QZTJIDSGSA-N 1 1 348.399 2.827 10 5 EFBEMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000591004694 478429827 /nfs/dbraw/zinc/42/98/27/478429827.db2.gz PVYKZSBTVWKHGO-GFCCVEGCSA-N 1 1 325.796 2.723 10 5 EFBEMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000591004694 478429820 /nfs/dbraw/zinc/42/98/20/478429820.db2.gz PVYKZSBTVWKHGO-GFCCVEGCSA-N 1 1 325.796 2.723 10 5 EFBEMO COc1cccc([N+](=O)[O-])c1N1CC[NH+](Cc2cccs2)CC1 ZINC000594543767 478431230 /nfs/dbraw/zinc/43/12/30/478431230.db2.gz RAFWEFWGTFHNGY-UHFFFAOYSA-N 1 1 333.413 2.987 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1 ZINC000594596548 478455886 /nfs/dbraw/zinc/45/58/86/478455886.db2.gz AOCVVFYDKBPKJJ-HIFRSBDPSA-N 1 1 333.388 2.810 10 5 EFBEMO C[N@@H+]1CCO[C@@H](CSc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000582000597 478487173 /nfs/dbraw/zinc/48/71/73/478487173.db2.gz SOWZOFIMBNPEQJ-SECBINFHSA-N 1 1 334.344 2.619 10 5 EFBEMO C[N@H+]1CCO[C@@H](CSc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000582000597 478487182 /nfs/dbraw/zinc/48/71/82/478487182.db2.gz SOWZOFIMBNPEQJ-SECBINFHSA-N 1 1 334.344 2.619 10 5 EFBEMO C[C@H]([NH3+])c1ccc(CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000591275482 478504747 /nfs/dbraw/zinc/50/47/47/478504747.db2.gz GQJIEWVHVYTFPV-LBPRGKRZSA-N 1 1 343.383 2.676 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000597857317 478543768 /nfs/dbraw/zinc/54/37/68/478543768.db2.gz DDIMQXCVDRQZPY-MRXNPFEDSA-N 1 1 348.447 2.776 10 5 EFBEMO CSc1cccc(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)c1[N+](=O)[O-] ZINC000597859035 478543913 /nfs/dbraw/zinc/54/39/13/478543913.db2.gz QGAWVKXYLZMEBX-NSHDSACASA-N 1 1 337.445 2.919 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000597859266 478545233 /nfs/dbraw/zinc/54/52/33/478545233.db2.gz SMOKNSXWOZYCHV-NSHDSACASA-N 1 1 325.796 2.851 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000597859648 478545702 /nfs/dbraw/zinc/54/57/02/478545702.db2.gz WXYWPOYVSAAOQJ-LBPRGKRZSA-N 1 1 342.399 2.746 10 5 EFBEMO CCN(C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](C)C1 ZINC000597947170 478590911 /nfs/dbraw/zinc/59/09/11/478590911.db2.gz UQYNJUACXPDSGZ-JSGCOSHPSA-N 1 1 337.445 2.628 10 5 EFBEMO COc1ccc(C[NH2+]Cc2cnc(C(F)(F)F)nc2)cc1[N+](=O)[O-] ZINC000594950130 478600125 /nfs/dbraw/zinc/60/01/25/478600125.db2.gz IZNICODFUIMARF-UHFFFAOYSA-N 1 1 342.277 2.702 10 5 EFBEMO CC[N@H+]1CCC[C@@H](CNC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000601021164 478618242 /nfs/dbraw/zinc/61/82/42/478618242.db2.gz SMPWCNVYCBEDQZ-HNNXBMFYSA-N 1 1 345.443 2.865 10 5 EFBEMO CCOc1ccc(NCc2cc3c(cc2[N+](=O)[O-])OCCO3)[nH+]c1C ZINC000595001166 478623784 /nfs/dbraw/zinc/62/37/84/478623784.db2.gz RKNRDXVPKAGLFJ-UHFFFAOYSA-N 1 1 345.355 2.502 10 5 EFBEMO CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@@H+](CC)C1 ZINC000598040684 478629139 /nfs/dbraw/zinc/62/91/39/478629139.db2.gz QIWGGBPDUYSRRD-AWEZNQCLSA-N 1 1 339.823 2.733 10 5 EFBEMO C[C@H]1CC[N@@H+](CC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000582556044 478629982 /nfs/dbraw/zinc/62/99/82/478629982.db2.gz KJADJFQHBJTWQY-GOEBONIOSA-N 1 1 331.416 2.643 10 5 EFBEMO CCN(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1 ZINC000598043782 478630638 /nfs/dbraw/zinc/63/06/38/478630638.db2.gz UZYVWCAQMJUSPL-LBPRGKRZSA-N 1 1 325.796 2.805 10 5 EFBEMO CCN(C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1CC[N@@H+](CC)C1 ZINC000598044163 478630791 /nfs/dbraw/zinc/63/07/91/478630791.db2.gz YVIREOPUTDZZGE-ZDUSSCGKSA-N 1 1 330.388 2.632 10 5 EFBEMO C[C@H]1C[C@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC[N@H+]1C ZINC000582585117 478635181 /nfs/dbraw/zinc/63/51/81/478635181.db2.gz CTAITBNREMAQBJ-UONOGXRCSA-N 1 1 349.434 2.894 10 5 EFBEMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000582625042 478644924 /nfs/dbraw/zinc/64/49/24/478644924.db2.gz IFCROIQTERKSNG-HNNXBMFYSA-N 1 1 349.431 2.615 10 5 EFBEMO CCO[C@H]1C[C@H]([NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000595067188 478649278 /nfs/dbraw/zinc/64/92/78/478649278.db2.gz MAJQMDFEMMEVDH-BPUTZDHNSA-N 1 1 330.388 2.575 10 5 EFBEMO O=[N+]([O-])c1cc(F)cnc1N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000601101278 478656599 /nfs/dbraw/zinc/65/65/99/478656599.db2.gz JYTGEUXPFOPHBN-UHFFFAOYSA-N 1 1 348.353 2.980 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNc1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601104756 478658716 /nfs/dbraw/zinc/65/87/16/478658716.db2.gz FZZUHYHZWRIZKX-VIFPVBQESA-N 1 1 335.330 2.633 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)[C@H](C)C1 ZINC000601119818 478667423 /nfs/dbraw/zinc/66/74/23/478667423.db2.gz WSLJQEFEVXAIJK-NXEZZACHSA-N 1 1 349.357 2.514 10 5 EFBEMO Cc1[nH+]ccn1CCCCNc1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601119261 478667499 /nfs/dbraw/zinc/66/74/99/478667499.db2.gz PQZZSRFRCTXYRY-UHFFFAOYSA-N 1 1 346.313 2.744 10 5 EFBEMO CC(C)C[N@H+]1CC[C@@H](CNc2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC000601129319 478674677 /nfs/dbraw/zinc/67/46/77/478674677.db2.gz QDHYQGGQNOSUKD-JTQLQIEISA-N 1 1 349.357 2.737 10 5 EFBEMO COc1ccc(OC)c(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c1 ZINC000601149388 478689037 /nfs/dbraw/zinc/68/90/37/478689037.db2.gz MVVRCFIQWCOJHP-GOSISDBHSA-N 1 1 346.383 2.609 10 5 EFBEMO Cc1cccc2ncc(C[NH2+][C@@](C)(CO)c3cccc([N+](=O)[O-])c3)n21 ZINC000601150280 478689112 /nfs/dbraw/zinc/68/91/12/478689112.db2.gz UXMYRKKSHFWIKJ-SFHVURJKSA-N 1 1 340.383 2.548 10 5 EFBEMO COc1ccc(OC)c(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c1 ZINC000601149389 478689770 /nfs/dbraw/zinc/68/97/70/478689770.db2.gz MVVRCFIQWCOJHP-SFHVURJKSA-N 1 1 346.383 2.609 10 5 EFBEMO COc1cccc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c1F ZINC000601149065 478690030 /nfs/dbraw/zinc/69/00/30/478690030.db2.gz IGSBZAAENJOTGO-QGZVFWFLSA-N 1 1 334.347 2.740 10 5 EFBEMO Cn1nc2c(c1CNc1cc[nH+]c3ccc([N+](=O)[O-])cc13)CCCC2 ZINC000601167070 478702354 /nfs/dbraw/zinc/70/23/54/478702354.db2.gz ZBPPWKFJNVWXNB-UHFFFAOYSA-N 1 1 337.383 2.789 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NC[C@@H]1CC[N@H+]1C(C)(C)C ZINC000601191677 478715953 /nfs/dbraw/zinc/71/59/53/478715953.db2.gz PKHCICDLLSILMT-QMMMGPOBSA-N 1 1 335.330 2.632 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@@H]1CC[N@H+](C(C)(C)C)C1 ZINC000601191615 478716402 /nfs/dbraw/zinc/71/64/02/478716402.db2.gz OBAHXJTWSPOOLJ-MRVPVSSYSA-N 1 1 335.330 2.632 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3C[C@@H](CO)[C@H](C(F)(F)F)C3)c2c1 ZINC000601234357 478738517 /nfs/dbraw/zinc/73/85/17/478738517.db2.gz BJROVWBFRNAVGN-JOYOIKCWSA-N 1 1 341.289 2.750 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)c2ccc([N+](=O)[O-])c(OC(C)C)n2)[C@@H](C)C1 ZINC000564469340 478747863 /nfs/dbraw/zinc/74/78/63/478747863.db2.gz CZEAGSGRXMZDQF-UONOGXRCSA-N 1 1 336.436 2.944 10 5 EFBEMO COc1cccc([N+](=O)[O-])c1N1CC[NH+](Cc2ccc(O)cc2)CC1 ZINC000601256687 478750428 /nfs/dbraw/zinc/75/04/28/478750428.db2.gz FIXKUKDYAABSPS-UHFFFAOYSA-N 1 1 343.383 2.631 10 5 EFBEMO C[C@H](NC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1)C1=CC[N@@H+](C)CC1 ZINC000601421978 478828967 /nfs/dbraw/zinc/82/89/67/478828967.db2.gz NNVVHEHBGOZEFZ-AWEZNQCLSA-N 1 1 343.427 2.783 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000598464846 478836420 /nfs/dbraw/zinc/83/64/20/478836420.db2.gz JQOIEDCQQHEBOY-UHFFFAOYSA-N 1 1 343.374 2.652 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000598466731 478837491 /nfs/dbraw/zinc/83/74/91/478837491.db2.gz YQHPJHRLKDGEAS-UHFFFAOYSA-N 1 1 325.384 2.513 10 5 EFBEMO CN(CC[N@@H+](C)C1CC1)C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601457169 478842417 /nfs/dbraw/zinc/84/24/17/478842417.db2.gz LLJDEYRFJDWXLX-UHFFFAOYSA-N 1 1 331.416 2.569 10 5 EFBEMO O=[N+]([O-])c1cc2c(nc1N1CCC(c3[nH]cc[nH+]3)CC1)CCCC2 ZINC000564892321 478850350 /nfs/dbraw/zinc/85/03/50/478850350.db2.gz INMYXMASPRBZAM-UHFFFAOYSA-N 1 1 327.388 2.976 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1CSC[C@H]1C[N@H+](C)CCO1 ZINC000564957945 478868045 /nfs/dbraw/zinc/86/80/45/478868045.db2.gz IYUAPYFOIZHXOE-OAHLLOKOSA-N 1 1 340.445 2.946 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1CSC[C@H]1C[N@@H+](C)CCO1 ZINC000564957945 478868052 /nfs/dbraw/zinc/86/80/52/478868052.db2.gz IYUAPYFOIZHXOE-OAHLLOKOSA-N 1 1 340.445 2.946 10 5 EFBEMO O=C(C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1)N1CCCC1 ZINC000505563921 478874810 /nfs/dbraw/zinc/87/48/10/478874810.db2.gz JWASWAUCHHPPDO-UHFFFAOYSA-N 1 1 335.379 2.568 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@](C)(C2CC2)C1 ZINC000595625444 478897262 /nfs/dbraw/zinc/89/72/62/478897262.db2.gz MTVRECJAZWHXGP-SFHVURJKSA-N 1 1 347.415 2.733 10 5 EFBEMO CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCc2ccccc21 ZINC000595636381 478907058 /nfs/dbraw/zinc/90/70/58/478907058.db2.gz XXTMDTWSIILRPI-UHFFFAOYSA-N 1 1 341.411 2.592 10 5 EFBEMO COc1ncncc1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000592514188 478923802 /nfs/dbraw/zinc/92/38/02/478923802.db2.gz DCFGKUGOVAURMI-AWEZNQCLSA-N 1 1 328.372 2.773 10 5 EFBEMO COc1ncncc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000592514188 478923806 /nfs/dbraw/zinc/92/38/06/478923806.db2.gz DCFGKUGOVAURMI-AWEZNQCLSA-N 1 1 328.372 2.773 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@]2(C)COC[C@]2(C)C1 ZINC000595687837 478936989 /nfs/dbraw/zinc/93/69/89/478936989.db2.gz CRCAUVJJVYMUPB-HDICACEKSA-N 1 1 347.415 2.590 10 5 EFBEMO O=C(C[N@H+]1CCC[C@H](CCF)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595755065 478978383 /nfs/dbraw/zinc/97/83/83/478978383.db2.gz FQABIVOWEQNGPT-CYBMUJFWSA-N 1 1 335.379 2.556 10 5 EFBEMO C[C@@]12COC[C@H]1C[N@@H+](Cc1coc(-c3ccc([N+](=O)[O-])cc3)n1)C2 ZINC000595760221 478979929 /nfs/dbraw/zinc/97/99/29/478979929.db2.gz SLMZKXGURFZTBE-CXAGYDPISA-N 1 1 329.356 2.718 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@H]2COC[C@]2(C)C1 ZINC000595761488 478981923 /nfs/dbraw/zinc/98/19/23/478981923.db2.gz XABNGNACGREXBQ-ZUCKAHLUSA-N 1 1 344.371 2.674 10 5 EFBEMO O=C(N[C@H]1CC[N@@H+](C2CC2)C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000573067148 478982573 /nfs/dbraw/zinc/98/25/73/478982573.db2.gz COACEJDLSORLAR-ZDUSSCGKSA-N 1 1 347.418 2.648 10 5 EFBEMO O=C(N[C@H]1CC[N@H+](C2CC2)C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000573067148 478982576 /nfs/dbraw/zinc/98/25/76/478982576.db2.gz COACEJDLSORLAR-ZDUSSCGKSA-N 1 1 347.418 2.648 10 5 EFBEMO C[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H](C)O1 ZINC000595779567 478992112 /nfs/dbraw/zinc/99/21/12/478992112.db2.gz DICUQXAEUPDALM-NEPJUHHUSA-N 1 1 332.360 2.644 10 5 EFBEMO C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H](C)O1 ZINC000595779567 478992118 /nfs/dbraw/zinc/99/21/18/478992118.db2.gz DICUQXAEUPDALM-NEPJUHHUSA-N 1 1 332.360 2.644 10 5 EFBEMO C[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC000595780706 478993545 /nfs/dbraw/zinc/99/35/45/478993545.db2.gz LEKAUHLKYGLWGT-NEPJUHHUSA-N 1 1 332.360 2.644 10 5 EFBEMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC000595780706 478993553 /nfs/dbraw/zinc/99/35/53/478993553.db2.gz LEKAUHLKYGLWGT-NEPJUHHUSA-N 1 1 332.360 2.644 10 5 EFBEMO CO[C@H]1C[C@@H](CN(C)c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[N@@H+](C)C1 ZINC000584011241 478993855 /nfs/dbraw/zinc/99/38/55/478993855.db2.gz FQFFADRSXUDDDX-RYUDHWBXSA-N 1 1 347.337 2.769 10 5 EFBEMO C[C@@H]1COC2(CCCC2)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000595805703 479008178 /nfs/dbraw/zinc/00/81/78/479008178.db2.gz BCBQMKOPXNYXGV-CQSZACIVSA-N 1 1 347.415 2.957 10 5 EFBEMO COC(=O)[C@H]1C[C@@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000595848822 479030657 /nfs/dbraw/zinc/03/06/57/479030657.db2.gz ROGSJSANBXQZSQ-JNSHFYNHSA-N 1 1 336.388 2.765 10 5 EFBEMO COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000595848822 479030664 /nfs/dbraw/zinc/03/06/64/479030664.db2.gz ROGSJSANBXQZSQ-JNSHFYNHSA-N 1 1 336.388 2.765 10 5 EFBEMO COC(=O)[C@H]1C[C@@H]([N@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000595851544 479032361 /nfs/dbraw/zinc/03/23/61/479032361.db2.gz YNARAKYPQBHJDI-JNSHFYNHSA-N 1 1 345.355 2.633 10 5 EFBEMO COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000595851544 479032370 /nfs/dbraw/zinc/03/23/70/479032370.db2.gz YNARAKYPQBHJDI-JNSHFYNHSA-N 1 1 345.355 2.633 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000592780278 479040779 /nfs/dbraw/zinc/04/07/79/479040779.db2.gz ZQCZOCADTPRAMZ-ZDUSSCGKSA-N 1 1 330.388 2.664 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000592785225 479043565 /nfs/dbraw/zinc/04/35/65/479043565.db2.gz JLXHWJSTMGOOOJ-NSHDSACASA-N 1 1 332.360 2.952 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl ZINC000596049275 479107444 /nfs/dbraw/zinc/10/74/44/479107444.db2.gz IIZGTQUCCHIQIH-JTQLQIEISA-N 1 1 341.795 2.931 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1c(C(F)(F)F)cnn1C ZINC000598989891 479115943 /nfs/dbraw/zinc/11/59/43/479115943.db2.gz UKUXUENMUSYWBN-UHFFFAOYSA-N 1 1 328.294 2.945 10 5 EFBEMO COC(=O)c1c(Cl)c(NCC[N@@H+](C)C2CC2)ccc1[N+](=O)[O-] ZINC000596087814 479130149 /nfs/dbraw/zinc/13/01/49/479130149.db2.gz JABNHJDMKIJZMI-UHFFFAOYSA-N 1 1 327.768 2.541 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]([C@@H](C)CO)C2CCCC2)c1 ZINC000593025397 479130625 /nfs/dbraw/zinc/13/06/25/479130625.db2.gz RYPDPNUFKPURPV-LBPRGKRZSA-N 1 1 336.388 2.507 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(Cn2c[nH+]c3c2C[C@H](C)[C@@H](C)C3)c1 ZINC000593031740 479134993 /nfs/dbraw/zinc/13/49/93/479134993.db2.gz LRSWQDQBMQJRLI-RYUDHWBXSA-N 1 1 343.383 2.997 10 5 EFBEMO Cn1ccnc1[C@H]([NH2+]CC[C@H]1CCCOC1)c1cccc([N+](=O)[O-])c1 ZINC000599057417 479142928 /nfs/dbraw/zinc/14/29/28/479142928.db2.gz OXCDXRUXHHAAAM-RHSMWYFYSA-N 1 1 344.415 2.824 10 5 EFBEMO Cn1ccnc1[C@@H]([NH2+]CC[C@H]1CCCOC1)c1cccc([N+](=O)[O-])c1 ZINC000599057416 479143208 /nfs/dbraw/zinc/14/32/08/479143208.db2.gz OXCDXRUXHHAAAM-PBHICJAKSA-N 1 1 344.415 2.824 10 5 EFBEMO CC[N@@H+](CCNc1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl)C1CC1 ZINC000596109238 479143536 /nfs/dbraw/zinc/14/35/36/479143536.db2.gz MPZZFOTUZXWKJG-UHFFFAOYSA-N 1 1 341.795 2.931 10 5 EFBEMO CC[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)CC1 ZINC000596120491 479150282 /nfs/dbraw/zinc/15/02/82/479150282.db2.gz RHCOXAGBFLBMQT-UHFFFAOYSA-N 1 1 341.795 2.567 10 5 EFBEMO CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCCOC1 ZINC000593066822 479154327 /nfs/dbraw/zinc/15/43/27/479154327.db2.gz GELNMBMRJRAEFE-AWEZNQCLSA-N 1 1 332.360 2.646 10 5 EFBEMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCCOC1 ZINC000593066822 479154336 /nfs/dbraw/zinc/15/43/36/479154336.db2.gz GELNMBMRJRAEFE-AWEZNQCLSA-N 1 1 332.360 2.646 10 5 EFBEMO C[C@@H]1C[N@H+](CCNc2ccc3cnccc3c2[N+](=O)[O-])[C@H](C)CO1 ZINC000599105540 479162829 /nfs/dbraw/zinc/16/28/29/479162829.db2.gz YQDGGZRWJAVOCM-CHWSQXEVSA-N 1 1 330.388 2.664 10 5 EFBEMO C[C@@H]1C[N@@H+](CCNc2ccc3cnccc3c2[N+](=O)[O-])[C@H](C)CO1 ZINC000599105540 479162833 /nfs/dbraw/zinc/16/28/33/479162833.db2.gz YQDGGZRWJAVOCM-CHWSQXEVSA-N 1 1 330.388 2.664 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)OCC12CCC2 ZINC000593092353 479168871 /nfs/dbraw/zinc/16/88/71/479168871.db2.gz NGLMQFVFBBPONM-AWEZNQCLSA-N 1 1 347.415 2.875 10 5 EFBEMO NC(=O)c1cc(NC[C@@H]2CC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000599126392 479170326 /nfs/dbraw/zinc/17/03/26/479170326.db2.gz GDPYRHCVOGKKSK-AWEZNQCLSA-N 1 1 332.404 2.513 10 5 EFBEMO NC(=O)c1cc(NC[C@H]2CC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000599126394 479170373 /nfs/dbraw/zinc/17/03/73/479170373.db2.gz GDPYRHCVOGKKSK-CQSZACIVSA-N 1 1 332.404 2.513 10 5 EFBEMO C[C@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCc2ccccc21 ZINC000593096435 479173241 /nfs/dbraw/zinc/17/32/41/479173241.db2.gz SNKDESFBKWZLHW-ZDUSSCGKSA-N 1 1 339.395 2.856 10 5 EFBEMO CCN(C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000596167399 479175348 /nfs/dbraw/zinc/17/53/48/479175348.db2.gz GNZCWGJLDZNATR-XJKSGUPXSA-N 1 1 334.420 2.782 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@@H]2CNc2cccnc2[N+](=O)[O-])cc1 ZINC000599139333 479177800 /nfs/dbraw/zinc/17/78/00/479177800.db2.gz KICCOYDUEZYDSA-CQSZACIVSA-N 1 1 328.372 2.685 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2cccnc2[N+](=O)[O-])cc1 ZINC000599139333 479177804 /nfs/dbraw/zinc/17/78/04/479177804.db2.gz KICCOYDUEZYDSA-CQSZACIVSA-N 1 1 328.372 2.685 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@@H]2CNc2ncc(C)cc2[N+](=O)[O-])cc1 ZINC000599140471 479179262 /nfs/dbraw/zinc/17/92/62/479179262.db2.gz UIPIGKYYAVTINY-OAHLLOKOSA-N 1 1 342.399 2.993 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2ncc(C)cc2[N+](=O)[O-])cc1 ZINC000599140471 479179266 /nfs/dbraw/zinc/17/92/66/479179266.db2.gz UIPIGKYYAVTINY-OAHLLOKOSA-N 1 1 342.399 2.993 10 5 EFBEMO CCOc1cc(C[N@@H+]2C[C@@H](CO)[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000602988828 479182380 /nfs/dbraw/zinc/18/23/80/479182380.db2.gz YOYDIPHHEMANKN-NWDGAFQWSA-N 1 1 348.321 2.596 10 5 EFBEMO CCOc1cc(C[N@H+]2C[C@@H](CO)[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000602988828 479182387 /nfs/dbraw/zinc/18/23/87/479182387.db2.gz YOYDIPHHEMANKN-NWDGAFQWSA-N 1 1 348.321 2.596 10 5 EFBEMO C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCc2ccc(F)cc21 ZINC000593116400 479183259 /nfs/dbraw/zinc/18/32/59/479183259.db2.gz LVRGTLUXBJPODP-CYBMUJFWSA-N 1 1 345.374 2.557 10 5 EFBEMO C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCc2ccc(F)cc21 ZINC000593116401 479183621 /nfs/dbraw/zinc/18/36/21/479183621.db2.gz LVRGTLUXBJPODP-ZDUSSCGKSA-N 1 1 345.374 2.557 10 5 EFBEMO Cc1cn2c([nH+]1)C[C@H](c1nc(-c3ccc([N+](=O)[O-])s3)no1)CC2 ZINC000599153452 479183856 /nfs/dbraw/zinc/18/38/56/479183856.db2.gz ZLVQMKSXNMHXQM-SECBINFHSA-N 1 1 331.357 2.941 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c2c(c1)COCO2 ZINC000593116639 479184105 /nfs/dbraw/zinc/18/41/05/479184105.db2.gz NCBUUOYVFZNKRT-AWEZNQCLSA-N 1 1 326.299 2.692 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@]3(CC3(F)F)C2)c2c(c1)COCO2 ZINC000593116639 479184115 /nfs/dbraw/zinc/18/41/15/479184115.db2.gz NCBUUOYVFZNKRT-AWEZNQCLSA-N 1 1 326.299 2.692 10 5 EFBEMO Cc1cn2c([nH+]1)C[C@@H](c1nc(-c3ccc([N+](=O)[O-])s3)no1)CC2 ZINC000599153459 479184267 /nfs/dbraw/zinc/18/42/67/479184267.db2.gz ZLVQMKSXNMHXQM-VIFPVBQESA-N 1 1 331.357 2.941 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CC[C@]4(CC4(F)F)C3)o2)cc1 ZINC000593118830 479187065 /nfs/dbraw/zinc/18/70/65/479187065.db2.gz YSZRMSDNZLRNHY-AWEZNQCLSA-N 1 1 336.298 2.876 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@]4(CC4(F)F)C3)o2)cc1 ZINC000593118830 479187071 /nfs/dbraw/zinc/18/70/71/479187071.db2.gz YSZRMSDNZLRNHY-AWEZNQCLSA-N 1 1 336.298 2.876 10 5 EFBEMO O=C1CCc2cc([N+](=O)[O-])c(NC[C@@H]3CC[N@H+]3C3CCCC3)cc2N1 ZINC000599165255 479189737 /nfs/dbraw/zinc/18/97/37/479189737.db2.gz PEJWIAGOTWXYPX-AWEZNQCLSA-N 1 1 344.415 2.908 10 5 EFBEMO COC(=O)c1c(Cl)c(N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000596247040 479222984 /nfs/dbraw/zinc/22/29/84/479222984.db2.gz KVXVRHVXXNORLX-AOOOYVTPSA-N 1 1 341.795 2.564 10 5 EFBEMO COC(=O)c1c(Cl)c(N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000596247040 479222988 /nfs/dbraw/zinc/22/29/88/479222988.db2.gz KVXVRHVXXNORLX-AOOOYVTPSA-N 1 1 341.795 2.564 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000593203891 479237827 /nfs/dbraw/zinc/23/78/27/479237827.db2.gz KKJOFQAYVYUBOJ-UHFFFAOYSA-N 1 1 346.431 2.644 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@H+]1CCNCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000574191854 479237998 /nfs/dbraw/zinc/23/79/98/479237998.db2.gz KBWNNFFMUKGBPI-GASCZTMLSA-N 1 1 348.447 2.776 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000574191854 479238003 /nfs/dbraw/zinc/23/80/03/479238003.db2.gz KBWNNFFMUKGBPI-GASCZTMLSA-N 1 1 348.447 2.776 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000593203790 479238191 /nfs/dbraw/zinc/23/81/91/479238191.db2.gz HOLMJWKSUCNEEL-UHFFFAOYSA-N 1 1 327.812 2.956 10 5 EFBEMO COC(=O)c1cc(NC[C@H]2CC[N@H+]2C(C)(C)C)cc(C)c1[N+](=O)[O-] ZINC000596309360 479248618 /nfs/dbraw/zinc/24/86/18/479248618.db2.gz ZKORQDOHQKXOLT-CYBMUJFWSA-N 1 1 335.404 2.975 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](Cc1ccncc1Br)CC2 ZINC000599354419 479265899 /nfs/dbraw/zinc/26/58/99/479265899.db2.gz VLYIWTANAMOKEW-UHFFFAOYSA-N 1 1 349.188 2.706 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](Cc1ccncc1Br)CC2 ZINC000599354419 479265901 /nfs/dbraw/zinc/26/59/01/479265901.db2.gz VLYIWTANAMOKEW-UHFFFAOYSA-N 1 1 349.188 2.706 10 5 EFBEMO C[C@@H](CN(C)CCC[NH+](C)C)Nc1ccnc2cc([N+](=O)[O-])ccc21 ZINC000596364114 479266785 /nfs/dbraw/zinc/26/67/85/479266785.db2.gz XXRFPRNKTZXGQI-AWEZNQCLSA-N 1 1 345.447 2.827 10 5 EFBEMO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1c(F)cc([N+](=O)[O-])cc1F ZINC000596364588 479267241 /nfs/dbraw/zinc/26/72/41/479267241.db2.gz PCLZPRSDLSPUCB-NSHDSACASA-N 1 1 330.379 2.557 10 5 EFBEMO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1c(F)cc([N+](=O)[O-])cc1F ZINC000596364588 479267245 /nfs/dbraw/zinc/26/72/45/479267245.db2.gz PCLZPRSDLSPUCB-NSHDSACASA-N 1 1 330.379 2.557 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(C(=O)c2cccc(SC)c2[N+](=O)[O-])C[C@@H]1C ZINC000603142392 479272036 /nfs/dbraw/zinc/27/20/36/479272036.db2.gz KHZURIXRTPIVQT-TXEJJXNPSA-N 1 1 337.445 2.871 10 5 EFBEMO O=[N+]([O-])c1cc(F)ccc1NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000596423631 479289268 /nfs/dbraw/zinc/28/92/68/479289268.db2.gz MZELQWBVSGYAIM-INIZCTEOSA-N 1 1 345.374 2.913 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](C(F)F)C2)cccc1[N+](=O)[O-] ZINC000611179877 479303569 /nfs/dbraw/zinc/30/35/69/479303569.db2.gz MLIMBMOXPYHPMM-WDEREUQCSA-N 1 1 327.331 2.817 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C(F)F)C2)cccc1[N+](=O)[O-] ZINC000611179877 479303577 /nfs/dbraw/zinc/30/35/77/479303577.db2.gz MLIMBMOXPYHPMM-WDEREUQCSA-N 1 1 327.331 2.817 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](C(F)F)C2)cccc1[N+](=O)[O-] ZINC000611179875 479303856 /nfs/dbraw/zinc/30/38/56/479303856.db2.gz MLIMBMOXPYHPMM-MNOVXSKESA-N 1 1 327.331 2.817 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@H](C(F)F)C2)cccc1[N+](=O)[O-] ZINC000611179875 479303864 /nfs/dbraw/zinc/30/38/64/479303864.db2.gz MLIMBMOXPYHPMM-MNOVXSKESA-N 1 1 327.331 2.817 10 5 EFBEMO Cc1c(CNC(=O)NCCC[N@H+](C)CC(C)C)cccc1[N+](=O)[O-] ZINC000593398067 479325819 /nfs/dbraw/zinc/32/58/19/479325819.db2.gz RKJNWATYAWHQKF-UHFFFAOYSA-N 1 1 336.436 2.680 10 5 EFBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553525 479331139 /nfs/dbraw/zinc/33/11/39/479331139.db2.gz YBPAVUXGXOTFOL-GLQYFDAESA-N 1 1 335.429 2.892 10 5 EFBEMO Cc1c(C[N@@H+]2CCOC[C@@H]2[C@H]2CCCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000585800617 479332256 /nfs/dbraw/zinc/33/22/56/479332256.db2.gz BSVQNUUVBGPCNA-NXHRZFHOSA-N 1 1 334.416 2.655 10 5 EFBEMO Cc1c(C[N@H+]2CCOC[C@@H]2[C@H]2CCCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000585800617 479332260 /nfs/dbraw/zinc/33/22/60/479332260.db2.gz BSVQNUUVBGPCNA-NXHRZFHOSA-N 1 1 334.416 2.655 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)Nc1nccc(C(=O)OCC)c1[N+](=O)[O-] ZINC000596543274 479334043 /nfs/dbraw/zinc/33/40/43/479334043.db2.gz QJOTZSIVGHIFPH-UHFFFAOYSA-N 1 1 338.408 2.699 10 5 EFBEMO C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000599625899 479358161 /nfs/dbraw/zinc/35/81/61/479358161.db2.gz QTQDDZPJXZANQX-JNIYBQFBSA-N 1 1 332.360 2.546 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[N@H+]1C(C)(C)C ZINC000596627327 479363421 /nfs/dbraw/zinc/36/34/21/479363421.db2.gz YIIOERJLQOHWFP-GFCCVEGCSA-N 1 1 336.392 2.598 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC000599648862 479368879 /nfs/dbraw/zinc/36/88/79/479368879.db2.gz BIBCMVRUHLQTNG-LALPHHSUSA-N 1 1 336.363 2.898 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC000599648862 479368881 /nfs/dbraw/zinc/36/88/81/479368881.db2.gz BIBCMVRUHLQTNG-LALPHHSUSA-N 1 1 336.363 2.898 10 5 EFBEMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+](C)C1 ZINC000611402507 479369079 /nfs/dbraw/zinc/36/90/79/479369079.db2.gz QPPMAFKGMCHOPH-GFCCVEGCSA-N 1 1 337.445 2.919 10 5 EFBEMO C[N@@H+](CCCNc1cc(N)c([N+](=O)[O-])c(CO)c1)Cc1ccccc1 ZINC000587029745 479369896 /nfs/dbraw/zinc/36/98/96/479369896.db2.gz MAQPUDCNBDKMJF-UHFFFAOYSA-N 1 1 344.415 2.603 10 5 EFBEMO O=C(C[N@H+]1CCCC2(CC2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000599672508 479384568 /nfs/dbraw/zinc/38/45/68/479384568.db2.gz ICROXILKPNCGAL-UHFFFAOYSA-N 1 1 329.400 2.750 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H]2CCCC[C@@]21C ZINC000599675864 479385322 /nfs/dbraw/zinc/38/53/22/479385322.db2.gz UXEYMCPBBKIDKG-SJCJKPOMSA-N 1 1 333.388 2.806 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H]2CCCC[C@@]21C ZINC000599675864 479385326 /nfs/dbraw/zinc/38/53/26/479385326.db2.gz UXEYMCPBBKIDKG-SJCJKPOMSA-N 1 1 333.388 2.806 10 5 EFBEMO C[C@]12CCCC[C@H]1C[N@@H+]2CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000599675536 479385867 /nfs/dbraw/zinc/38/58/67/479385867.db2.gz RBGNDIFZMDDFBU-GTNSWQLSSA-N 1 1 347.371 2.527 10 5 EFBEMO C[C@]12CCCC[C@H]1C[N@H+]2CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000599675536 479385872 /nfs/dbraw/zinc/38/58/72/479385872.db2.gz RBGNDIFZMDDFBU-GTNSWQLSSA-N 1 1 347.371 2.527 10 5 EFBEMO COC(=O)[C@@H]1C[C@@H](C)[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)[C@@H](C)C1 ZINC000599693723 479394730 /nfs/dbraw/zinc/39/47/30/479394730.db2.gz FYVDRLJCVDEESO-DABQJJPHSA-N 1 1 336.388 2.765 10 5 EFBEMO C[C@@H]1CC[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@H]1F ZINC000611501768 479397139 /nfs/dbraw/zinc/39/71/39/479397139.db2.gz IEIUGKXONBKFOQ-DGCLKSJQSA-N 1 1 337.351 2.573 10 5 EFBEMO C[C@@H]1CC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@H]1F ZINC000611501768 479397144 /nfs/dbraw/zinc/39/71/44/479397144.db2.gz IEIUGKXONBKFOQ-DGCLKSJQSA-N 1 1 337.351 2.573 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000599780272 479422890 /nfs/dbraw/zinc/42/28/90/479422890.db2.gz NBVANYZPNCRFKM-CQSZACIVSA-N 1 1 348.403 2.742 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@@]3(CC3(F)F)C1)OCCO2 ZINC000593695418 479426576 /nfs/dbraw/zinc/42/65/76/479426576.db2.gz OMWBFZOSFOCZBN-CQSZACIVSA-N 1 1 326.299 2.597 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@]3(CC3(F)F)C1)OCCO2 ZINC000593695418 479426582 /nfs/dbraw/zinc/42/65/82/479426582.db2.gz OMWBFZOSFOCZBN-CQSZACIVSA-N 1 1 326.299 2.597 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@]3(CC3(F)F)C1)OCCO2 ZINC000593695417 479426738 /nfs/dbraw/zinc/42/67/38/479426738.db2.gz OMWBFZOSFOCZBN-AWEZNQCLSA-N 1 1 326.299 2.597 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@]3(CC3(F)F)C1)OCCO2 ZINC000593695417 479426741 /nfs/dbraw/zinc/42/67/41/479426741.db2.gz OMWBFZOSFOCZBN-AWEZNQCLSA-N 1 1 326.299 2.597 10 5 EFBEMO CC[N@@H+](CCNC(=O)Nc1ccc([N+](=O)[O-])c2ccncc12)C1CC1 ZINC000599830328 479442307 /nfs/dbraw/zinc/44/23/07/479442307.db2.gz QRYKRWODJQTOTF-UHFFFAOYSA-N 1 1 343.387 2.749 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C ZINC000596843867 479452588 /nfs/dbraw/zinc/45/25/88/479452588.db2.gz LJISHIZQKPMXCU-LBPRGKRZSA-N 1 1 336.392 2.598 10 5 EFBEMO CC[N@@H+]1CCN(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000618469208 479458680 /nfs/dbraw/zinc/45/86/80/479458680.db2.gz 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C[C@H]1[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCC12CCOCC2 ZINC000618305604 480614587 /nfs/dbraw/zinc/61/45/87/480614587.db2.gz MOZITFXKWXJOPZ-GFCCVEGCSA-N 1 1 330.388 2.862 10 5 EFBEMO COc1cc(CN(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000184230088 533790529 /nfs/dbraw/zinc/79/05/29/533790529.db2.gz NESYONRCNIJBOP-WCQYABFASA-N 1 1 325.384 2.657 10 5 EFBEMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000119406087 519722674 /nfs/dbraw/zinc/72/26/74/519722674.db2.gz CHIGHUGLIQSORI-CQSZACIVSA-N 1 1 344.415 2.926 10 5 EFBEMO CCNc1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](CC)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000122178923 520280570 /nfs/dbraw/zinc/28/05/70/520280570.db2.gz QRAYJVYIWAQJDI-XJKSGUPXSA-N 1 1 348.447 2.829 10 5 EFBEMO CCN(CC)C(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000058524844 520443143 /nfs/dbraw/zinc/44/31/43/520443143.db2.gz GGUZPINPGGSFJC-UHFFFAOYSA-N 1 1 349.431 2.684 10 5 EFBEMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)c2cccc([N+](=O)[O-])c2N)CC1 ZINC000356436941 534540922 /nfs/dbraw/zinc/54/09/22/534540922.db2.gz VJLQUQYNYNISFG-UHFFFAOYSA-N 1 1 346.431 2.585 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000246171299 523483417 /nfs/dbraw/zinc/48/34/17/523483417.db2.gz LIQRCVUOPJDIKM-WBVHZDCISA-N 1 1 331.416 2.613 10 5 EFBEMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(c2cc[nH]n2)CC1 ZINC000195506686 524272707 /nfs/dbraw/zinc/27/27/07/524272707.db2.gz QSWYWTQLBIPESY-LBPRGKRZSA-N 1 1 343.387 2.525 10 5 EFBEMO Cc1nccn1C[C@@H]1CCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000178297063 534779470 /nfs/dbraw/zinc/77/94/70/534779470.db2.gz MBNXTYMYNCFPCF-HNNXBMFYSA-N 1 1 330.388 2.643 10 5 EFBEMO C[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@H]1c1cccc(F)c1 ZINC000245571877 524507003 /nfs/dbraw/zinc/50/70/03/524507003.db2.gz BXTLMBXDNJNSJL-FZKQIMNGSA-N 1 1 345.374 2.979 10 5 EFBEMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)c1 ZINC000157451090 524895740 /nfs/dbraw/zinc/89/57/40/524895740.db2.gz IBPLGWOGCAEQTM-INIZCTEOSA-N 1 1 346.387 2.646 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1C1CC1 ZINC000363384043 525465437 /nfs/dbraw/zinc/46/54/37/525465437.db2.gz FKQZMMLMPVCPSQ-HNNXBMFYSA-N 1 1 333.388 2.806 10 5 EFBEMO CSc1ccc(C(=O)N2CCC[N@H+](C3CC3)CC2)cc1[N+](=O)[O-] ZINC000194507942 525955016 /nfs/dbraw/zinc/95/50/16/525955016.db2.gz NCNVZBLAPCWQGD-UHFFFAOYSA-N 1 1 335.429 2.627 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(c2cc[nH]n2)CC1 ZINC000195506688 526161375 /nfs/dbraw/zinc/16/13/75/526161375.db2.gz QSWYWTQLBIPESY-GFCCVEGCSA-N 1 1 343.387 2.525 10 5 EFBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](C)C[N@@H+](C)Cc1ccccc1 ZINC000182082251 527314862 /nfs/dbraw/zinc/31/48/62/527314862.db2.gz FIYOFKBPFBYURS-CYBMUJFWSA-N 1 1 342.399 2.549 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](Oc4cccnc4)C3)nc2c1 ZINC000152226019 527381395 /nfs/dbraw/zinc/38/13/95/527381395.db2.gz PDYLIOZRDBDDRO-AWEZNQCLSA-N 1 1 340.339 2.784 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](Oc4cccnc4)C3)nc2c1 ZINC000152226019 527381401 /nfs/dbraw/zinc/38/14/01/527381401.db2.gz PDYLIOZRDBDDRO-AWEZNQCLSA-N 1 1 340.339 2.784 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](Oc3cccnc3)C2)c1 ZINC000152546282 527390680 /nfs/dbraw/zinc/39/06/80/527390680.db2.gz ZAJFJRXOVPREHF-KRWDZBQOSA-N 1 1 329.356 2.522 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](Oc3cccnc3)C2)c1 ZINC000152546374 527391102 /nfs/dbraw/zinc/39/11/02/527391102.db2.gz ZAJFJRXOVPREHF-QGZVFWFLSA-N 1 1 329.356 2.522 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000246225920 527394667 /nfs/dbraw/zinc/39/46/67/527394667.db2.gz FIGDBJOYJPJDGG-KFKAGJAMSA-N 1 1 345.443 2.577 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)c1 ZINC000246225920 527394690 /nfs/dbraw/zinc/39/46/90/527394690.db2.gz FIGDBJOYJPJDGG-KFKAGJAMSA-N 1 1 345.443 2.577 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)c1 ZINC000246225920 527394696 /nfs/dbraw/zinc/39/46/96/527394696.db2.gz FIGDBJOYJPJDGG-KFKAGJAMSA-N 1 1 345.443 2.577 10 5 EFBEMO Cc1nn(C)c(C)c1[C@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000137049793 527663233 /nfs/dbraw/zinc/66/32/33/527663233.db2.gz WBLDEQAKNZKCRJ-SJORKVTESA-N 1 1 344.415 2.816 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](n2cncn2)C1 ZINC000171620930 528210968 /nfs/dbraw/zinc/21/09/68/528210968.db2.gz FXLODCRIRDDGKP-INIZCTEOSA-N 1 1 345.403 2.811 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](n2cncn2)C1 ZINC000171620930 528210972 /nfs/dbraw/zinc/21/09/72/528210972.db2.gz FXLODCRIRDDGKP-INIZCTEOSA-N 1 1 345.403 2.811 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](n2cncn2)C1 ZINC000171620936 528211060 /nfs/dbraw/zinc/21/10/60/528211060.db2.gz FXLODCRIRDDGKP-MRXNPFEDSA-N 1 1 345.403 2.811 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](n2cncn2)C1 ZINC000171620936 528211064 /nfs/dbraw/zinc/21/10/64/528211064.db2.gz FXLODCRIRDDGKP-MRXNPFEDSA-N 1 1 345.403 2.811 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000181402332 529304017 /nfs/dbraw/zinc/30/40/17/529304017.db2.gz IFVYJFPAXCMJOH-GXTWGEPZSA-N 1 1 348.403 2.694 10 5 EFBEMO CC[C@@H](NC(=O)N1CCC[C@H]2C[N@@H+](C)C[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000425693462 535789358 /nfs/dbraw/zinc/78/93/58/535789358.db2.gz STDBNLRBHJHCTK-USXIJHARSA-N 1 1 346.431 2.782 10 5 EFBEMO COc1cc(C[N@@H+]2CCC[C@@H](c3ccncn3)C2)c([N+](=O)[O-])cc1F ZINC000363938237 536752464 /nfs/dbraw/zinc/75/24/64/536752464.db2.gz KDUZSYSIYQODRN-GFCCVEGCSA-N 1 1 346.362 2.912 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@@H](c3ccncn3)C2)c([N+](=O)[O-])cc1F ZINC000363938237 536752469 /nfs/dbraw/zinc/75/24/69/536752469.db2.gz KDUZSYSIYQODRN-GFCCVEGCSA-N 1 1 346.362 2.912 10 5 EFBEMO COc1ccc(NC(=O)C[N@H+]2C[C@H](C)C[C@@H](C)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000355791734 536770126 /nfs/dbraw/zinc/77/01/26/536770126.db2.gz XOUNYSRWFMPUQR-UPJWGTAASA-N 1 1 335.404 2.908 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000754255466 575411325 /nfs/dbraw/zinc/41/13/25/575411325.db2.gz CBLRPHNZUKWQSA-HVJHFUJKSA-N 1 1 329.400 2.693 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000755054840 575535548 /nfs/dbraw/zinc/53/55/48/575535548.db2.gz NMWQENNGDAHOEC-JWZGAQTFSA-N 1 1 329.400 2.741 10 5 EFBEMO CC[N@H+]1CCC[C@@H](CNC(=O)/C(C)=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000755197069 575559455 /nfs/dbraw/zinc/55/94/55/575559455.db2.gz DKHWJPNIRPCCHC-UKYUDJEDSA-N 1 1 331.416 2.846 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCO[C@@H](C3CCCCC3)C2)cc1 ZINC000755306909 575572783 /nfs/dbraw/zinc/57/27/83/575572783.db2.gz KKPMUFXZYULXBM-QZTJIDSGSA-N 1 1 334.416 2.909 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCO[C@@H](C3CCCCC3)C2)cc1 ZINC000755306909 575572784 /nfs/dbraw/zinc/57/27/84/575572784.db2.gz KKPMUFXZYULXBM-QZTJIDSGSA-N 1 1 334.416 2.909 10 5 EFBEMO COC(=O)/C=C/c1ccc(N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000757795575 575853169 /nfs/dbraw/zinc/85/31/69/575853169.db2.gz RCQGWAFMMOYAKE-VYXDKDMYSA-N 1 1 345.399 2.676 10 5 EFBEMO Cn1cc([N+](=O)[O-])cc1C(=O)OCCC[N@@H+](C)Cc1ccccc1 ZINC000757952556 575856657 /nfs/dbraw/zinc/85/66/57/575856657.db2.gz CAPURNRXZNANML-UHFFFAOYSA-N 1 1 331.372 2.612 10 5 EFBEMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c3nonc32)[C@H]1c1ccccc1 ZINC000758251263 575864872 /nfs/dbraw/zinc/86/48/72/575864872.db2.gz IPOOSSZYAIVCDG-CXAGYDPISA-N 1 1 339.355 2.988 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@H]3COCC[C@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000761294610 576141901 /nfs/dbraw/zinc/14/19/01/576141901.db2.gz YFVNJAZXWGRXRH-XJKSGUPXSA-N 1 1 330.388 2.711 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@@H+]1CC=C(C)CC1 ZINC000762702755 576325899 /nfs/dbraw/zinc/32/58/99/576325899.db2.gz JVXWHOVYIMUCDX-FYWRMAATSA-N 1 1 329.400 2.766 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@H]3COCC[C@@H]32)c2ccc([N+](=O)[O-])cc12 ZINC000765081863 577004756 /nfs/dbraw/zinc/00/47/56/577004756.db2.gz RDPKSMJUAXHQLV-BBRMVZONSA-N 1 1 330.388 2.711 10 5 EFBEMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H]1NC(=O)OC(C)(C)C ZINC000769875606 577390474 /nfs/dbraw/zinc/39/04/74/577390474.db2.gz WKIMXINXECXODO-CZUORRHYSA-N 1 1 349.431 2.982 10 5 EFBEMO COc1cc(F)c([N+](=O)[O-])c(N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1 ZINC000771240996 581191938 /nfs/dbraw/zinc/19/19/38/581191938.db2.gz UUGUOICBNJKIPV-CYBMUJFWSA-N 1 1 337.395 2.911 10 5 EFBEMO CC[N@H+](CCNC(=O)C1(C2CC2)CC1)Cc1ccccc1[N+](=O)[O-] ZINC001691025956 1247982590 /nfs/dbraw/zinc/98/25/90/1247982590.db2.gz MKCJROKJZJKWJE-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO CC[N@@H+](CCNC(=O)C1(C2CC2)CC1)Cc1ccccc1[N+](=O)[O-] ZINC001691025956 1247982601 /nfs/dbraw/zinc/98/26/01/1247982601.db2.gz MKCJROKJZJKWJE-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO CC[N@@H+](CCNC(=O)Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001691026006 1247985640 /nfs/dbraw/zinc/98/56/40/1247985640.db2.gz OSERTKQVINQRTA-UHFFFAOYSA-N 1 1 341.411 2.776 10 5 EFBEMO CC[N@@H+](CCNC(=O)CC(C)(F)F)Cc1cccc([N+](=O)[O-])c1 ZINC001691038614 1248036023 /nfs/dbraw/zinc/03/60/23/1248036023.db2.gz KASFOCBZMRXRNN-UHFFFAOYSA-N 1 1 329.347 2.578 10 5 EFBEMO O=C(C=C1CCC1)NCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001691205175 1248535287 /nfs/dbraw/zinc/53/52/87/1248535287.db2.gz LDJSARWZPPNSAA-UHFFFAOYSA-N 1 1 329.400 2.786 10 5 EFBEMO CC[C@@H](OC(=O)c1cc(C[NH+](C)C)on1)c1cccc([N+](=O)[O-])c1 ZINC001127828424 1256431493 /nfs/dbraw/zinc/43/14/93/1256431493.db2.gz OQTFFCRSGLZPOC-OAHLLOKOSA-N 1 1 333.344 2.953 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)ccc1Cl ZINC000824654284 1278218848 /nfs/dbraw/zinc/21/88/48/1278218848.db2.gz MALFRQAQBDYZLY-GZBFAFLISA-N 1 1 340.807 2.610 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)ccc1Cl ZINC000824654285 1278219994 /nfs/dbraw/zinc/21/99/94/1278219994.db2.gz MALFRQAQBDYZLY-NFAWXSAZSA-N 1 1 340.807 2.610 10 5 EFBEMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000734552741 1267016403 /nfs/dbraw/zinc/01/64/03/1267016403.db2.gz NJFRSHLFPXEMOI-NSHDSACASA-N 1 1 325.796 2.662 10 5 EFBEMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001299280383 1267073231 /nfs/dbraw/zinc/07/32/31/1267073231.db2.gz CFKDTMQDXXMCPQ-CYBMUJFWSA-N 1 1 339.823 2.732 10 5 EFBEMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001299280384 1267081076 /nfs/dbraw/zinc/08/10/76/1267081076.db2.gz CFKDTMQDXXMCPQ-ZDUSSCGKSA-N 1 1 339.823 2.732 10 5 EFBEMO COC(=O)/C=C\c1ccc(NC[C@@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000742571989 1270116347 /nfs/dbraw/zinc/11/63/47/1270116347.db2.gz JWCOMNCXLJYGDF-PKYBCLHXSA-N 1 1 347.415 2.923 10 5 EFBEMO CCC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](CC)C(=O)OCC ZINC001169234139 1272748995 /nfs/dbraw/zinc/74/89/95/1272748995.db2.gz QGNFSDOJTVNYLS-CVEARBPZSA-N 1 1 338.404 2.682 10 5 EFBEMO CCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](CC)C(=O)OCC ZINC001169234139 1272749002 /nfs/dbraw/zinc/74/90/02/1272749002.db2.gz QGNFSDOJTVNYLS-CVEARBPZSA-N 1 1 338.404 2.682 10 5 EFBEMO CN(C)Cc1cc(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1F ZINC000819073852 1276620277 /nfs/dbraw/zinc/62/02/77/1276620277.db2.gz QGMNYZJZJYCZKJ-SFHVURJKSA-N 1 1 347.390 2.619 10 5 EFBEMO C[C@@H]1CCC[N@@H+](CCNC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001136224571 1276775855 /nfs/dbraw/zinc/77/58/55/1276775855.db2.gz ABTDGHHQLDQTGZ-GFCCVEGCSA-N 1 1 339.823 2.639 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+](C2CC2)C2(CO)CCC2)o1 ZINC001170949567 1277213489 /nfs/dbraw/zinc/21/34/89/1277213489.db2.gz RRBBRYXDNYBFLL-UHFFFAOYSA-N 1 1 344.371 2.524 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+](C2CC2)C2(CO)CCC2)o1 ZINC001170949567 1277213490 /nfs/dbraw/zinc/21/34/90/1277213490.db2.gz RRBBRYXDNYBFLL-UHFFFAOYSA-N 1 1 344.371 2.524 10 5 EFBEMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000871763651 1287275495 /nfs/dbraw/zinc/27/54/95/1287275495.db2.gz NDNNXXTVCCZHCY-KBPBESRZSA-N 1 1 338.795 2.949 10 5 EFBEMO CC(C)(CO)[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1cccnc1 ZINC000821336507 1277521047 /nfs/dbraw/zinc/52/10/47/1277521047.db2.gz CCZFZXRDYTUONB-MRXNPFEDSA-N 1 1 333.363 2.978 10 5 EFBEMO C/C(=C\C(=O)NCc1c[nH+]c2n1CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000791391196 1278079680 /nfs/dbraw/zinc/07/96/80/1278079680.db2.gz VKTQUFHLOIDQPH-JLHYYAGUSA-N 1 1 340.383 2.847 10 5 EFBEMO CCCC[N@@H+](C)CC1CCN(C(=O)c2cc([N+](=O)[O-])cc(C)n2)CC1 ZINC001144303491 1279399126 /nfs/dbraw/zinc/39/91/26/1279399126.db2.gz YBMQFYCEOCLYJR-UHFFFAOYSA-N 1 1 348.447 2.882 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000845224089 1279487984 /nfs/dbraw/zinc/48/79/84/1279487984.db2.gz LAJZQCNWFMPIIQ-AWEZNQCLSA-N 1 1 336.436 2.933 10 5 EFBEMO C[C@@H]([NH2+]CCNC(=O)OC(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872030541 1287405847 /nfs/dbraw/zinc/40/58/47/1287405847.db2.gz HMYXMVBPCMGMCF-SNVBAGLBSA-N 1 1 327.356 2.909 10 5 EFBEMO C[C@@H]([NH2+]C[C@]1(N(C)C)CCSC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872039482 1287408474 /nfs/dbraw/zinc/40/84/74/1287408474.db2.gz FXCVOCUAFAKCLA-IAQYHMDHSA-N 1 1 327.425 2.822 10 5 EFBEMO C[C@H](NCCC[N@H+]1CCCO[C@H](C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872065563 1287417559 /nfs/dbraw/zinc/41/75/59/1287417559.db2.gz DNRUMIXCJJTFDS-KGLIPLIRSA-N 1 1 339.411 2.885 10 5 EFBEMO Cc1ccnc([C@H]2CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000846972660 1280640275 /nfs/dbraw/zinc/64/02/75/1280640275.db2.gz XLZHWWSTGZSPNT-YJBOKZPZSA-N 1 1 327.384 2.821 10 5 EFBEMO Cn1ncc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)n1 ZINC000808414529 1281705251 /nfs/dbraw/zinc/70/52/51/1281705251.db2.gz BJHUWSPORFIGPL-UHFFFAOYSA-N 1 1 329.385 2.742 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC3(C2)Oc2ccccc2O3)cc1 ZINC000808792428 1281902246 /nfs/dbraw/zinc/90/22/46/1281902246.db2.gz ISHZNVZGQKQKRL-HNNXBMFYSA-N 1 1 342.351 2.502 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC3(C2)Oc2ccccc2O3)cc1 ZINC000808792428 1281902256 /nfs/dbraw/zinc/90/22/56/1281902256.db2.gz ISHZNVZGQKQKRL-HNNXBMFYSA-N 1 1 342.351 2.502 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000810694015 1283528581 /nfs/dbraw/zinc/52/85/81/1283528581.db2.gz CGHHCQNAZXYTDU-QGZVFWFLSA-N 1 1 338.379 2.893 10 5 EFBEMO CC(C)[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)[C@H]1CCOC1 ZINC000812290172 1285025037 /nfs/dbraw/zinc/02/50/37/1285025037.db2.gz AUBJNGQHJDTMTG-KRWDZBQOSA-N 1 1 330.388 2.915 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000747831290 1285579532 /nfs/dbraw/zinc/57/95/32/1285579532.db2.gz LVICILGUUVPLQV-LSDHHAIUSA-N 1 1 344.415 2.959 10 5 EFBEMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000747833251 1285585176 /nfs/dbraw/zinc/58/51/76/1285585176.db2.gz VEOCGIKXNUINLZ-UONOGXRCSA-N 1 1 330.388 2.651 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)N2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000813012340 1285610516 /nfs/dbraw/zinc/61/05/16/1285610516.db2.gz HYRJABYPKYALOC-KRWDZBQOSA-N 1 1 335.379 2.696 10 5 EFBEMO CO[C@@H](C)CCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171910 1285701464 /nfs/dbraw/zinc/70/14/64/1285701464.db2.gz WXUDWLRNYUSGCV-BBRMVZONSA-N 1 1 336.388 2.527 10 5 EFBEMO CO[C@@H](C)CCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171910 1285701472 /nfs/dbraw/zinc/70/14/72/1285701472.db2.gz WXUDWLRNYUSGCV-BBRMVZONSA-N 1 1 336.388 2.527 10 5 EFBEMO CC(C)SCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813170703 1285701590 /nfs/dbraw/zinc/70/15/90/1285701590.db2.gz KIBVSOSJQUDLMY-HNNXBMFYSA-N 1 1 338.429 2.854 10 5 EFBEMO CC(C)SCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813170703 1285701600 /nfs/dbraw/zinc/70/16/00/1285701600.db2.gz KIBVSOSJQUDLMY-HNNXBMFYSA-N 1 1 338.429 2.854 10 5 EFBEMO CO[C@H](C)CCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171911 1285702323 /nfs/dbraw/zinc/70/23/23/1285702323.db2.gz WXUDWLRNYUSGCV-CJNGLKHVSA-N 1 1 336.388 2.527 10 5 EFBEMO CO[C@H](C)CCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171911 1285702328 /nfs/dbraw/zinc/70/23/28/1285702328.db2.gz WXUDWLRNYUSGCV-CJNGLKHVSA-N 1 1 336.388 2.527 10 5 EFBEMO CC(C)[N@H+]1CCC[C@@H](C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC001179398717 1289122054 /nfs/dbraw/zinc/12/20/54/1289122054.db2.gz MDWGXVWXXGOKJV-HUUCEWRRSA-N 1 1 333.432 2.935 10 5 EFBEMO COc1cc(C[NH+]2CCC(O)(C(C)C)CC2)c([N+](=O)[O-])cc1F ZINC001176921669 1288173765 /nfs/dbraw/zinc/17/37/65/1288173765.db2.gz PVRCPLJZLIPKDY-UHFFFAOYSA-N 1 1 326.368 2.725 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@@H]1[C@H]1CCCO1 ZINC001176927562 1288176701 /nfs/dbraw/zinc/17/67/01/1288176701.db2.gz SVLHFSMTXPKWFE-IAGOWNOFSA-N 1 1 347.415 2.875 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@@H]1[C@H]1CCCO1 ZINC001176927562 1288176703 /nfs/dbraw/zinc/17/67/03/1288176703.db2.gz SVLHFSMTXPKWFE-IAGOWNOFSA-N 1 1 347.415 2.875 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H]1CC3(CO1)CCOCC3)C2 ZINC000878302993 1291614037 /nfs/dbraw/zinc/61/40/37/1291614037.db2.gz DDQYHCUFRXNJIW-OAHLLOKOSA-N 1 1 332.400 2.539 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H]1CC3(CO1)CCOCC3)C2 ZINC000878302993 1291614045 /nfs/dbraw/zinc/61/40/45/1291614045.db2.gz DDQYHCUFRXNJIW-OAHLLOKOSA-N 1 1 332.400 2.539 10 5 EFBEMO CC(C)(C)c1ccc(NC(=O)CC[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000803614837 1312883861 /nfs/dbraw/zinc/88/38/61/1312883861.db2.gz YQUFTOIWVIDINQ-UHFFFAOYSA-N 1 1 335.404 2.553 10 5 EFBEMO C[C@@H](CN1CCOCC1)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001191683517 1292627829 /nfs/dbraw/zinc/62/78/29/1292627829.db2.gz XEYZPVVKEKLFPG-HNNXBMFYSA-N 1 1 333.432 2.528 10 5 EFBEMO Cc1nnc(C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C(C)(C)C)o1 ZINC001191730789 1292644233 /nfs/dbraw/zinc/64/42/33/1292644233.db2.gz FFDHQKFCZDYAOM-UHFFFAOYSA-N 1 1 334.376 2.966 10 5 EFBEMO Cc1nnc(C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C(C)(C)C)o1 ZINC001191730789 1292644246 /nfs/dbraw/zinc/64/42/46/1292644246.db2.gz FFDHQKFCZDYAOM-UHFFFAOYSA-N 1 1 334.376 2.966 10 5 EFBEMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001192313278 1292865331 /nfs/dbraw/zinc/86/53/31/1292865331.db2.gz CCMYGQAWKVOFBV-QWRGUYRKSA-N 1 1 342.237 2.882 10 5 EFBEMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCN(c2cc(C)cc[nH+]2)CC1 ZINC000882105302 1293100928 /nfs/dbraw/zinc/10/09/28/1293100928.db2.gz SPBWGVJUAFLLID-UHFFFAOYSA-N 1 1 340.383 2.827 10 5 EFBEMO CC(C)(O)[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC001197589769 1294627033 /nfs/dbraw/zinc/62/70/33/1294627033.db2.gz MVBVTLFMTPZTOT-CYBMUJFWSA-N 1 1 346.387 2.628 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(O)(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC001198675986 1295196078 /nfs/dbraw/zinc/19/60/78/1295196078.db2.gz BYCVATHPIYSMHS-AWEZNQCLSA-N 1 1 349.431 2.713 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1COC(=O)CC[C@H]1CCCC[N@H+]1C ZINC000803856165 1313259028 /nfs/dbraw/zinc/25/90/28/1313259028.db2.gz PBMUFLHCFIVKKJ-CQSZACIVSA-N 1 1 336.388 2.911 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1COC(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000803859048 1313265448 /nfs/dbraw/zinc/26/54/48/1313265448.db2.gz LYVWIYSHXMETBB-AWEZNQCLSA-N 1 1 336.388 2.911 10 5 EFBEMO Cc1ccc(OCC[N@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776275767 1297341688 /nfs/dbraw/zinc/34/16/88/1297341688.db2.gz KZJQXKORVHYNSK-GOSISDBHSA-N 1 1 330.384 2.947 10 5 EFBEMO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CNCCC1(F)F ZINC000903956055 1313483672 /nfs/dbraw/zinc/48/36/72/1313483672.db2.gz GITUMEUVBHAIDF-JSGCOSHPSA-N 1 1 327.375 2.750 10 5 EFBEMO CC1(C(=O)NCCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC001490373924 1298791335 /nfs/dbraw/zinc/79/13/35/1298791335.db2.gz CTKGMQMHUBJTNG-UHFFFAOYSA-N 1 1 331.416 2.866 10 5 EFBEMO Cc1noc(C[NH+]2CCC(O)(c3cccc(C)c3C)CC2)c1[N+](=O)[O-] ZINC000851784697 1299395053 /nfs/dbraw/zinc/39/50/53/1299395053.db2.gz MQQBRYNIIQEPHH-UHFFFAOYSA-N 1 1 345.399 2.992 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H](c3ccccn3)C2)cc1 ZINC000852084092 1299541157 /nfs/dbraw/zinc/54/11/57/1299541157.db2.gz PYAVKUNSPAZCHX-CRAIPNDOSA-N 1 1 327.384 2.903 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c([N+](=O)[O-])c1 ZINC000852758328 1299867342 /nfs/dbraw/zinc/86/73/42/1299867342.db2.gz DLAOHFANJMRYRZ-CALCHBBNSA-N 1 1 347.371 2.896 10 5 EFBEMO COc1cc(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)c(Cl)cc1[N+](=O)[O-] ZINC000853242734 1300063262 /nfs/dbraw/zinc/06/32/62/1300063262.db2.gz WLAVYEXGVRYAPL-MNOVXSKESA-N 1 1 341.795 2.532 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCCOCC3)CC2)c(Cl)c1 ZINC000853688301 1300229726 /nfs/dbraw/zinc/22/97/26/1300229726.db2.gz LIRGVPFYSOCEAU-UHFFFAOYSA-N 1 1 339.823 2.939 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH+](CCCF)CC1 ZINC000862113758 1302287761 /nfs/dbraw/zinc/28/77/61/1302287761.db2.gz XVGITHWJKYIKLU-BUHFOSPRSA-N 1 1 335.379 2.502 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Cl ZINC000862154679 1302298346 /nfs/dbraw/zinc/29/83/46/1302298346.db2.gz SBPDWKKGTWUMJD-JTQLQIEISA-N 1 1 325.796 2.851 10 5 EFBEMO O=[N+]([O-])c1ccc(NC(=S)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1 ZINC000863231040 1302561739 /nfs/dbraw/zinc/56/17/39/1302561739.db2.gz XVYZVVZJLVDMLT-HNNXBMFYSA-N 1 1 334.445 2.898 10 5 EFBEMO C[C@H]1CC[C@]2(CC[N@H+](Cn3c(=O)oc4cccc([N+](=O)[O-])c43)C2)C1 ZINC000794639516 1302846836 /nfs/dbraw/zinc/84/68/36/1302846836.db2.gz MCAXZVKSJMZMAG-SJCJKPOMSA-N 1 1 331.372 2.972 10 5 EFBEMO C[C@H]1CC[C@]2(CC[N@@H+](Cn3c(=O)oc4cccc([N+](=O)[O-])c43)C2)C1 ZINC000794639516 1302846859 /nfs/dbraw/zinc/84/68/59/1302846859.db2.gz MCAXZVKSJMZMAG-SJCJKPOMSA-N 1 1 331.372 2.972 10 5 EFBEMO C[C@@H]1CC[C@@]2(CC[N@H+](Cn3c(=O)oc4cccc([N+](=O)[O-])c43)C2)C1 ZINC000794639520 1302847657 /nfs/dbraw/zinc/84/76/57/1302847657.db2.gz MCAXZVKSJMZMAG-SJKOYZFVSA-N 1 1 331.372 2.972 10 5 EFBEMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cn3c(=O)oc4cccc([N+](=O)[O-])c43)C2)C1 ZINC000794639520 1302847666 /nfs/dbraw/zinc/84/76/66/1302847666.db2.gz MCAXZVKSJMZMAG-SJKOYZFVSA-N 1 1 331.372 2.972 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(c2cc(F)c([N+](=O)[O-])cc2CO)CC1 ZINC000865746956 1303383598 /nfs/dbraw/zinc/38/35/98/1303383598.db2.gz RQNZLBSZBKHUCJ-UHFFFAOYSA-N 1 1 334.351 2.573 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@H]3CC4(CO3)CCOCC4)c2c1 ZINC000866174204 1303551046 /nfs/dbraw/zinc/55/10/46/1303551046.db2.gz JTLFRXOIQUXGIZ-AWEZNQCLSA-N 1 1 343.383 2.563 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(c3cc(Br)ccc3[N+](=O)[O-])CC[C@@H]21 ZINC000866204684 1303561908 /nfs/dbraw/zinc/56/19/08/1303561908.db2.gz FZRYMSIREMVJBR-PWSUYJOCSA-N 1 1 340.221 2.888 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(c3cc(Br)ccc3[N+](=O)[O-])CC[C@H]21 ZINC000866204685 1303562002 /nfs/dbraw/zinc/56/20/02/1303562002.db2.gz FZRYMSIREMVJBR-ZYHUDNBSSA-N 1 1 340.221 2.888 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3cc(Br)ccc3[N+](=O)[O-])CC[C@@H]21 ZINC000866204683 1303562029 /nfs/dbraw/zinc/56/20/29/1303562029.db2.gz FZRYMSIREMVJBR-JQWIXIFHSA-N 1 1 340.221 2.888 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3ncc([N+](=O)[O-])cc3C(F)(F)F)CC[C@H]21 ZINC000866206988 1303562928 /nfs/dbraw/zinc/56/29/28/1303562928.db2.gz GYRYZWXDNLKYNF-JOYOIKCWSA-N 1 1 330.310 2.539 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(c3cccc(Br)c3[N+](=O)[O-])CC[C@H]21 ZINC000866210228 1303565605 /nfs/dbraw/zinc/56/56/05/1303565605.db2.gz ZSVOFJOGVKIEDP-ZYHUDNBSSA-N 1 1 340.221 2.888 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000868342058 1304253360 /nfs/dbraw/zinc/25/33/60/1304253360.db2.gz VJXQDJUUKDITBQ-BPUTZDHNSA-N 1 1 346.431 2.700 10 5 EFBEMO Cc1ccc(CNC(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000868392853 1304273987 /nfs/dbraw/zinc/27/39/87/1304273987.db2.gz DAQQMCGTUWQOIR-INIZCTEOSA-N 1 1 348.447 2.680 10 5 EFBEMO C/C(=C/C(=O)N1CC[C@@]2(CC[N@H+](C)C2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000795128551 1305396669 /nfs/dbraw/zinc/39/66/69/1305396669.db2.gz HFMXPIMSRVWGAZ-DEQJRXDXSA-N 1 1 329.400 2.552 10 5 EFBEMO C[C@@]([NH3+])(C(=O)N1CCC[C@H](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870956750 1305708495 /nfs/dbraw/zinc/70/84/95/1305708495.db2.gz GYDUSDBMCACDFS-KSSFIOAISA-N 1 1 331.416 2.807 10 5 EFBEMO C[N@H+]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCC1(C)C ZINC000871153163 1305842186 /nfs/dbraw/zinc/84/21/86/1305842186.db2.gz AILWZSNFSBCTTQ-UHFFFAOYSA-N 1 1 325.796 2.805 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@H+](C)C(C)(C)CC2)c1 ZINC000871152829 1305843270 /nfs/dbraw/zinc/84/32/70/1305843270.db2.gz UMGQVWLRXNZTIO-UHFFFAOYSA-N 1 1 349.431 2.615 10 5 EFBEMO C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CCC1(C)C ZINC000871155228 1305846383 /nfs/dbraw/zinc/84/63/83/1305846383.db2.gz RHZWLIBYAHXDMB-UHFFFAOYSA-N 1 1 342.399 2.699 10 5 EFBEMO CNC(=O)C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000796614243 1306820755 /nfs/dbraw/zinc/82/07/55/1306820755.db2.gz VFYLLTKECUHVOE-OAHLLOKOSA-N 1 1 331.347 2.701 10 5 EFBEMO Nc1ccc([N+](=O)[O-])c(NCc2ccc(C[NH+]3CCOCC3)cc2)c1 ZINC000800846080 1308542548 /nfs/dbraw/zinc/54/25/48/1308542548.db2.gz CFUJQVYNPJDLFU-UHFFFAOYSA-N 1 1 342.399 2.621 10 5 EFBEMO O=C([C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1)N1CCCC1 ZINC000801516981 1310432386 /nfs/dbraw/zinc/43/23/86/1310432386.db2.gz HKOOKOZLRPCRPZ-CQSZACIVSA-N 1 1 335.379 2.568 10 5 EFBEMO CC[N@H+]1CCC[C@@H](CNC(=O)/C=C(/C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000751725226 1311133114 /nfs/dbraw/zinc/13/31/14/1311133114.db2.gz HHNPZELFBXAKMM-SZGZABIGSA-N 1 1 331.416 2.846 10 5 EFBEMO C/C(=C\C(=O)OC[C@H]1C[N@@H+](C(C)C)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC000802135619 1311382262 /nfs/dbraw/zinc/38/22/62/1311382262.db2.gz ZSUJNANCMBXFAH-IDKBZEPQSA-N 1 1 348.399 2.651 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)OC[C@H]1C[N@@H+](C(C)C)CCO1 ZINC000802140930 1311388980 /nfs/dbraw/zinc/38/89/80/1311388980.db2.gz OCKFMTZSXONNPK-OOXMNIKJSA-N 1 1 348.399 2.651 10 5 EFBEMO 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1 1 349.337 2.735 10 5 EFBEMO CC[N@H+](CCNC(=O)c1ccccc1F)Cc1ccccc1[N+](=O)[O-] ZINC001317474366 1328060007 /nfs/dbraw/zinc/06/00/07/1328060007.db2.gz GWXAQHSLYKXSBI-UHFFFAOYSA-N 1 1 345.374 2.986 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ccccc1F)Cc1ccccc1[N+](=O)[O-] ZINC001317474366 1328060011 /nfs/dbraw/zinc/06/00/11/1328060011.db2.gz GWXAQHSLYKXSBI-UHFFFAOYSA-N 1 1 345.374 2.986 10 5 EFBEMO O=C(Cc1ccoc1)NCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001317550172 1328134374 /nfs/dbraw/zinc/13/43/74/1328134374.db2.gz VJQZHKUDSZETTI-UHFFFAOYSA-N 1 1 343.383 2.511 10 5 EFBEMO CC(C)[N@@H+](CCCNC(=O)c1cnco1)Cc1ccc([N+](=O)[O-])cc1 ZINC001317695356 1328303133 /nfs/dbraw/zinc/30/31/33/1328303133.db2.gz NVZUXBFHGUZFIN-UHFFFAOYSA-N 1 1 346.387 2.613 10 5 EFBEMO O=C(CCCC1CC1)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001318144085 1328504756 /nfs/dbraw/zinc/50/47/56/1328504756.db2.gz AHCGEXBJYOJMOK-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO C/C(=C\C(=O)N1CC[N@H+](C2CC2)C[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC001326571738 1330318846 /nfs/dbraw/zinc/31/88/46/1330318846.db2.gz AQUXSOQUPYHNNW-AYYGCFCKSA-N 1 1 343.427 2.941 10 5 EFBEMO CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC001331694381 1330867187 /nfs/dbraw/zinc/86/71/87/1330867187.db2.gz KVXPCEIWTXPPSB-HNNXBMFYSA-N 1 1 346.431 2.773 10 5 EFBEMO C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC[N@H+]1C ZINC001331867104 1330882907 /nfs/dbraw/zinc/88/29/07/1330882907.db2.gz BNTMGWNQYYEIEH-JSGCOSHPSA-N 1 1 327.384 2.961 10 5 EFBEMO COc1cc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)ccc1F ZINC001331966329 1330898095 /nfs/dbraw/zinc/89/80/95/1330898095.db2.gz RMTNVBGOHXWMNZ-QGZVFWFLSA-N 1 1 334.347 2.740 10 5 EFBEMO COc1ccc(C(=O)N2CC[N@@H+](C3CCCC3)[C@H](C)C2)cc1[N+](=O)[O-] ZINC001347813624 1332775586 /nfs/dbraw/zinc/77/55/86/1332775586.db2.gz LOVFMDDIPXINDI-CYBMUJFWSA-N 1 1 347.415 2.692 10 5 EFBEMO C[C@H]1CN(C(=O)c2cc(F)ccc2[N+](=O)[O-])CC[N@H+]1C1CCCC1 ZINC001348348685 1332827262 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UQMMAVUUVHTVAG-VZLFFANISA-N 1 1 343.855 2.545 10 5 EFBEMO O=C(NCC[N@@H+](C/C=C/Cl)C1CCCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001499518057 1402655563 /nfs/dbraw/zinc/65/55/63/1402655563.db2.gz UQMMAVUUVHTVAG-VZLFFANISA-N 1 1 343.855 2.545 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)C1=COCCC1 ZINC001502165437 1404060013 /nfs/dbraw/zinc/06/00/13/1404060013.db2.gz WKXSLPXKFPBAFN-UHFFFAOYSA-N 1 1 347.415 2.569 10 5 EFBEMO CC(C)N(CC[N@@H+](C)CCCC(C)(C)C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001725728878 1425799693 /nfs/dbraw/zinc/79/96/93/1425799693.db2.gz RWWQWADAMIRKTH-HUUCEWRRSA-N 1 1 327.469 2.647 10 5 EFBEMO CC(C)N(CC[N@H+](C)CCCC(C)(C)C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001725728878 1425799696 /nfs/dbraw/zinc/79/96/96/1425799696.db2.gz RWWQWADAMIRKTH-HUUCEWRRSA-N 1 1 327.469 2.647 10 5 EFBEMO CC(C)N(CC[N@@H+](C)CCCC(C)(C)C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001725728878 1425799699 /nfs/dbraw/zinc/79/96/99/1425799699.db2.gz RWWQWADAMIRKTH-HUUCEWRRSA-N 1 1 327.469 2.647 10 5 EFBEMO Cc1[nH]c(CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)c(C)[nH+]1 ZINC001558462947 1415181476 /nfs/dbraw/zinc/18/14/76/1415181476.db2.gz KJALPMVTLLCQQM-UHFFFAOYSA-N 1 1 342.277 2.884 10 5 EFBEMO CC[N@H+]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Cl)C(C)(C)C1 ZINC001558525242 1415185856 /nfs/dbraw/zinc/18/58/56/1415185856.db2.gz HNMIPIVPCKZLMN-CYBMUJFWSA-N 1 1 325.796 2.708 10 5 EFBEMO CCc1c[nH]c2nc[nH+]c(NCCOc3ccc([N+](=O)[O-])cc3)c12 ZINC001559097958 1415224561 /nfs/dbraw/zinc/22/45/61/1415224561.db2.gz LTEBHYNCWLFSPB-UHFFFAOYSA-N 1 1 327.344 2.871 10 5 EFBEMO COc1ccc2ncc([N+](=O)[O-])c(Nc3ccc4[nH+]ccn4c3)c2c1 ZINC001559242569 1415232534 /nfs/dbraw/zinc/23/25/34/1415232534.db2.gz FZMGLLFPYHDXKQ-UHFFFAOYSA-N 1 1 335.323 2.965 10 5 EFBEMO C[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1CCO ZINC001559982585 1415259993 /nfs/dbraw/zinc/25/99/93/1415259993.db2.gz SEPLNTYSMAMQJC-GXTWGEPZSA-N 1 1 346.387 2.628 10 5 EFBEMO COC(=O)[C@@]1(C)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1C ZINC001560063958 1415262582 /nfs/dbraw/zinc/26/25/82/1415262582.db2.gz PFVDSOGAHTWMER-BONVTDFDSA-N 1 1 326.780 2.879 10 5 EFBEMO Cc1nccnc1[C@@H](C)[NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC001560124251 1415264371 /nfs/dbraw/zinc/26/43/71/1415264371.db2.gz RFTLONQUAZZTBW-OLZOCXBDSA-N 1 1 343.387 2.679 10 5 EFBEMO Cc1cccnc1[C@@H](C)[NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001560221487 1415268831 /nfs/dbraw/zinc/26/88/31/1415268831.db2.gz XFVMPHCFVRWVAK-OLZOCXBDSA-N 1 1 328.372 2.976 10 5 EFBEMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C[C@]12CCC[C@H]1OCC2 ZINC001560235902 1415269707 /nfs/dbraw/zinc/26/97/07/1415269707.db2.gz ZBOPCMGBQMYQGD-HZPDHXFCSA-N 1 1 335.360 2.894 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@]1(CO)c1ccccc1 ZINC001560231481 1415269896 /nfs/dbraw/zinc/26/98/96/1415269896.db2.gz UTMNUCKXFLGXQI-IBGZPJMESA-N 1 1 342.395 2.957 10 5 EFBEMO CC[C@@H](NC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1)c1cccc([N+](=O)[O-])c1 ZINC001564377018 1415376207 /nfs/dbraw/zinc/37/62/07/1415376207.db2.gz XSXLQLXAAKQAON-USXIJHARSA-N 1 1 346.431 2.782 10 5 EFBEMO C[N@@H+](CCCNC(=O)C1CC(C)(C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001566449309 1415552365 /nfs/dbraw/zinc/55/23/65/1415552365.db2.gz KWBDXTLTWTVVPP-UHFFFAOYSA-N 1 1 333.432 2.969 10 5 EFBEMO O=C(CCCC1CC1)N[C@@H]1[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21 ZINC001566975392 1415884513 /nfs/dbraw/zinc/88/45/13/1415884513.db2.gz SMZNJDGLVUYOSJ-DZFIZOCASA-N 1 1 343.427 2.722 10 5 EFBEMO C[N@@H+](CCNC(=O)C(C)(C)C(C)(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC001567316192 1416068412 /nfs/dbraw/zinc/06/84/12/1416068412.db2.gz QZYDKOFKJHHYOY-UHFFFAOYSA-N 1 1 343.374 2.824 10 5 EFBEMO CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C2CCC2)cc1 ZINC001567333030 1416077277 /nfs/dbraw/zinc/07/72/77/1416077277.db2.gz HYZGJODHYKVIRO-QZTJIDSGSA-N 1 1 345.443 2.557 10 5 EFBEMO CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C2CCC2)cc1 ZINC001567333030 1416077286 /nfs/dbraw/zinc/07/72/86/1416077286.db2.gz HYZGJODHYKVIRO-QZTJIDSGSA-N 1 1 345.443 2.557 10 5 EFBEMO CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C2CCC2)cc1 ZINC001567333030 1416077295 /nfs/dbraw/zinc/07/72/95/1416077295.db2.gz HYZGJODHYKVIRO-QZTJIDSGSA-N 1 1 345.443 2.557 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1[nH]ccc1C)Cc1cccc([N+](=O)[O-])c1 ZINC001567424346 1416132270 /nfs/dbraw/zinc/13/22/70/1416132270.db2.gz SNFZDQCTQZHJHT-UHFFFAOYSA-N 1 1 344.415 2.873 10 5 EFBEMO Cc1ccoc1CC(=O)N(C)CC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001568495434 1416543693 /nfs/dbraw/zinc/54/36/93/1416543693.db2.gz LHGFUOUWYQWJSI-UHFFFAOYSA-N 1 1 345.399 2.629 10 5 EFBEMO Cc1ccoc1CC(=O)N(C)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001568495434 1416543696 /nfs/dbraw/zinc/54/36/96/1416543696.db2.gz LHGFUOUWYQWJSI-UHFFFAOYSA-N 1 1 345.399 2.629 10 5 EFBEMO Cc1cccc(NCCNC(=O)NCc2ccc(C)c([N+](=O)[O-])c2)[nH+]1 ZINC001684706879 1416728791 /nfs/dbraw/zinc/72/87/91/1416728791.db2.gz UORQKQOHHFGLPP-UHFFFAOYSA-N 1 1 343.387 2.518 10 5 EFBEMO CC(C)=C(C)CC(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001692325298 1417276927 /nfs/dbraw/zinc/27/69/27/1417276927.db2.gz RNJPWQRAMRWYPA-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO CCC(C)(C)C(=O)NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC001699661338 1417443086 /nfs/dbraw/zinc/44/30/86/1417443086.db2.gz MSIMVNMUAISOAZ-UHFFFAOYSA-N 1 1 325.434 2.831 10 5 EFBEMO C[N@H+](CCNC(=O)C1(C(C)(F)F)CC1)Cc1cccc([N+](=O)[O-])c1 ZINC001713467286 1418547498 /nfs/dbraw/zinc/54/74/98/1418547498.db2.gz HOXARMSCJJRLPK-UHFFFAOYSA-N 1 1 341.358 2.578 10 5 EFBEMO C[N@@H+](CCNC(=O)C1(C(C)(F)F)CC1)Cc1cccc([N+](=O)[O-])c1 ZINC001713467286 1418547502 /nfs/dbraw/zinc/54/75/02/1418547502.db2.gz HOXARMSCJJRLPK-UHFFFAOYSA-N 1 1 341.358 2.578 10 5 EFBEMO O=C(NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1)C1CC2(CCC2)C1 ZINC001715861383 1418691869 /nfs/dbraw/zinc/69/18/69/1418691869.db2.gz UOWTWNLCKJMZSE-UPHRSURJSA-N 1 1 349.456 2.999 10 5 EFBEMO CC(C)CC(=O)NCC1=CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001718014127 1419655023 /nfs/dbraw/zinc/65/50/23/1419655023.db2.gz IKGZEWIFDUZLRH-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO CC(C)N(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cc[nH]c1 ZINC001725728544 1425799428 /nfs/dbraw/zinc/79/94/28/1425799428.db2.gz SBWJMFPZZZPBPI-UHFFFAOYSA-N 1 1 344.415 2.906 10 5 EFBEMO O=[N+]([O-])c1cccc(CN2CC[N@H+]3CCC[C@H]3C2)c1Br ZINC000300487075 713408325 /nfs/dbraw/zinc/40/83/25/713408325.db2.gz KJASCMBZJUWFHG-LBPRGKRZSA-N 1 1 340.221 2.637 10 5 EFBEMO C[N@H+]1C[C@@H]2CN(Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@]2(C)C1 ZINC000933733490 715030121 /nfs/dbraw/zinc/03/01/21/715030121.db2.gz KINNOUKEVYYLIR-DOMZBBRYSA-N 1 1 343.349 2.997 10 5 EFBEMO COC(=O)/C=C/c1ccc(NCC[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000108087695 715392903 /nfs/dbraw/zinc/39/29/03/715392903.db2.gz JGHBQBONXLIWEQ-OWNNVSBGSA-N 1 1 347.415 2.925 10 5 EFBEMO C[C@@H]1C[C@@H](NCc2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000162209551 716778256 /nfs/dbraw/zinc/77/82/56/716778256.db2.gz AOTNWHSPRHCVDL-MFKMUULPSA-N 1 1 342.237 2.930 10 5 EFBEMO [NH3+]C[C@@H]1CCC[C@@H]1NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000925764015 717436291 /nfs/dbraw/zinc/43/62/91/717436291.db2.gz VFJDHDZJLZUNEZ-CABZTGNLSA-N 1 1 328.210 2.574 10 5 EFBEMO CC[N@H+]1CC[C@@H]1CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893874002 720136382 /nfs/dbraw/zinc/13/63/82/720136382.db2.gz TVPIBGGMCIGAFW-LLVKDONJSA-N 1 1 343.836 2.551 10 5 EFBEMO COC(=O)[C@H]1[C@H](C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1(F)F ZINC000893945937 720178260 /nfs/dbraw/zinc/17/82/60/720178260.db2.gz OPKIRJDGHYQUCW-UONOGXRCSA-N 1 1 340.326 2.614 10 5 EFBEMO COC(=O)[C@H]1[C@H](C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1(F)F ZINC000893945937 720178262 /nfs/dbraw/zinc/17/82/62/720178262.db2.gz OPKIRJDGHYQUCW-UONOGXRCSA-N 1 1 340.326 2.614 10 5 EFBEMO Cc1cn(C[N@H+]2CCC[C@H](C)CC2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000728707365 724142422 /nfs/dbraw/zinc/14/24/22/724142422.db2.gz MJFYFFLRLZMKJD-AWEZNQCLSA-N 1 1 344.415 2.935 10 5 EFBEMO Cc1cn(C[N@@H+]2CCC[C@H](C)CC2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000728707365 724142424 /nfs/dbraw/zinc/14/24/24/724142424.db2.gz MJFYFFLRLZMKJD-AWEZNQCLSA-N 1 1 344.415 2.935 10 5 EFBEMO CC(=O)c1cc(N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)ccc1[N+](=O)[O-] ZINC000895566981 724203638 /nfs/dbraw/zinc/20/36/38/724203638.db2.gz DPTVFZMKBACIKD-HOCLYGCPSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1cc(N[C@H]2CCC[N@H+]3CCSC[C@@H]23)ccc1[N+](=O)[O-] ZINC000895566981 724203641 /nfs/dbraw/zinc/20/36/41/724203641.db2.gz DPTVFZMKBACIKD-HOCLYGCPSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1ccc(N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)c([N+](=O)[O-])c1 ZINC000895567592 724203785 /nfs/dbraw/zinc/20/37/85/724203785.db2.gz ROQMZHGWRROJCJ-BBRMVZONSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1ccc(N[C@H]2CCC[N@H+]3CCSC[C@@H]23)c([N+](=O)[O-])c1 ZINC000895567592 724203787 /nfs/dbraw/zinc/20/37/87/724203787.db2.gz ROQMZHGWRROJCJ-BBRMVZONSA-N 1 1 335.429 2.789 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@H](c3nccs3)C1)OCCO2 ZINC000895581963 724213078 /nfs/dbraw/zinc/21/30/78/724213078.db2.gz DMXXEALQQJTAOF-LLVKDONJSA-N 1 1 347.396 2.812 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[NH+]3CC(CC4CCOCC4)C3)nc2c1 ZINC000895616532 724224590 /nfs/dbraw/zinc/22/45/90/724224590.db2.gz VVEXVRQVTFKJIW-UHFFFAOYSA-N 1 1 331.372 2.985 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@](CO)(C(F)(F)F)C1 ZINC000895846566 724348078 /nfs/dbraw/zinc/34/80/78/724348078.db2.gz QKBXLJITCBKABD-PKXJPQMGSA-N 1 1 330.306 2.855 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@@](CO)(C(F)(F)F)C1 ZINC000895846566 724348083 /nfs/dbraw/zinc/34/80/83/724348083.db2.gz QKBXLJITCBKABD-PKXJPQMGSA-N 1 1 330.306 2.855 10 5 EFBEMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cn1ccc(Br)n1 ZINC000800865854 725996343 /nfs/dbraw/zinc/99/63/43/725996343.db2.gz LMMLDZSVTBAFGA-UHFFFAOYSA-N 1 1 339.193 2.686 10 5 EFBEMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cn1ccc(Br)n1 ZINC000800865854 725996345 /nfs/dbraw/zinc/99/63/45/725996345.db2.gz LMMLDZSVTBAFGA-UHFFFAOYSA-N 1 1 339.193 2.686 10 5 EFBEMO CN(CC[N@@H+](C)C1CC1)C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000907448518 726946971 /nfs/dbraw/zinc/94/69/71/726946971.db2.gz ORMCLKKXVPRRFC-UHFFFAOYSA-N 1 1 339.823 2.733 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC000908282776 727150457 /nfs/dbraw/zinc/15/04/57/727150457.db2.gz VWWHCHVGOFIEAN-SWLSCSKDSA-N 1 1 333.388 2.949 10 5 EFBEMO CC[N@H+]1CCCN(C(=O)/C=C(\C)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000910280366 727426743 /nfs/dbraw/zinc/42/67/43/727426743.db2.gz AMFSSAXILXNNRB-OKFGHLOFSA-N 1 1 331.416 2.941 10 5 EFBEMO CC[N@H+]1CCCN(C(=O)/C=C(\C)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000910280368 727426910 /nfs/dbraw/zinc/42/69/10/727426910.db2.gz AMFSSAXILXNNRB-ZQHYZAEZSA-N 1 1 331.416 2.941 10 5 EFBEMO Cc1nn(C[N@@H+]2CCCN(c3ccc(C)cc3)CC2)c(C)c1[N+](=O)[O-] ZINC000917485175 727811667 /nfs/dbraw/zinc/81/16/67/727811667.db2.gz LOWLOBLMVNJRLU-UHFFFAOYSA-N 1 1 343.431 2.886 10 5 EFBEMO Cc1nn(C[N@H+]2CCCN(c3ccc(C)cc3)CC2)c(C)c1[N+](=O)[O-] ZINC000917485175 727811668 /nfs/dbraw/zinc/81/16/68/727811668.db2.gz LOWLOBLMVNJRLU-UHFFFAOYSA-N 1 1 343.431 2.886 10 5 EFBEMO CSc1cccc(C(=O)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-] ZINC000913281500 727815014 /nfs/dbraw/zinc/81/50/14/727815014.db2.gz QWIMBUXZRVHRCO-CALCHBBNSA-N 1 1 349.456 2.731 10 5 EFBEMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3cc4cc([N+](=O)[O-])ccc4o3)C[C@@]2(C)C1 ZINC000913288260 727816876 /nfs/dbraw/zinc/81/68/76/727816876.db2.gz CIZBLQIYSFELSB-HDICACEKSA-N 1 1 343.383 2.755 10 5 EFBEMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@@]3(O)CCCC[C@@H]3C2)c1 ZINC000164937620 727998428 /nfs/dbraw/zinc/99/84/28/727998428.db2.gz RUNZCVSOFFZWDQ-PBHICJAKSA-N 1 1 330.388 2.529 10 5 EFBEMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@@]4(O)CCCC[C@@H]4C3)c2c1 ZINC000164990375 728004512 /nfs/dbraw/zinc/00/45/12/728004512.db2.gz VQSMBFJLDXXYFO-PBHICJAKSA-N 1 1 330.388 2.529 10 5 EFBEMO CC/C=C/CC[N@H+]1Cc2ccc(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2C1 ZINC001570310969 1086139511 /nfs/dbraw/zinc/13/95/11/1086139511.db2.gz LWCGAHFJYZMJIU-GVKUHWBJSA-N 1 1 343.427 2.640 10 5 EFBEMO CC/C=C/CC[N@@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1 ZINC001570310969 1086139517 /nfs/dbraw/zinc/13/95/17/1086139517.db2.gz LWCGAHFJYZMJIU-GVKUHWBJSA-N 1 1 343.427 2.640 10 5 EFBEMO CC/C=C/CC[N@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1 ZINC001570310969 1086139523 /nfs/dbraw/zinc/13/95/23/1086139523.db2.gz LWCGAHFJYZMJIU-GVKUHWBJSA-N 1 1 343.427 2.640 10 5 EFBEMO Nc1nnc([C@H]2CCC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)o1 ZINC001647898868 1089906429 /nfs/dbraw/zinc/90/64/29/1089906429.db2.gz ZFXJCHGNFNWBCQ-JTQLQIEISA-N 1 1 337.767 2.593 10 5 EFBEMO Nc1nnc([C@H]2CCC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)o1 ZINC001647898868 1089906438 /nfs/dbraw/zinc/90/64/38/1089906438.db2.gz ZFXJCHGNFNWBCQ-JTQLQIEISA-N 1 1 337.767 2.593 10 5 EFBEMO C[C@H]1CN(CCOc2cccc([N+](=O)[O-])c2)CCN1c1cc[nH+]cc1 ZINC001620542775 1090606940 /nfs/dbraw/zinc/60/69/40/1090606940.db2.gz JWHWDIFCRKRHGL-HNNXBMFYSA-N 1 1 342.399 2.579 10 5 EFBEMO CC(C)[C@@H]1C[C@@H](N2CCCC2)C[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC001648591955 1092235959 /nfs/dbraw/zinc/23/59/59/1092235959.db2.gz SWDJBOYQUCYZBC-QYZOEREBSA-N 1 1 347.459 2.823 10 5 EFBEMO CC(C)[C@@H]1C[C@@H](N2CCCC2)C[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC001648591955 1092235976 /nfs/dbraw/zinc/23/59/76/1092235976.db2.gz SWDJBOYQUCYZBC-QYZOEREBSA-N 1 1 347.459 2.823 10 5 EFBEMO CC[N@@H+](Cc1ccc(C(=O)Nc2c([N+](=O)[O-])cnn2C)cc1)C(C)C ZINC001585612333 1092522958 /nfs/dbraw/zinc/52/29/58/1092522958.db2.gz QJAVHVXUBZYMAD-UHFFFAOYSA-N 1 1 345.403 2.811 10 5 EFBEMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2c(OCC)cccc2[N+](=O)[O-])C1 ZINC001587016097 1092776482 /nfs/dbraw/zinc/77/64/82/1092776482.db2.gz JLRJKCDNXBISRB-AWEZNQCLSA-N 1 1 349.431 2.797 10 5 EFBEMO C/C(=C/C(=O)NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)C1CC1 ZINC001670751424 1092977744 /nfs/dbraw/zinc/97/77/44/1092977744.db2.gz QPCFFTYKGDCKEW-WDZFZDKYSA-N 1 1 335.429 2.751 10 5 EFBEMO COc1ccc(C[C@H]2CC[N@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC001167635576 1093169301 /nfs/dbraw/zinc/16/93/01/1093169301.db2.gz NDLLNUSIZKKDHB-VQIMIIECSA-N 1 1 342.395 2.954 10 5 EFBEMO C[N@H+](CCNC(=O)C1CCC=CCC1)Cc1cccc([N+](=O)[O-])c1 ZINC001267230541 1093292553 /nfs/dbraw/zinc/29/25/53/1093292553.db2.gz RMBLNWYOZAUMHQ-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO C[N@@H+](CCNC(=O)C1CCC=CCC1)Cc1cccc([N+](=O)[O-])c1 ZINC001267230541 1093292564 /nfs/dbraw/zinc/29/25/64/1093292564.db2.gz RMBLNWYOZAUMHQ-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO O=C(Cc1ccco1)NCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001267335054 1093606894 /nfs/dbraw/zinc/60/68/94/1093606894.db2.gz LEVKJNAIZYWUGM-UHFFFAOYSA-N 1 1 343.383 2.511 10 5 EFBEMO O=C(Cc1ccco1)NCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001267335054 1093606900 /nfs/dbraw/zinc/60/69/00/1093606900.db2.gz LEVKJNAIZYWUGM-UHFFFAOYSA-N 1 1 343.383 2.511 10 5 EFBEMO Cc1ccc(NCCNC(=O)c2cc([N+](=O)[O-])ccc2Cl)[nH+]c1 ZINC001597168489 1094568997 /nfs/dbraw/zinc/56/89/97/1094568997.db2.gz DXEHOHVANMTGFT-UHFFFAOYSA-N 1 1 334.763 2.794 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H]3COC[C@H]3C2)ccc1Br ZINC000690774834 1094571112 /nfs/dbraw/zinc/57/11/12/1094571112.db2.gz NQRPYXQYCUWBIN-VXGBXAGGSA-N 1 1 341.205 2.826 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)ccc1Br ZINC000690774834 1094571120 /nfs/dbraw/zinc/57/11/20/1094571120.db2.gz NQRPYXQYCUWBIN-VXGBXAGGSA-N 1 1 341.205 2.826 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H]3COC[C@@H]3C2)ccc1Br ZINC000690774831 1094571940 /nfs/dbraw/zinc/57/19/40/1094571940.db2.gz NQRPYXQYCUWBIN-NEPJUHHUSA-N 1 1 341.205 2.826 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)ccc1Br ZINC000690774831 1094571946 /nfs/dbraw/zinc/57/19/46/1094571946.db2.gz NQRPYXQYCUWBIN-NEPJUHHUSA-N 1 1 341.205 2.826 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1cscn1)Cc1cccc([N+](=O)[O-])c1 ZINC001481132673 1094906689 /nfs/dbraw/zinc/90/66/89/1094906689.db2.gz VYZBHADCSRHAOS-UHFFFAOYSA-N 1 1 348.428 2.693 10 5 EFBEMO CC(C)[N@@H+](CCCNC(=O)C(C)(F)F)Cc1ccccc1[N+](=O)[O-] ZINC001267497204 1094993908 /nfs/dbraw/zinc/99/39/08/1094993908.db2.gz QAKPEBMNVJGPAE-UHFFFAOYSA-N 1 1 343.374 2.967 10 5 EFBEMO C/C(=C/C(=O)NC[C@@H](C)Cn1cc[nH+]c1C)c1ccc([N+](=O)[O-])cc1 ZINC000785364908 1095221358 /nfs/dbraw/zinc/22/13/58/1095221358.db2.gz UHEXYRIDFVGLOR-JFBXQDQPSA-N 1 1 342.399 2.956 10 5 EFBEMO CC(C)CNC(=O)C1([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])CCCC1 ZINC001167829997 1095249214 /nfs/dbraw/zinc/24/92/14/1095249214.db2.gz XIHXLVOTXPMTHZ-UHFFFAOYSA-N 1 1 337.395 2.909 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1[nH]c(C)cc1C)Cc1cccc([N+](=O)[O-])c1 ZINC001480983337 1095661775 /nfs/dbraw/zinc/66/17/75/1095661775.db2.gz XFXFEDOOWGYCRM-UHFFFAOYSA-N 1 1 344.415 2.792 10 5 EFBEMO CC[N@@H+](CCNC(=O)C1CC2(CC2)C1)Cc1cccc([N+](=O)[O-])c1 ZINC001480999316 1095723442 /nfs/dbraw/zinc/72/34/42/1095723442.db2.gz PNROMKFSSHNJSE-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(F)cc1 ZINC001268228964 1096136715 /nfs/dbraw/zinc/13/67/15/1096136715.db2.gz HRLCSPSCQKGOSB-UHFFFAOYSA-N 1 1 345.374 2.938 10 5 EFBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)CCC(F)F ZINC001268244254 1096172359 /nfs/dbraw/zinc/17/23/59/1096172359.db2.gz WNPGCCABXZJANY-UHFFFAOYSA-N 1 1 329.347 2.530 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)CCC(F)F ZINC001268244254 1096172362 /nfs/dbraw/zinc/17/23/62/1096172362.db2.gz WNPGCCABXZJANY-UHFFFAOYSA-N 1 1 329.347 2.530 10 5 EFBEMO Cc1ncccc1C(=O)N(C)CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001268247498 1096173953 /nfs/dbraw/zinc/17/39/53/1096173953.db2.gz MRTOQUCZRJKKBK-UHFFFAOYSA-N 1 1 342.399 2.502 10 5 EFBEMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2N)C1 ZINC001626180935 1097067173 /nfs/dbraw/zinc/06/71/73/1097067173.db2.gz SDTAQMMRFHIDIT-VNHYZAJKSA-N 1 1 346.431 2.654 10 5 EFBEMO O=C(NC1(C[NH2+]CC2CCCCCC2)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001269545080 1098230348 /nfs/dbraw/zinc/23/03/48/1098230348.db2.gz CJTPWXYXJGISNG-HZPDHXFCSA-N 1 1 337.464 2.641 10 5 EFBEMO C[N@@H+]1CC[C@H]1CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC001617183161 1099222683 /nfs/dbraw/zinc/22/26/83/1099222683.db2.gz OUBPCSTWMXGYQS-HNNXBMFYSA-N 1 1 340.383 2.772 10 5 EFBEMO C[N@H+]1CC[C@H]1CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC001617183161 1099222690 /nfs/dbraw/zinc/22/26/90/1099222690.db2.gz OUBPCSTWMXGYQS-HNNXBMFYSA-N 1 1 340.383 2.772 10 5 EFBEMO C/C(=C/C(=O)NCC[N@@H+]1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785266177 1099238277 /nfs/dbraw/zinc/23/82/77/1099238277.db2.gz KMQUUVSKTFRXGA-QAALXFNPSA-N 1 1 331.416 2.846 10 5 EFBEMO CCCn1nccc1NC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC001618196284 1099283253 /nfs/dbraw/zinc/28/32/53/1099283253.db2.gz JFNQEWLWQOTCFK-UHFFFAOYSA-N 1 1 345.403 2.665 10 5 EFBEMO O=C(C[N@H+]1CC[C@@H](C2CCCC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001618677105 1099312180 /nfs/dbraw/zinc/31/21/80/1099312180.db2.gz NECOWUTVQAQXIH-MRXNPFEDSA-N 1 1 343.427 2.996 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H]2CSC[C@@]2(C)C1 ZINC001620647062 1099365654 /nfs/dbraw/zinc/36/56/54/1099365654.db2.gz BOZHLWFSTFZDGO-BFQNTYOBSA-N 1 1 335.429 2.607 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H]2CSC[C@@]2(C)C1 ZINC001620647305 1099366247 /nfs/dbraw/zinc/36/62/47/1099366247.db2.gz KZMXFYZNUAGELO-SUMWQHHRSA-N 1 1 349.456 2.917 10 5 EFBEMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@]2(CO)c2ccccc2)cc1 ZINC001620676220 1099370110 /nfs/dbraw/zinc/37/01/10/1099370110.db2.gz PPRATDYVNVSWGH-LJQANCHMSA-N 1 1 342.395 2.957 10 5 EFBEMO O=C(NCC1([NH2+]CC2CCCCCC2)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001270743688 1099512277 /nfs/dbraw/zinc/51/22/77/1099512277.db2.gz USGZDJCQBDPSQM-HZPDHXFCSA-N 1 1 337.464 2.641 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H](C)[N@H+]1CCC[C@H](C)C1 ZINC001625594688 1099829613 /nfs/dbraw/zinc/82/96/13/1099829613.db2.gz PFKZDOXVMCCTHH-AAEUAGOBSA-N 1 1 337.395 2.893 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC001626939518 1099938626 /nfs/dbraw/zinc/93/86/26/1099938626.db2.gz NWTRUDLSLDSBEX-CYBMUJFWSA-N 1 1 335.379 2.789 10 5 EFBEMO Cc1cc(C(=O)N2CC[N@H+](C)C3(CCCCC3)C2)cc([N+](=O)[O-])c1 ZINC001627991124 1100048962 /nfs/dbraw/zinc/04/89/62/1100048962.db2.gz YNSVPUPSLWEQOP-UHFFFAOYSA-N 1 1 331.416 2.994 10 5 EFBEMO CC(C)(C)[NH+]1CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC001630767698 1100337383 /nfs/dbraw/zinc/33/73/83/1100337383.db2.gz PDRNJNJETJQVQV-UHFFFAOYSA-N 1 1 325.796 2.805 10 5 EFBEMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC001633420886 1100541786 /nfs/dbraw/zinc/54/17/86/1100541786.db2.gz DBYPVVIJBOGFBC-LLVKDONJSA-N 1 1 325.796 2.852 10 5 EFBEMO CC[C@H](NC(=O)N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC001633921440 1100574998 /nfs/dbraw/zinc/57/49/98/1100574998.db2.gz FLDAEFNZORWGLY-PQEBFOHHSA-N 1 1 346.431 2.685 10 5 EFBEMO CCC[N@H+]1CCC[C@H]1CNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001636032163 1100695727 /nfs/dbraw/zinc/69/57/27/1100695727.db2.gz IBMQDLSJJCTRCT-ZDUSSCGKSA-N 1 1 339.823 2.781 10 5 EFBEMO Cc1cc(F)cc(C(=O)N2CCC3(CCC[N@@H+]3C)CC2)c1[N+](=O)[O-] ZINC001637352715 1100775120 /nfs/dbraw/zinc/77/51/20/1100775120.db2.gz PSPFNOJYKPNZHR-UHFFFAOYSA-N 1 1 335.379 2.743 10 5 EFBEMO CC[N@@H+](C)[C@@H]1CCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC001637912889 1100817003 /nfs/dbraw/zinc/81/70/03/1100817003.db2.gz POSZBRGXESOIFN-SNVBAGLBSA-N 1 1 329.759 2.554 10 5 EFBEMO Cc1[nH]c(CNC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])c(C)[nH+]1 ZINC001638892906 1100896154 /nfs/dbraw/zinc/89/61/54/1100896154.db2.gz LGNGPAKUNMOWFY-UHFFFAOYSA-N 1 1 336.779 2.837 10 5 EFBEMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@@H+](C)CC1(C)C ZINC001639136347 1100918826 /nfs/dbraw/zinc/91/88/26/1100918826.db2.gz VZBGYMHDENNEBH-AWEZNQCLSA-N 1 1 337.445 2.777 10 5 EFBEMO CC[N@H+]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Cl)C(C)(C)C1 ZINC001639266166 1100931767 /nfs/dbraw/zinc/93/17/67/1100931767.db2.gz IEODICYGNXTBSE-GFCCVEGCSA-N 1 1 325.796 2.708 10 5 EFBEMO CC[N@H+]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C(C)(C)C1 ZINC001639267346 1100931946 /nfs/dbraw/zinc/93/19/46/1100931946.db2.gz WXKFQSIJVBSOEN-OAHLLOKOSA-N 1 1 342.399 2.603 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1 ZINC001639271934 1100932447 /nfs/dbraw/zinc/93/24/47/1100932447.db2.gz DVSBTLNMDUZWBN-QWHCGFSZSA-N 1 1 335.404 2.914 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N2CC[C@@H]([N@@H+](C)CC)C2)cc1C ZINC001640549015 1101058644 /nfs/dbraw/zinc/05/86/44/1101058644.db2.gz LWLCEYLFIFTKJI-CYBMUJFWSA-N 1 1 335.404 2.610 10 5 EFBEMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001640619975 1101066138 /nfs/dbraw/zinc/06/61/38/1101066138.db2.gz UEVRCJDDPOZPLX-ZDUSSCGKSA-N 1 1 339.823 2.733 10 5 EFBEMO CC[N@@H+](C)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC001640951991 1101091513 /nfs/dbraw/zinc/09/15/13/1101091513.db2.gz FKXZFTCQVKOELQ-LLVKDONJSA-N 1 1 345.321 2.780 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCC1CCN(c2nn(C)cc2[N+](=O)[O-])CC1 ZINC001642400237 1101210614 /nfs/dbraw/zinc/21/06/14/1101210614.db2.gz GDXLZTDQEDGKJG-CQSZACIVSA-N 1 1 335.452 2.809 10 5 EFBEMO O=[N+]([O-])c1cc2c(nc1N[C@@H]1CCC[N@H+]3CCSC[C@@H]13)CCCC2 ZINC001643172163 1101276703 /nfs/dbraw/zinc/27/67/03/1101276703.db2.gz GYBULZKEFNYMPV-ZBFHGGJFSA-N 1 1 348.472 2.860 10 5 EFBEMO COC(=O)/C=C\c1ccc(NCC[N@H+]2CCC(C)(C)C2)c([N+](=O)[O-])c1 ZINC001652315744 1101475633 /nfs/dbraw/zinc/47/56/33/1101475633.db2.gz QZRLQGBTIWBGMR-ALCCZGGFSA-N 1 1 347.415 2.925 10 5 EFBEMO Cc1ccc(NC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)c(N)c1[N+](=O)[O-] ZINC001653215320 1101596307 /nfs/dbraw/zinc/59/63/07/1101596307.db2.gz VGVLYEHHYJYAHF-MRXNPFEDSA-N 1 1 338.383 2.636 10 5 EFBEMO C[C@H]1CN(CCOc2cccc([N+](=O)[O-])c2)CC[N@H+]1C1CCCC1 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CRYHTZAOYIEMCU-IBGZPJMESA-N 1 1 342.395 2.957 10 5 EFBEMO O=C(CC[N@H+]1CCCC[C@@]12CCCOC2)Nc1ccccc1[N+](=O)[O-] ZINC001655921471 1101910260 /nfs/dbraw/zinc/91/02/60/1101910260.db2.gz BOIAYVOBDJMBKL-SFHVURJKSA-N 1 1 347.415 2.959 10 5 EFBEMO CCc1ccc2c(c1)CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C2 ZINC001655919426 1101911021 /nfs/dbraw/zinc/91/10/21/1101911021.db2.gz SGMSWBLQNQQMCP-UHFFFAOYSA-N 1 1 339.395 2.814 10 5 EFBEMO CCc1ccc2c(c1)CC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C2 ZINC001655919426 1101911027 /nfs/dbraw/zinc/91/10/27/1101911027.db2.gz SGMSWBLQNQQMCP-UHFFFAOYSA-N 1 1 339.395 2.814 10 5 EFBEMO C[N@H+]1C[C@@H]2CC[C@@H](Nc3c4cccc(Cl)c4ncc3[N+](=O)[O-])[C@@H]2C1 ZINC001655955458 1101918373 /nfs/dbraw/zinc/91/83/73/1101918373.db2.gz KAUUXHKHDVVSHT-ZKYQVNSYSA-N 1 1 346.818 2.970 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@]12CCC[C@H]1OCC2 ZINC001656559408 1102122477 /nfs/dbraw/zinc/12/24/77/1102122477.db2.gz YLICLKSHOSPDPG-CRAIPNDOSA-N 1 1 347.415 2.733 10 5 EFBEMO CCOCCOC1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC001656989269 1102280886 /nfs/dbraw/zinc/28/08/86/1102280886.db2.gz ZTIZDMXDEVHQBX-UHFFFAOYSA-N 1 1 326.368 2.751 10 5 EFBEMO CCC[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H](CC)C(=O)OCC ZINC001658232179 1102447456 /nfs/dbraw/zinc/44/74/56/1102447456.db2.gz LEEHALHLARLNKO-CVEARBPZSA-N 1 1 338.404 2.682 10 5 EFBEMO CCC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H](CC)C(=O)OCC ZINC001658232179 1102447459 /nfs/dbraw/zinc/44/74/59/1102447459.db2.gz LEEHALHLARLNKO-CVEARBPZSA-N 1 1 338.404 2.682 10 5 EFBEMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](c2ccccc2)[C@H](C(N)=O)C1 ZINC001659013372 1102507139 /nfs/dbraw/zinc/50/71/39/1102507139.db2.gz YLSZCMZBHDJCKW-XOKHGSTOSA-N 1 1 339.395 2.857 10 5 EFBEMO C[N@@H+](CCNC(=O)CC1CC(F)(F)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001480881679 1102568615 /nfs/dbraw/zinc/56/86/15/1102568615.db2.gz IQVDBMARAPFDOC-UHFFFAOYSA-N 1 1 341.358 2.578 10 5 EFBEMO COC(=O)[C@]12CCC[C@H]1C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C2 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347.459 2.587 10 5 EFBEMO CN(CC(C)(C)C[NH2+]CCC1=CCCCC1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001674832396 1106263822 /nfs/dbraw/zinc/26/38/22/1106263822.db2.gz ROKDLFLZZGIMRQ-HZPDHXFCSA-N 1 1 337.464 2.616 10 5 EFBEMO CCc1onc(C)c1C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000929154058 1106320250 /nfs/dbraw/zinc/32/02/50/1106320250.db2.gz HEROBWQREHREGI-UHFFFAOYSA-N 1 1 330.388 2.776 10 5 EFBEMO C[N@@H+](CCNC(=O)CC(C)(C)C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001480861670 1108710333 /nfs/dbraw/zinc/71/03/33/1108710333.db2.gz NDIZEAIIAFPIRS-UHFFFAOYSA-N 1 1 333.432 2.969 10 5 EFBEMO O=C(NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)C1(C2CC2)CC1 ZINC001483742873 1111094635 /nfs/dbraw/zinc/09/46/35/1111094635.db2.gz MYBZWQQKXZEDSD-UHFFFAOYSA-N 1 1 335.429 2.585 10 5 EFBEMO CC(C)=CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CCCCCC1 ZINC001483814548 1112482520 /nfs/dbraw/zinc/48/25/20/1112482520.db2.gz JVJGHKVYSMUENM-IAGOWNOFSA-N 1 1 337.464 2.759 10 5 EFBEMO 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TXTYXTPCOASHKQ-OAHLLOKOSA-N 1 1 335.448 2.946 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000124234647 222396325 /nfs/dbraw/zinc/39/63/25/222396325.db2.gz AKOGSLIZMIAQOT-JQWIXIFHSA-N 1 1 325.796 2.803 10 5 EFBEMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H](CNc3ccccn3)C2)cc1 ZINC000171640514 227190147 /nfs/dbraw/zinc/19/01/47/227190147.db2.gz YYLYXTSDRGACPK-OAHLLOKOSA-N 1 1 342.399 2.803 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](CNc3ccccn3)C2)c1 ZINC000171642043 227192792 /nfs/dbraw/zinc/19/27/92/227192792.db2.gz IIHNSJMQFVANNA-OAHLLOKOSA-N 1 1 342.399 2.803 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](C(=O)OC(C)(C)C)C1 ZINC000178521606 264904610 /nfs/dbraw/zinc/90/46/10/264904610.db2.gz BJJYFDKWIKQNDA-LBPRGKRZSA-N 1 1 336.388 2.767 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(=O)OC(C)(C)C)C1 ZINC000178521606 264904613 /nfs/dbraw/zinc/90/46/13/264904613.db2.gz BJJYFDKWIKQNDA-LBPRGKRZSA-N 1 1 336.388 2.767 10 5 EFBEMO 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COc1ccc(NC(=O)NCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000272761427 266374718 /nfs/dbraw/zinc/37/47/18/266374718.db2.gz ALTIWTNLPXRDEX-GFCCVEGCSA-N 1 1 336.392 2.599 10 5 EFBEMO CC[C@H](NC(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000272778244 266379193 /nfs/dbraw/zinc/37/91/93/266379193.db2.gz RCILCKIAMKEGMD-GUYCJALGSA-N 1 1 346.431 2.996 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](n2cc(C)cn2)C1 ZINC000105899524 273004784 /nfs/dbraw/zinc/00/47/84/273004784.db2.gz BHAVBUBNFVQCHL-MRXNPFEDSA-N 1 1 330.388 2.945 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](n2cc(C)cn2)C1 ZINC000105899524 273004786 /nfs/dbraw/zinc/00/47/86/273004786.db2.gz BHAVBUBNFVQCHL-MRXNPFEDSA-N 1 1 330.388 2.945 10 5 EFBEMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H](CC(F)(F)F)C2)c1 ZINC000278659420 267512888 /nfs/dbraw/zinc/51/28/88/267512888.db2.gz HRQZSHWLDXIZJA-DGCLKSJQSA-N 1 1 348.321 2.609 10 5 EFBEMO CN(C(=O)C[N@@H+]1CC[C@H](CC(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000278726835 267536564 /nfs/dbraw/zinc/53/65/64/267536564.db2.gz LAOFTECHVWONBR-LLVKDONJSA-N 1 1 345.321 2.832 10 5 EFBEMO CN(C(=O)C[N@H+]1CC[C@H](CC(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000278726835 267536566 /nfs/dbraw/zinc/53/65/66/267536566.db2.gz LAOFTECHVWONBR-LLVKDONJSA-N 1 1 345.321 2.832 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000276624101 273138928 /nfs/dbraw/zinc/13/89/28/273138928.db2.gz RKUPUYLLFULXCG-UHFFFAOYSA-N 1 1 325.796 2.771 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000278799640 273162352 /nfs/dbraw/zinc/16/23/52/273162352.db2.gz YEBXEIVOFVWPCB-UHFFFAOYSA-N 1 1 344.371 2.797 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CNC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000279124428 273179461 /nfs/dbraw/zinc/17/94/61/273179461.db2.gz WDNSUWSQCYICKB-LBPRGKRZSA-N 1 1 325.796 2.771 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000280280988 273310875 /nfs/dbraw/zinc/31/08/75/273310875.db2.gz DOOBRRSRHLHYGK-QWHCGFSZSA-N 1 1 335.404 2.548 10 5 EFBEMO O=[N+]([O-])c1cccnc1N1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000281841643 273475727 /nfs/dbraw/zinc/47/57/27/273475727.db2.gz IYELYBPDXWMHLQ-ZDUSSCGKSA-N 1 1 327.388 2.907 10 5 EFBEMO COC(=O)c1cc(N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc(C)c1[N+](=O)[O-] ZINC000286443604 274202503 /nfs/dbraw/zinc/20/25/03/274202503.db2.gz RNUVPJWYRASBHN-NNQSOWQGSA-N 1 1 347.415 2.751 10 5 EFBEMO O=[N+]([O-])c1cnc(N[C@@H]2CCc3[nH+]c[nH]c3C2)c(C(F)(F)F)c1 ZINC000413310980 275041522 /nfs/dbraw/zinc/04/15/22/275041522.db2.gz OECUBPRMXXYAPK-SSDOTTSWSA-N 1 1 327.266 2.701 10 5 EFBEMO O=[N+]([O-])c1cnc(N[C@@H]2CCc3[nH]c[nH+]c3C2)c(C(F)(F)F)c1 ZINC000413310980 275041524 /nfs/dbraw/zinc/04/15/24/275041524.db2.gz OECUBPRMXXYAPK-SSDOTTSWSA-N 1 1 327.266 2.701 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184228727 276183209 /nfs/dbraw/zinc/18/32/09/276183209.db2.gz UHHDSUNKWMMVGH-ZDUSSCGKSA-N 1 1 325.384 2.659 10 5 EFBEMO C[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000362358518 277062300 /nfs/dbraw/zinc/06/23/00/277062300.db2.gz KAAUGJFNTALQLD-CQSZACIVSA-N 1 1 330.363 2.724 10 5 EFBEMO C[C@H]([NH2+]CC(=O)Nc1nc2c(s1)CCC2)c1cccc([N+](=O)[O-])c1 ZINC000341569668 279461111 /nfs/dbraw/zinc/46/11/11/279461111.db2.gz CTZTWJHCDNCMQT-JTQLQIEISA-N 1 1 346.412 2.829 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@H](N2CCOCC2)[C@@H](C)C1 ZINC000245524384 281022677 /nfs/dbraw/zinc/02/26/77/281022677.db2.gz NMVKYIIXOKHCQF-MPGHIAIKSA-N 1 1 333.432 2.617 10 5 EFBEMO C[N@@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])o2)[C@@H]1c1ccc(F)cc1 ZINC000361193054 290214123 /nfs/dbraw/zinc/21/41/23/290214123.db2.gz ZDOQREZWWMEJPJ-WFASDCNBSA-N 1 1 333.319 2.502 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])o2)[C@@H]1c1ccc(F)cc1 ZINC000361193054 290214125 /nfs/dbraw/zinc/21/41/25/290214125.db2.gz ZDOQREZWWMEJPJ-WFASDCNBSA-N 1 1 333.319 2.502 10 5 EFBEMO C[N@H+]1C[C@@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000371528344 290276540 /nfs/dbraw/zinc/27/65/40/290276540.db2.gz LCHOWKGOEIPVOA-HZPDHXFCSA-N 1 1 343.358 2.562 10 5 EFBEMO C[N@@H+](CCNC(=O)NCCc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000126661140 293046582 /nfs/dbraw/zinc/04/65/82/293046582.db2.gz AJLLYFMVKUEINY-UHFFFAOYSA-N 1 1 348.447 2.701 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC000294002230 295096603 /nfs/dbraw/zinc/09/66/03/295096603.db2.gz XJXLTWDBBKTWSM-MRXNPFEDSA-N 1 1 337.807 2.724 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000294543526 295183563 /nfs/dbraw/zinc/18/35/63/295183563.db2.gz QKOFBLXMNKXGQL-CQSZACIVSA-N 1 1 347.415 2.548 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@](C)(F)C1 ZINC000295058690 295262899 /nfs/dbraw/zinc/26/28/99/295262899.db2.gz BEWYBOBTBCJCSU-INIZCTEOSA-N 1 1 339.367 2.756 10 5 EFBEMO C[C@]1(F)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000295283739 295293100 /nfs/dbraw/zinc/29/31/00/295293100.db2.gz DHPCPCGPLDOBBI-HNNXBMFYSA-N 1 1 327.331 2.887 10 5 EFBEMO COC(=O)c1cc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc(C)c1[N+](=O)[O-] ZINC000295866656 295388832 /nfs/dbraw/zinc/38/88/32/295388832.db2.gz CHUIGVOLYFHNSD-AGUYFDCRSA-N 1 1 333.388 2.727 10 5 EFBEMO CN(C)C(=O)C1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000172017815 310756525 /nfs/dbraw/zinc/75/65/25/310756525.db2.gz KOLVFYQMYYYXFL-UHFFFAOYSA-N 1 1 325.796 2.548 10 5 EFBEMO C[C@@H]1CC[N@H+](CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000299677469 311110091 /nfs/dbraw/zinc/11/00/91/311110091.db2.gz UPJFGZSPHNYESA-LLVKDONJSA-N 1 1 346.412 2.999 10 5 EFBEMO C[C@@H]1CC[N@@H+](CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000299677469 311110092 /nfs/dbraw/zinc/11/00/92/311110092.db2.gz UPJFGZSPHNYESA-LLVKDONJSA-N 1 1 346.412 2.999 10 5 EFBEMO C[N@@H+](CCO)C1(CNc2ccc(F)cc2[N+](=O)[O-])CCCCC1 ZINC000301307112 311130257 /nfs/dbraw/zinc/13/02/57/311130257.db2.gz ZBQNCGZBSSCOJC-UHFFFAOYSA-N 1 1 325.384 2.773 10 5 EFBEMO COCc1cc([N+](=O)[O-])ccc1N1C[C@@H]2C[N@H+]3CCCC[C@H]3[C@H]2C1 ZINC000301472612 311139133 /nfs/dbraw/zinc/13/91/33/311139133.db2.gz LCHVRYNNILLLKV-ZVZYQTTQSA-N 1 1 331.416 2.662 10 5 EFBEMO Cc1ccc(N2CCCC[C@@H](N3CC[NH+](C)CC3)C2)c([N+](=O)[O-])c1 ZINC000301805100 311159345 /nfs/dbraw/zinc/15/93/45/311159345.db2.gz DWCDCTKFMMCBOD-MRXNPFEDSA-N 1 1 332.448 2.510 10 5 EFBEMO COCC[N@H+]1CCN(c2cc(C)nc3c2cccc3[N+](=O)[O-])C[C@@H]1C ZINC000301979262 311169835 /nfs/dbraw/zinc/16/98/35/311169835.db2.gz AJWJHKUCFRIZRY-AWEZNQCLSA-N 1 1 344.415 2.608 10 5 EFBEMO Cc1nn(C)c(NCC[N@@H+]2CCc3c(Cl)cccc3C2)c1[N+](=O)[O-] ZINC000302617622 311194498 /nfs/dbraw/zinc/19/44/98/311194498.db2.gz CTOSJOKRGPNDPO-UHFFFAOYSA-N 1 1 349.822 2.760 10 5 EFBEMO Cc1nn(C)c(NCC[N@H+]2CCc3c(Cl)cccc3C2)c1[N+](=O)[O-] ZINC000302617622 311194499 /nfs/dbraw/zinc/19/44/99/311194499.db2.gz CTOSJOKRGPNDPO-UHFFFAOYSA-N 1 1 349.822 2.760 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H](O)COCc1cccs1)C2 ZINC000305445420 311223142 /nfs/dbraw/zinc/22/31/42/311223142.db2.gz PBACWKOYHVSMPB-CQSZACIVSA-N 1 1 348.424 2.592 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)COCc1cccs1)C2 ZINC000305445420 311223144 /nfs/dbraw/zinc/22/31/44/311223144.db2.gz PBACWKOYHVSMPB-CQSZACIVSA-N 1 1 348.424 2.592 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000330836429 311337686 /nfs/dbraw/zinc/33/76/86/311337686.db2.gz IFEWZNMBJYFZJL-HOCLYGCPSA-N 1 1 349.431 2.571 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000330836429 311337688 /nfs/dbraw/zinc/33/76/88/311337688.db2.gz IFEWZNMBJYFZJL-HOCLYGCPSA-N 1 1 349.431 2.571 10 5 EFBEMO Cc1sc(C(=O)NCC[N@H+]2CCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000331295572 311365767 /nfs/dbraw/zinc/36/57/67/311365767.db2.gz NOMOUZJUHGQJFH-UHFFFAOYSA-N 1 1 325.434 2.817 10 5 EFBEMO CC[NH+](CC)[C@H](C)CN[C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000475330888 313221391 /nfs/dbraw/zinc/22/13/91/313221391.db2.gz DMQHSRHRUIJLQT-ZIAGYGMSSA-N 1 1 336.436 2.632 10 5 EFBEMO CCOc1cc(C[N@@H+]2CCC[C@H]2C(=O)N(CC)CC)ccc1[N+](=O)[O-] ZINC000492464077 314000146 /nfs/dbraw/zinc/00/01/46/314000146.db2.gz SITHQLFDDLUHHJ-INIZCTEOSA-N 1 1 349.431 2.826 10 5 EFBEMO CCOc1cc(C[N@H+]2CCC[C@H]2C(=O)N(CC)CC)ccc1[N+](=O)[O-] ZINC000492464077 314000150 /nfs/dbraw/zinc/00/01/50/314000150.db2.gz SITHQLFDDLUHHJ-INIZCTEOSA-N 1 1 349.431 2.826 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000493253041 314292715 /nfs/dbraw/zinc/29/27/15/314292715.db2.gz JGDWRGKDYAHDEK-BBRMVZONSA-N 1 1 346.431 2.842 10 5 EFBEMO COc1cc(C[NH2+][C@@H](CO)c2sccc2C)c([N+](=O)[O-])cc1F ZINC000494624326 314614522 /nfs/dbraw/zinc/61/45/22/314614522.db2.gz GMXYSCLYFSYXMK-LBPRGKRZSA-N 1 1 340.376 2.936 10 5 EFBEMO C[NH+](C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)c1ccccc1Cl ZINC000531886477 317328358 /nfs/dbraw/zinc/32/83/58/317328358.db2.gz GKSCYOZZHHQHOO-HNNXBMFYSA-N 1 1 348.790 2.676 10 5 EFBEMO C[C@H](C(=O)N1CC[NH2+][C@@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000562958532 318719450 /nfs/dbraw/zinc/71/94/50/318719450.db2.gz IBYBOZCZUGODDB-KBXCAEBGSA-N 1 1 339.395 2.871 10 5 EFBEMO Cc1nsc(C)c1C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000566834819 319113944 /nfs/dbraw/zinc/11/39/44/319113944.db2.gz IBCKSQLONDZLON-UHFFFAOYSA-N 1 1 332.429 2.990 10 5 EFBEMO CC1(C)C[NH+](CC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000577745300 320140992 /nfs/dbraw/zinc/14/09/92/320140992.db2.gz GFXAOHMSCIFNMS-OAHLLOKOSA-N 1 1 331.416 2.643 10 5 EFBEMO C[C@H]1CC[N@H+](CC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000581379473 324365513 /nfs/dbraw/zinc/36/55/13/324365513.db2.gz ODZAZBAAVDFEOM-VIFPVBQESA-N 1 1 342.193 2.638 10 5 EFBEMO C[C@H]1CC[N@@H+](CC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000581379473 324365516 /nfs/dbraw/zinc/36/55/16/324365516.db2.gz ODZAZBAAVDFEOM-VIFPVBQESA-N 1 1 342.193 2.638 10 5 EFBEMO C[N@H+](Cc1cccnc1)C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2)C1 ZINC000190449567 473279699 /nfs/dbraw/zinc/27/96/99/473279699.db2.gz RTLFNQSBQDQGIR-MRXNPFEDSA-N 1 1 326.400 2.948 10 5 EFBEMO Cc1cc([N+](=O)[O-])cnc1N1CC[C@H](C[N@H+](C)Cc2cccnc2)C1 ZINC000190450515 473278851 /nfs/dbraw/zinc/27/88/51/473278851.db2.gz CJZUWXZYXMGKHO-MRXNPFEDSA-N 1 1 341.415 2.652 10 5 EFBEMO C[N@H+](Cc1cccnc1)C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2)C1 ZINC000190449547 473279217 /nfs/dbraw/zinc/27/92/17/473279217.db2.gz RTLFNQSBQDQGIR-INIZCTEOSA-N 1 1 326.400 2.948 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000124799447 473305303 /nfs/dbraw/zinc/30/53/03/473305303.db2.gz WEGMLUOAXJLKSF-JSGCOSHPSA-N 1 1 337.445 2.628 10 5 EFBEMO CCc1ccc(C(=O)N2CCC[C@@H]2Cn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000177148128 473318527 /nfs/dbraw/zinc/31/85/27/473318527.db2.gz XNBODKBPNNQUMC-MRXNPFEDSA-N 1 1 342.399 2.967 10 5 EFBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177212091 473331503 /nfs/dbraw/zinc/33/15/03/473331503.db2.gz VJAYGSCAMWULOK-HNNXBMFYSA-N 1 1 328.372 2.713 10 5 EFBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1C ZINC000177207269 473332443 /nfs/dbraw/zinc/33/24/43/473332443.db2.gz ORNPGSRZVIDHNE-OAHLLOKOSA-N 1 1 328.372 2.713 10 5 EFBEMO CCc1n[nH]c(C2CC[NH+](CCOc3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000190703796 473367857 /nfs/dbraw/zinc/36/78/57/473367857.db2.gz TTZVEUZDXQZTTR-UHFFFAOYSA-N 1 1 345.403 2.534 10 5 EFBEMO CCc1nc(C2CC[NH+](CCOc3cccc([N+](=O)[O-])c3)CC2)n[nH]1 ZINC000190703796 473367864 /nfs/dbraw/zinc/36/78/64/473367864.db2.gz TTZVEUZDXQZTTR-UHFFFAOYSA-N 1 1 345.403 2.534 10 5 EFBEMO COc1ccc(N2CC[NH+]([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)nc1 ZINC000452043490 476792403 /nfs/dbraw/zinc/79/24/03/476792403.db2.gz BAIWEBPXGHSHSE-CQSZACIVSA-N 1 1 342.399 2.882 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1cc(=O)n2ccccc2n1 ZINC000024863536 472070967 /nfs/dbraw/zinc/07/09/67/472070967.db2.gz OJFLRFGUBCXKKA-ZDUSSCGKSA-N 1 1 338.367 2.796 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cc(=O)n2ccccc2n1 ZINC000024863536 472070973 /nfs/dbraw/zinc/07/09/73/472070973.db2.gz OJFLRFGUBCXKKA-ZDUSSCGKSA-N 1 1 338.367 2.796 10 5 EFBEMO Cc1sc(C(=O)NCCC[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000068007587 472121628 /nfs/dbraw/zinc/12/16/28/472121628.db2.gz DGGZKQTWIVMBKN-LLVKDONJSA-N 1 1 325.434 2.959 10 5 EFBEMO C[N@@H+](CCc1ccc(F)cc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000055023860 472131798 /nfs/dbraw/zinc/13/17/98/472131798.db2.gz JSZJZQJGXZVBBB-UHFFFAOYSA-N 1 1 331.347 2.507 10 5 EFBEMO Cc1ccc([C@@H]2CCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1C ZINC000076082584 472263684 /nfs/dbraw/zinc/26/36/84/472263684.db2.gz QTGDPSDIACEXHL-ROUUACIJSA-N 1 1 344.415 2.606 10 5 EFBEMO COC(=O)/C=C/c1ccc(N[C@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000069000650 472277076 /nfs/dbraw/zinc/27/70/76/472277076.db2.gz UAEVDVCYEVAFIA-DYLGSBMWSA-N 1 1 333.388 2.676 10 5 EFBEMO C[NH+](C)[C@@H](CNC(=S)Nc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000057011196 472373194 /nfs/dbraw/zinc/37/31/94/472373194.db2.gz XTBCPXFNDIHXHE-HNNXBMFYSA-N 1 1 345.428 2.579 10 5 EFBEMO CCN(CC)C(=O)C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000069701775 472402331 /nfs/dbraw/zinc/40/23/31/472402331.db2.gz SJLJXYAWSXVKMZ-UHFFFAOYSA-N 1 1 337.395 2.814 10 5 EFBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000128260021 472425614 /nfs/dbraw/zinc/42/56/14/472425614.db2.gz YCQWKTHFXLDVQW-MRXNPFEDSA-N 1 1 342.399 2.642 10 5 EFBEMO Cc1sc(C(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000032737758 472461801 /nfs/dbraw/zinc/46/18/01/472461801.db2.gz GELWEBHXRVFLIN-MNOVXSKESA-N 1 1 325.434 2.957 10 5 EFBEMO C[C@H]1CCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000154906870 472484983 /nfs/dbraw/zinc/48/49/83/472484983.db2.gz DNOAMBPDXJDSTM-LBPRGKRZSA-N 1 1 334.376 2.956 10 5 EFBEMO C[C@@H]1CCC[N@H+]1C1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1 ZINC000154926417 472487827 /nfs/dbraw/zinc/48/78/27/472487827.db2.gz KXVYGCSSCVWVPK-LLVKDONJSA-N 1 1 335.433 2.757 10 5 EFBEMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC[C@H](Cn2cncn2)C1 ZINC000119127097 472529505 /nfs/dbraw/zinc/52/95/05/472529505.db2.gz AKOBWIVSNZDGQJ-LBPRGKRZSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@H](Cn2cncn2)C1 ZINC000119127097 472529509 /nfs/dbraw/zinc/52/95/09/472529509.db2.gz AKOBWIVSNZDGQJ-LBPRGKRZSA-N 1 1 335.795 2.752 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000155686527 472595653 /nfs/dbraw/zinc/59/56/53/472595653.db2.gz LKKAYALMRMXFHP-MFKMUULPSA-N 1 1 325.796 2.707 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1C[C@@H]2CCC[N@@H+]2C[C@@H]1C ZINC000119886210 472597760 /nfs/dbraw/zinc/59/77/60/472597760.db2.gz RGJGXCQLSVHNLC-KBPBESRZSA-N 1 1 332.404 2.912 10 5 EFBEMO CC[C@H](NC(=O)NC[C@@H](C)[N@@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000090560571 472636781 /nfs/dbraw/zinc/63/67/81/472636781.db2.gz ZBPRTJDHTDCPIU-WBMJQRKESA-N 1 1 334.420 2.828 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H]1CC(N)=O ZINC000104680059 472681887 /nfs/dbraw/zinc/68/18/87/472681887.db2.gz DHPNOSQFJCRAPB-AWEZNQCLSA-N 1 1 335.404 2.612 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1CC(N)=O ZINC000104680055 472682874 /nfs/dbraw/zinc/68/28/74/472682874.db2.gz DHPNOSQFJCRAPB-CQSZACIVSA-N 1 1 335.404 2.612 10 5 EFBEMO CCC[N@H+]1CC[C@@H](CNc2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)C1 ZINC000091457340 472768355 /nfs/dbraw/zinc/76/83/55/472768355.db2.gz MEDZULMGMRIHHT-ZDUSSCGKSA-N 1 1 335.404 2.834 10 5 EFBEMO CC[N@H+](CCc1nccs1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000121032612 472786834 /nfs/dbraw/zinc/78/68/34/472786834.db2.gz JECUNRFPPFBKFL-LBPRGKRZSA-N 1 1 348.428 2.943 10 5 EFBEMO CC[N@@H+](CCc1nccs1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000121032612 472786839 /nfs/dbraw/zinc/78/68/39/472786839.db2.gz JECUNRFPPFBKFL-LBPRGKRZSA-N 1 1 348.428 2.943 10 5 EFBEMO CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000105852956 472789509 /nfs/dbraw/zinc/78/95/09/472789509.db2.gz KVCJQEXMSIGNQC-ZDUSSCGKSA-N 1 1 346.362 2.970 10 5 EFBEMO Cc1cnc(CC[N@@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])s1 ZINC000157555123 472832702 /nfs/dbraw/zinc/83/27/02/472832702.db2.gz SIHMREWLAAHJSQ-GFCCVEGCSA-N 1 1 348.428 2.861 10 5 EFBEMO Cc1cnc(CC[N@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])s1 ZINC000157555123 472832710 /nfs/dbraw/zinc/83/27/10/472832710.db2.gz SIHMREWLAAHJSQ-GFCCVEGCSA-N 1 1 348.428 2.861 10 5 EFBEMO Cc1cnn([C@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000106220225 472833028 /nfs/dbraw/zinc/83/30/28/472833028.db2.gz BYKVFCAIZKMJLB-INIZCTEOSA-N 1 1 330.388 2.816 10 5 EFBEMO Cc1cnn([C@@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000106220222 472834471 /nfs/dbraw/zinc/83/44/71/472834471.db2.gz BYKVFCAIZKMJLB-MRXNPFEDSA-N 1 1 330.388 2.816 10 5 EFBEMO C[C@@H]1C[N@H+](C2CCN(C/C=C/c3ccccc3[N+](=O)[O-])CC2)CCO1 ZINC000092078973 472854664 /nfs/dbraw/zinc/85/46/64/472854664.db2.gz GUTNIONJUNPJKG-MQDFFIGUSA-N 1 1 345.443 2.793 10 5 EFBEMO C[C@@H]1CN(C2CC[NH+](C/C=C/c3ccccc3[N+](=O)[O-])CC2)CCO1 ZINC000092078973 472854669 /nfs/dbraw/zinc/85/46/69/472854669.db2.gz GUTNIONJUNPJKG-MQDFFIGUSA-N 1 1 345.443 2.793 10 5 EFBEMO COc1ccc(C[N@H+]2CCCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1 ZINC000073869909 472892324 /nfs/dbraw/zinc/89/23/24/472892324.db2.gz GDAPOFQLZOLVTC-UHFFFAOYSA-N 1 1 342.399 2.711 10 5 EFBEMO CNC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000121903349 472941696 /nfs/dbraw/zinc/94/16/96/472941696.db2.gz BCXXSLJJZHTJEC-HNNXBMFYSA-N 1 1 329.356 2.565 10 5 EFBEMO CNC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000121903349 472941698 /nfs/dbraw/zinc/94/16/98/472941698.db2.gz BCXXSLJJZHTJEC-HNNXBMFYSA-N 1 1 329.356 2.565 10 5 EFBEMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)C[C@H](O)COCc1ccccc1 ZINC000074289412 472979270 /nfs/dbraw/zinc/97/92/70/472979270.db2.gz YLUZZSBSYCBUQK-HNNXBMFYSA-N 1 1 336.413 2.666 10 5 EFBEMO C[N@H+](Cc1csc([N+](=O)[O-])c1)C[C@H](O)COCc1ccccc1 ZINC000074289412 472979276 /nfs/dbraw/zinc/97/92/76/472979276.db2.gz YLUZZSBSYCBUQK-HNNXBMFYSA-N 1 1 336.413 2.666 10 5 EFBEMO CC[N@H+](CCc1nccs1)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000159150906 473003200 /nfs/dbraw/zinc/00/32/00/473003200.db2.gz TYKUVKAHCTWIFR-UHFFFAOYSA-N 1 1 348.428 2.863 10 5 EFBEMO CC[N@@H+](CCc1nccs1)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000159150906 473003206 /nfs/dbraw/zinc/00/32/06/473003206.db2.gz TYKUVKAHCTWIFR-UHFFFAOYSA-N 1 1 348.428 2.863 10 5 EFBEMO O=[N+]([O-])c1ccc(SC[C@H](O)C[N@H+]2CCc3ccccc3C2)nc1 ZINC000159190568 473007082 /nfs/dbraw/zinc/00/70/82/473007082.db2.gz SVVIBPNIUZGWJC-MRXNPFEDSA-N 1 1 345.424 2.501 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000093011117 473026156 /nfs/dbraw/zinc/02/61/56/473026156.db2.gz MUGATZJQVJDWPK-FZMUQLTDSA-N 1 1 345.443 2.795 10 5 EFBEMO C[N@H+]1CCC[C@H]1CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000051383497 473045301 /nfs/dbraw/zinc/04/53/01/473045301.db2.gz ADUNIULMLPNIIQ-ZDUSSCGKSA-N 1 1 346.412 2.542 10 5 EFBEMO C[N@H+]1CCC[C@H]1CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000051383500 473045604 /nfs/dbraw/zinc/04/56/04/473045604.db2.gz ZUWIKZIIGLTIMG-ZDUSSCGKSA-N 1 1 346.412 2.542 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCCN1CCC(C[NH+]2CCCC2)CC1 ZINC000051907939 473071751 /nfs/dbraw/zinc/07/17/51/473071751.db2.gz RMCQLWAUGBZXRP-UHFFFAOYSA-N 1 1 333.432 2.781 10 5 EFBEMO CC[N@H+]1CCC[C@H](Nc2ncc([N+](=O)[O-])cc2Br)C1 ZINC000093433925 473108092 /nfs/dbraw/zinc/10/80/92/473108092.db2.gz FRYMWFLPIYVBFI-VIFPVBQESA-N 1 1 329.198 2.649 10 5 EFBEMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2c([N+](=O)[O-])ncn2C)cc1 ZINC000080927751 473103684 /nfs/dbraw/zinc/10/36/84/473103684.db2.gz IOOKECBNMKHYMX-NSHDSACASA-N 1 1 326.360 2.996 10 5 EFBEMO CC[N@@H+]1CCC[C@@H](Nc2ncc([N+](=O)[O-])cc2Br)C1 ZINC000093433926 473107242 /nfs/dbraw/zinc/10/72/42/473107242.db2.gz FRYMWFLPIYVBFI-SECBINFHSA-N 1 1 329.198 2.649 10 5 EFBEMO CC[N@H+]1CCC[C@@H](Nc2ncc([N+](=O)[O-])cc2Br)C1 ZINC000093433926 473107246 /nfs/dbraw/zinc/10/72/46/473107246.db2.gz FRYMWFLPIYVBFI-SECBINFHSA-N 1 1 329.198 2.649 10 5 EFBEMO CC[N@@H+]1CCC[C@H](Nc2ncc([N+](=O)[O-])cc2Br)C1 ZINC000093433925 473108085 /nfs/dbraw/zinc/10/80/85/473108085.db2.gz FRYMWFLPIYVBFI-VIFPVBQESA-N 1 1 329.198 2.649 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1C[C@@H]2CCC[N@@H+]2C[C@@H]1C ZINC000094139736 473180566 /nfs/dbraw/zinc/18/05/66/473180566.db2.gz JIVZOBBLRKUKOZ-ZFWWWQNUSA-N 1 1 331.416 2.829 10 5 EFBEMO CCOc1ccc(C(=O)NC[C@H]2CCCC[N@H+]2CC)cc1[N+](=O)[O-] ZINC000110994078 473187601 /nfs/dbraw/zinc/18/76/01/473187601.db2.gz BXSQXMKCUAZUKB-CQSZACIVSA-N 1 1 335.404 2.598 10 5 EFBEMO CCOc1ccc(C(=O)NC[C@@H]2CCCC[N@H+]2CC)cc1[N+](=O)[O-] ZINC000110994082 473187872 /nfs/dbraw/zinc/18/78/72/473187872.db2.gz BXSQXMKCUAZUKB-AWEZNQCLSA-N 1 1 335.404 2.598 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)Cn1cc[nH+]c1C ZINC000185360689 473405187 /nfs/dbraw/zinc/40/51/87/473405187.db2.gz VKVDMSUFLDLBPC-LFGHMXSPSA-N 1 1 342.399 2.956 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H](CO)CC(C)C ZINC000185365034 473407347 /nfs/dbraw/zinc/40/73/47/473407347.db2.gz NUMQIMWFRXDORM-HNNXBMFYSA-N 1 1 337.420 2.571 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177712866 473422419 /nfs/dbraw/zinc/42/24/19/473422419.db2.gz GXSPCJAXVARIGH-MRXNPFEDSA-N 1 1 348.447 2.648 10 5 EFBEMO CCN1CCC[C@@H]1C[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177712866 473422427 /nfs/dbraw/zinc/42/24/27/473422427.db2.gz GXSPCJAXVARIGH-MRXNPFEDSA-N 1 1 348.447 2.648 10 5 EFBEMO CCN1CCC[C@@H]1C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177712866 473422432 /nfs/dbraw/zinc/42/24/32/473422432.db2.gz GXSPCJAXVARIGH-MRXNPFEDSA-N 1 1 348.447 2.648 10 5 EFBEMO Cc1ccc(C[NH+]2CCC(c3nc(N(C)C)no3)CC2)cc1[N+](=O)[O-] ZINC000191907556 473588779 /nfs/dbraw/zinc/58/87/79/473588779.db2.gz NANYOQVCJPQOAI-UHFFFAOYSA-N 1 1 345.403 2.732 10 5 EFBEMO CC[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000127436143 473613496 /nfs/dbraw/zinc/61/34/96/473613496.db2.gz OQIFNRNGKCMSLB-GFCCVEGCSA-N 1 1 345.321 2.828 10 5 EFBEMO CC[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CCN1CC(F)F ZINC000153688896 473637452 /nfs/dbraw/zinc/63/74/52/473637452.db2.gz PTWPQYDTGNPBQW-CQSZACIVSA-N 1 1 327.375 2.799 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(NCC2(N3CCCCC3)CC[NH+](C)CC2)n1 ZINC000127761808 473648339 /nfs/dbraw/zinc/64/83/39/473648339.db2.gz XBMDDKCEXULVRL-UHFFFAOYSA-N 1 1 347.463 2.660 10 5 EFBEMO CCOc1ccc(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000172837126 473691294 /nfs/dbraw/zinc/69/12/94/473691294.db2.gz CMLXXKLWWFITRB-OAHLLOKOSA-N 1 1 349.431 2.940 10 5 EFBEMO CCN(C)C(=O)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000186818497 473763188 /nfs/dbraw/zinc/76/31/88/473763188.db2.gz XTXJBIWKGZCUJZ-SFHVURJKSA-N 1 1 327.384 2.752 10 5 EFBEMO C[C@H](NC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000245970164 473767875 /nfs/dbraw/zinc/76/78/75/473767875.db2.gz NYALQTLXRURIMD-JLJPHGGASA-N 1 1 346.431 2.782 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2csc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000180157519 473814317 /nfs/dbraw/zinc/81/43/17/473814317.db2.gz KOMWSVIVRMOUJY-HIFRSBDPSA-N 1 1 331.397 2.832 10 5 EFBEMO COc1ccc(OCC[N@H+]2CCCC[C@@H]2c2cn[nH]c2)c([N+](=O)[O-])c1 ZINC000173398574 473825763 /nfs/dbraw/zinc/82/57/63/473825763.db2.gz VASDKMRWCTUQFA-OAHLLOKOSA-N 1 1 346.387 2.933 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000246755676 473953534 /nfs/dbraw/zinc/95/35/34/473953534.db2.gz BNTVPERQSROUCE-RHSMWYFYSA-N 1 1 348.447 2.632 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](c2ccsc2)[C@H](CO)C1 ZINC000188086146 473977481 /nfs/dbraw/zinc/97/74/81/473977481.db2.gz SZVYXQMHWGNQEU-HOCLYGCPSA-N 1 1 348.424 2.873 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000174533310 474058511 /nfs/dbraw/zinc/05/85/11/474058511.db2.gz JQCIZLHGTYAKTB-LBPRGKRZSA-N 1 1 325.796 2.805 10 5 EFBEMO Nc1ccc(N2CCN(c3ccc([N+](=O)[O-])cc3Cl)CC2)c[nH+]1 ZINC000264611323 474059687 /nfs/dbraw/zinc/05/96/87/474059687.db2.gz FQSKFZDJWAWOLU-UHFFFAOYSA-N 1 1 333.779 2.552 10 5 EFBEMO CCOCC[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC)c2)C[C@H]1CC ZINC000174737814 474088370 /nfs/dbraw/zinc/08/83/70/474088370.db2.gz FCQNFDWCBBIULR-CQSZACIVSA-N 1 1 337.420 2.541 10 5 EFBEMO CSc1ccc(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000247246047 474097857 /nfs/dbraw/zinc/09/78/57/474097857.db2.gz NHQPFXCYQGTKGZ-AAEUAGOBSA-N 1 1 335.429 2.625 10 5 EFBEMO CSc1ccc(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)cc1[N+](=O)[O-] ZINC000247246063 474098788 /nfs/dbraw/zinc/09/87/88/474098788.db2.gz NHQPFXCYQGTKGZ-YPMHNXCESA-N 1 1 335.429 2.625 10 5 EFBEMO CCn1c(C)nc([N+](=O)[O-])c1N[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC000288964481 474105037 /nfs/dbraw/zinc/10/50/37/474105037.db2.gz UBCXBHTWYIUNNW-GJZGRUSLSA-N 1 1 329.404 2.977 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000247289067 474110046 /nfs/dbraw/zinc/11/00/46/474110046.db2.gz KSSNUYPTNQRDDY-MLGOLLRUSA-N 1 1 346.431 2.628 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000188506135 474113928 /nfs/dbraw/zinc/11/39/28/474113928.db2.gz QISSFRRUYKOQCL-LSDHHAIUSA-N 1 1 347.415 2.611 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](Cn3cncn3)C2)c(Cl)c1 ZINC000182174305 474113947 /nfs/dbraw/zinc/11/39/47/474113947.db2.gz OJIJPDDBMYKSJL-LBPRGKRZSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](Cn3cncn3)C2)c(Cl)c1 ZINC000182174305 474113950 /nfs/dbraw/zinc/11/39/50/474113950.db2.gz OJIJPDDBMYKSJL-LBPRGKRZSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](Cn3cncn3)C2)c(Cl)c1 ZINC000182174389 474114739 /nfs/dbraw/zinc/11/47/39/474114739.db2.gz OJIJPDDBMYKSJL-GFCCVEGCSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](Cn3cncn3)C2)c(Cl)c1 ZINC000182174389 474114746 /nfs/dbraw/zinc/11/47/46/474114746.db2.gz OJIJPDDBMYKSJL-GFCCVEGCSA-N 1 1 335.795 2.752 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000174960283 474123559 /nfs/dbraw/zinc/12/35/59/474123559.db2.gz LEUXXGGPDVAYEI-ZIAGYGMSSA-N 1 1 337.807 2.947 10 5 EFBEMO C[N@@H+](CCc1ccc(F)cc1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182221085 474125535 /nfs/dbraw/zinc/12/55/35/474125535.db2.gz AAYXFMPSVZPDTM-INIZCTEOSA-N 1 1 348.374 2.648 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000247441216 474147852 /nfs/dbraw/zinc/14/78/52/474147852.db2.gz RZWFGHKSOVXXJF-QMTHXVAHSA-N 1 1 325.796 2.707 10 5 EFBEMO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000175136992 474148343 /nfs/dbraw/zinc/14/83/43/474148343.db2.gz PYGFNSROQAFVJN-MRXNPFEDSA-N 1 1 342.399 2.759 10 5 EFBEMO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000175136992 474148347 /nfs/dbraw/zinc/14/83/47/474148347.db2.gz PYGFNSROQAFVJN-MRXNPFEDSA-N 1 1 342.399 2.759 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000247470577 474154832 /nfs/dbraw/zinc/15/48/32/474154832.db2.gz VFYYAUDASOQLQY-DVOMOZLQSA-N 1 1 334.420 2.684 10 5 EFBEMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000247470587 474154873 /nfs/dbraw/zinc/15/48/73/474154873.db2.gz VFYYAUDASOQLQY-HEHGZKQESA-N 1 1 334.420 2.684 10 5 EFBEMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000265017040 474164350 /nfs/dbraw/zinc/16/43/50/474164350.db2.gz XULFHWKFMQCHCR-SMDDNHRTSA-N 1 1 329.356 2.650 10 5 EFBEMO COc1cc(C(=O)NCC[N@H+]2CCCC[C@@H]2C)cc([N+](=O)[O-])c1C ZINC000188730646 474179342 /nfs/dbraw/zinc/17/93/42/474179342.db2.gz YCEZZJZZBKVQRJ-LBPRGKRZSA-N 1 1 335.404 2.516 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175519918 474241126 /nfs/dbraw/zinc/24/11/26/474241126.db2.gz KVMJEVUKWLWCCI-LLVKDONJSA-N 1 1 325.796 2.852 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2csc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000248033119 474247778 /nfs/dbraw/zinc/24/77/78/474247778.db2.gz KOMWSVIVRMOUJY-UKRRQHHQSA-N 1 1 331.397 2.832 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000248047683 474251384 /nfs/dbraw/zinc/25/13/84/474251384.db2.gz NFXFFHXFAODNOV-QFBILLFUSA-N 1 1 339.395 2.699 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000248124493 474261550 /nfs/dbraw/zinc/26/15/50/474261550.db2.gz VAHUFRZDWCEOSD-DOTOQJQBSA-N 1 1 325.368 2.770 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC000248375619 474300090 /nfs/dbraw/zinc/30/00/90/474300090.db2.gz XJXFRFMSKHJETK-ARFHVFGLSA-N 1 1 334.416 2.989 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H]1c1ccco1 ZINC000248462027 474333976 /nfs/dbraw/zinc/33/39/76/474333976.db2.gz PPXIOGPRNIJVAO-KGLIPLIRSA-N 1 1 332.356 2.765 10 5 EFBEMO CO[C@@H]1C[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC[C@H]1C ZINC000189331751 474362497 /nfs/dbraw/zinc/36/24/97/474362497.db2.gz UPZSDNMONMSYFL-MLGOLLRUSA-N 1 1 335.404 2.589 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]([C@@H](O)c2nccn2C)C1 ZINC000248572981 474364325 /nfs/dbraw/zinc/36/43/25/474364325.db2.gz CYVQAPWVOVJUOW-DOTOQJQBSA-N 1 1 344.415 2.582 10 5 EFBEMO CO[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC[C@H]1C ZINC000189346380 474367371 /nfs/dbraw/zinc/36/73/71/474367371.db2.gz DPIXRZKRUUTVAJ-MLGOLLRUSA-N 1 1 335.404 2.589 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@]3(O)CCCC[C@H]3C2)c([N+](=O)[O-])cc1F ZINC000248625177 474382741 /nfs/dbraw/zinc/38/27/41/474382741.db2.gz NPLJFSLJKTUJJO-SUMWQHHRSA-N 1 1 338.379 2.870 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@]3(O)CCCC[C@H]3C2)c([N+](=O)[O-])cc1F ZINC000248625177 474382749 /nfs/dbraw/zinc/38/27/49/474382749.db2.gz NPLJFSLJKTUJJO-SUMWQHHRSA-N 1 1 338.379 2.870 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000248998277 474503195 /nfs/dbraw/zinc/50/31/95/474503195.db2.gz NGXHJTBKJFFFOA-HIFRSBDPSA-N 1 1 332.404 2.994 10 5 EFBEMO C[N@@H+](CCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)C1CC1 ZINC000277691879 474592459 /nfs/dbraw/zinc/59/24/59/474592459.db2.gz GUISQSQIBPTKBR-UHFFFAOYSA-N 1 1 335.407 2.918 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[N@H+](C2CC2)CC1 ZINC000184716009 474593663 /nfs/dbraw/zinc/59/36/63/474593663.db2.gz XVNRSVLJHWIRSC-INIZCTEOSA-N 1 1 345.443 2.860 10 5 EFBEMO Cc1sc(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000249734072 474609537 /nfs/dbraw/zinc/60/95/37/474609537.db2.gz CVZMWEPEOKKGOU-MNOVXSKESA-N 1 1 325.434 2.815 10 5 EFBEMO CC(C)[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2Br)C1 ZINC000267181068 474611157 /nfs/dbraw/zinc/61/11/57/474611157.db2.gz BQFIPVCURYETRZ-SECBINFHSA-N 1 1 329.198 2.647 10 5 EFBEMO CC(C)[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2Br)C1 ZINC000267181068 474611151 /nfs/dbraw/zinc/61/11/51/474611151.db2.gz BQFIPVCURYETRZ-SECBINFHSA-N 1 1 329.198 2.647 10 5 EFBEMO CC(C)(C)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H]1O ZINC000278474252 474654074 /nfs/dbraw/zinc/65/40/74/474654074.db2.gz ICGVYNZRXSSLAU-HIFRSBDPSA-N 1 1 337.376 2.732 10 5 EFBEMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H]1O ZINC000278474252 474654079 /nfs/dbraw/zinc/65/40/79/474654079.db2.gz ICGVYNZRXSSLAU-HIFRSBDPSA-N 1 1 337.376 2.732 10 5 EFBEMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(c2nnc3n2CCC3)CC1 ZINC000609144038 480118954 /nfs/dbraw/zinc/11/89/54/480118954.db2.gz BQQIUKSHLLSAMJ-UHFFFAOYSA-N 1 1 345.378 2.651 10 5 EFBEMO CCc1ccc(NC(=O)N(C)[C@H]2CC[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000252511601 474689718 /nfs/dbraw/zinc/68/97/18/474689718.db2.gz IONWCFWAQFLRBK-DOMZBBRYSA-N 1 1 334.420 2.961 10 5 EFBEMO Cc1nc(N[C@@H]2CC[N@H+](C[C@H]3CCCO3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000252512293 474691131 /nfs/dbraw/zinc/69/11/31/474691131.db2.gz OWSOHGRCOGBKKM-NWANDNLSSA-N 1 1 334.420 2.600 10 5 EFBEMO Cc1ccc(OC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000305286387 474727973 /nfs/dbraw/zinc/72/79/73/474727973.db2.gz DRKDIUXUMONSAS-KRWDZBQOSA-N 1 1 342.395 2.701 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(N3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)nc2c1 ZINC000278607593 474735038 /nfs/dbraw/zinc/73/50/38/474735038.db2.gz ZWAGQBPTSODBKT-SJKOYZFVSA-N 1 1 341.415 2.924 10 5 EFBEMO CC(C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CCOC1 ZINC000291894136 474737588 /nfs/dbraw/zinc/73/75/88/474737588.db2.gz QVVSWZNIBFNSOD-ZDUSSCGKSA-N 1 1 339.367 2.562 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1C[N@@H+](C2CC2)C[C@@H]1C ZINC000278658495 474759212 /nfs/dbraw/zinc/75/92/12/474759212.db2.gz NYSUUZHSRFZUCZ-GWCFXTLKSA-N 1 1 337.807 2.769 10 5 EFBEMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@H](CC(F)(F)F)C2)c1 ZINC000278659426 474761397 /nfs/dbraw/zinc/76/13/97/474761397.db2.gz HRQZSHWLDXIZJA-YPMHNXCESA-N 1 1 348.321 2.609 10 5 EFBEMO C[C@@H]1CC[C@H](C(N)=O)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000338961860 474780765 /nfs/dbraw/zinc/78/07/65/474780765.db2.gz RJJPFARQZLEVEA-ZJUUUORDSA-N 1 1 345.321 2.699 10 5 EFBEMO C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000338961860 474780775 /nfs/dbraw/zinc/78/07/75/474780775.db2.gz RJJPFARQZLEVEA-ZJUUUORDSA-N 1 1 345.321 2.699 10 5 EFBEMO CC(C)(C)[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1O ZINC000273231375 474790593 /nfs/dbraw/zinc/79/05/93/474790593.db2.gz DIMYYDZDGYPUIJ-OCCSQVGLSA-N 1 1 333.388 2.965 10 5 EFBEMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1O ZINC000273231375 474790602 /nfs/dbraw/zinc/79/06/02/474790602.db2.gz DIMYYDZDGYPUIJ-OCCSQVGLSA-N 1 1 333.388 2.965 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C(C)C)[C@H]1CCOC1 ZINC000292005212 474796995 /nfs/dbraw/zinc/79/69/95/474796995.db2.gz XNADKYJAAJHUJP-HNNXBMFYSA-N 1 1 335.404 2.731 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[N@H+](C2CCOCC2)C[C@H]1C ZINC000278731443 474800915 /nfs/dbraw/zinc/80/09/15/474800915.db2.gz SOMKGBRJIHNCPR-CABCVRRESA-N 1 1 333.432 2.841 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](C2CCOCC2)C[C@H]1C ZINC000278782713 474832595 /nfs/dbraw/zinc/83/25/95/474832595.db2.gz VEILMMKJVNBAJB-OAHLLOKOSA-N 1 1 333.432 2.588 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](C2CCOCC2)C[C@@H]1C ZINC000278782708 474832621 /nfs/dbraw/zinc/83/26/21/474832621.db2.gz VEILMMKJVNBAJB-HNNXBMFYSA-N 1 1 333.432 2.588 10 5 EFBEMO C[C@H](NCc1cc([O-])ccc1[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000339073963 474901320 /nfs/dbraw/zinc/90/13/20/474901320.db2.gz CTWVBRZCPROWOW-LBPRGKRZSA-N 1 1 339.355 2.732 10 5 EFBEMO CC(C)[C@@H](NCc1cc(O)ccc1[N+](=O)[O-])c1nnc2ccccn21 ZINC000339075354 474903786 /nfs/dbraw/zinc/90/37/86/474903786.db2.gz MJXNBWSKERSWND-MRXNPFEDSA-N 1 1 341.371 2.830 10 5 EFBEMO Cn1cc(-c2cc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])on2)cn1 ZINC000285201109 474925591 /nfs/dbraw/zinc/92/55/91/474925591.db2.gz DANGPGJGOCXMAJ-UHFFFAOYSA-N 1 1 341.371 2.658 10 5 EFBEMO C[C@H]1OCC[C@H]1[N@@H+](CCO)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339149543 474977726 /nfs/dbraw/zinc/97/77/26/474977726.db2.gz SBKLGVZYASPWDD-QMTHXVAHSA-N 1 1 348.321 2.585 10 5 EFBEMO C[C@@H]([NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(=O)NCCF ZINC000337556741 475123856 /nfs/dbraw/zinc/12/38/56/475123856.db2.gz RUGWIJFGCXVRTI-DYVFJYSZSA-N 1 1 345.374 2.748 10 5 EFBEMO C[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cn2)[C@@H]1c1ccc(F)c(F)c1 ZINC000273936939 475127090 /nfs/dbraw/zinc/12/70/90/475127090.db2.gz LFRRUMHYLMCHLY-KGLIPLIRSA-N 1 1 335.314 2.520 10 5 EFBEMO C[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cn2)[C@@H]1c1ccc(F)c(F)c1 ZINC000273936939 475127101 /nfs/dbraw/zinc/12/71/01/475127101.db2.gz LFRRUMHYLMCHLY-KGLIPLIRSA-N 1 1 335.314 2.520 10 5 EFBEMO C[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cn2)[C@H]1c1ccc(F)c(F)c1 ZINC000273936956 475127620 /nfs/dbraw/zinc/12/76/20/475127620.db2.gz LFRRUMHYLMCHLY-ZIAGYGMSSA-N 1 1 335.314 2.520 10 5 EFBEMO C[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cn2)[C@H]1c1ccc(F)c(F)c1 ZINC000273936956 475127629 /nfs/dbraw/zinc/12/76/29/475127629.db2.gz LFRRUMHYLMCHLY-ZIAGYGMSSA-N 1 1 335.314 2.520 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])o2)[C@@H]1c1ccc(F)cc1 ZINC000361193051 475260806 /nfs/dbraw/zinc/26/08/06/475260806.db2.gz ZDOQREZWWMEJPJ-DOMZBBRYSA-N 1 1 333.319 2.502 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])o2)[C@@H]1c1ccc(F)cc1 ZINC000361193051 475260816 /nfs/dbraw/zinc/26/08/16/475260816.db2.gz ZDOQREZWWMEJPJ-DOMZBBRYSA-N 1 1 333.319 2.502 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@H](CNC(=O)C(C)C)C2)ccc1[N+](=O)[O-] ZINC000352416505 475272077 /nfs/dbraw/zinc/27/20/77/475272077.db2.gz HJUFKMKHMJZUGZ-OAHLLOKOSA-N 1 1 349.431 2.588 10 5 EFBEMO CCCC(=O)NC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000352424107 475282351 /nfs/dbraw/zinc/28/23/51/475282351.db2.gz DJLAKPYQGZAYDA-OAHLLOKOSA-N 1 1 349.431 2.732 10 5 EFBEMO Cc1ccc([C@@H](C)NC(=O)N[C@@H]2CCc3nc[nH]c3C2)cc1[N+](=O)[O-] ZINC000357954878 475289598 /nfs/dbraw/zinc/28/95/98/475289598.db2.gz HYBUPJGHCLQDRA-DGCLKSJQSA-N 1 1 343.387 2.544 10 5 EFBEMO CC[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)[C@H](CC)CN1C(C)=O ZINC000352540173 475394119 /nfs/dbraw/zinc/39/41/19/475394119.db2.gz HUNGLGLBOMZNET-HZPDHXFCSA-N 1 1 349.431 2.825 10 5 EFBEMO CC[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)[C@H](CC)CN1C(C)=O ZINC000352540173 475394125 /nfs/dbraw/zinc/39/41/25/475394125.db2.gz HUNGLGLBOMZNET-HZPDHXFCSA-N 1 1 349.431 2.825 10 5 EFBEMO COc1ccccc1NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000352549587 475402714 /nfs/dbraw/zinc/40/27/14/475402714.db2.gz DIWUFQBYURTTNW-UHFFFAOYSA-N 1 1 343.383 2.716 10 5 EFBEMO COc1ccccc1NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000352549587 475402722 /nfs/dbraw/zinc/40/27/22/475402722.db2.gz DIWUFQBYURTTNW-UHFFFAOYSA-N 1 1 343.383 2.716 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CCCCC[C@H]2CCO)c2c(c1)COCO2 ZINC000342025061 475514303 /nfs/dbraw/zinc/51/43/03/475514303.db2.gz TVFXNGXJIUFIDE-HNNXBMFYSA-N 1 1 336.388 2.588 10 5 EFBEMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000348247512 475521696 /nfs/dbraw/zinc/52/16/96/475521696.db2.gz SSAAYWSYBCUTBW-WOPDTQHZSA-N 1 1 348.321 2.607 10 5 EFBEMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000348247507 475521873 /nfs/dbraw/zinc/52/18/73/475521873.db2.gz SSAAYWSYBCUTBW-GRYCIOLGSA-N 1 1 348.321 2.607 10 5 EFBEMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000348249293 475523500 /nfs/dbraw/zinc/52/35/00/475523500.db2.gz WJNDHSSIFDROMD-MPKXVKKWSA-N 1 1 348.321 2.607 10 5 EFBEMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000348249296 475523635 /nfs/dbraw/zinc/52/36/35/475523635.db2.gz WJNDHSSIFDROMD-SCDSUCTJSA-N 1 1 348.321 2.607 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCCC[C@H]1CCO ZINC000342049880 475533674 /nfs/dbraw/zinc/53/36/74/475533674.db2.gz QDFXTPSKFLWSEX-HNNXBMFYSA-N 1 1 349.431 2.859 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)ccc1[N+](=O)[O-] ZINC000352776296 475612164 /nfs/dbraw/zinc/61/21/64/475612164.db2.gz BPAIOZUMTDNHCQ-CJNGLKHVSA-N 1 1 330.388 2.883 10 5 EFBEMO COC(=O)COc1ccc(C[N@@H+](C)C[C@@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000355042636 475619829 /nfs/dbraw/zinc/61/98/29/475619829.db2.gz SZNHUEBTZAZNLE-CQSZACIVSA-N 1 1 348.399 2.935 10 5 EFBEMO CNC(=O)C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccccc1 ZINC000361645523 475625335 /nfs/dbraw/zinc/62/53/35/475625335.db2.gz DPLIDFIDDFXHKT-MRXNPFEDSA-N 1 1 343.383 2.570 10 5 EFBEMO C[N@@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)cc1 ZINC000361683367 475660636 /nfs/dbraw/zinc/66/06/36/475660636.db2.gz AZTFHRPNDQSZGT-IRXDYDNUSA-N 1 1 343.358 2.909 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)cc1 ZINC000361683367 475660643 /nfs/dbraw/zinc/66/06/43/475660643.db2.gz AZTFHRPNDQSZGT-IRXDYDNUSA-N 1 1 343.358 2.909 10 5 EFBEMO CN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@H+](C2CC2)C1 ZINC000348428479 475661542 /nfs/dbraw/zinc/66/15/42/475661542.db2.gz OEQFTKUOUBQCAA-LBPRGKRZSA-N 1 1 338.795 2.949 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000348707211 475826149 /nfs/dbraw/zinc/82/61/49/475826149.db2.gz RJEQRHKYOCFJND-LSDHHAIUSA-N 1 1 348.447 2.504 10 5 EFBEMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000297877251 475911582 /nfs/dbraw/zinc/91/15/82/475911582.db2.gz RFSIYWMZCBKUON-UWVGGRQHSA-N 1 1 345.321 2.778 10 5 EFBEMO CN(c1ncnc2cccc([N+](=O)[O-])c21)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000343334482 475959074 /nfs/dbraw/zinc/95/90/74/475959074.db2.gz BKGIPCROXSFWOJ-FUNVUKJBSA-N 1 1 327.388 2.599 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000298202440 476016378 /nfs/dbraw/zinc/01/63/78/476016378.db2.gz CNTKETYYVFTXCW-RIEGTJTDSA-N 1 1 339.342 2.899 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000298202440 476016384 /nfs/dbraw/zinc/01/63/84/476016384.db2.gz CNTKETYYVFTXCW-RIEGTJTDSA-N 1 1 339.342 2.899 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCC[C@H]2C)c1 ZINC000298504416 476117068 /nfs/dbraw/zinc/11/70/68/476117068.db2.gz QGFVPHNGLWRYMJ-GFCCVEGCSA-N 1 1 337.445 2.921 10 5 EFBEMO Cn1ccnc1[C@@H]([NH2+]CC1(CCO)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000353650153 476156961 /nfs/dbraw/zinc/15/69/61/476156961.db2.gz ZFBVURDBHBTTDS-INIZCTEOSA-N 1 1 344.415 2.560 10 5 EFBEMO CO[C@@H]1CC[C@H]([NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000353674944 476177461 /nfs/dbraw/zinc/17/74/61/476177461.db2.gz VFKHPCYSTCRRCO-IMJJTQAJSA-N 1 1 330.388 2.575 10 5 EFBEMO C[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000362358517 476192901 /nfs/dbraw/zinc/19/29/01/476192901.db2.gz KAAUGJFNTALQLD-AWEZNQCLSA-N 1 1 330.363 2.724 10 5 EFBEMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000357077807 476211819 /nfs/dbraw/zinc/21/18/19/476211819.db2.gz XLHSPWZZNMCNTH-KBXCAEBGSA-N 1 1 347.415 2.814 10 5 EFBEMO COc1cc(C[N@H+](C[C@H](C)OC)C(C)C)c([N+](=O)[O-])cc1OC ZINC000353827201 476292009 /nfs/dbraw/zinc/29/20/09/476292009.db2.gz YKGRDHLRUWYQFN-LBPRGKRZSA-N 1 1 326.393 2.857 10 5 EFBEMO C[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1cccs1 ZINC000357219232 476294366 /nfs/dbraw/zinc/29/43/66/476294366.db2.gz JOZVDXKZOPMZTQ-IAQYHMDHSA-N 1 1 348.428 2.797 10 5 EFBEMO O=C1C[C@H]([C@H]2CCCC[N@@H+]2C/C=C/c2ccccc2[N+](=O)[O-])CN1 ZINC000360808534 476401610 /nfs/dbraw/zinc/40/16/10/476401610.db2.gz DQHDFBZDCOHPRR-HRNFOAQLSA-N 1 1 329.400 2.599 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2csc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC000362775024 476401925 /nfs/dbraw/zinc/40/19/25/476401925.db2.gz AOSZEEFHSXTADT-UKRRQHHQSA-N 1 1 349.387 2.971 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2csc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC000362775024 476401931 /nfs/dbraw/zinc/40/19/31/476401931.db2.gz AOSZEEFHSXTADT-UKRRQHHQSA-N 1 1 349.387 2.971 10 5 EFBEMO C[N@H+]1CCC[C@@H](CNc2ccncc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000360992149 476528857 /nfs/dbraw/zinc/52/88/57/476528857.db2.gz ZYEYNCHKBUAXQS-BLLLJJGKSA-N 1 1 332.429 2.968 10 5 EFBEMO CC(C)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)cc1[N+](=O)[O-] ZINC000364970695 476553720 /nfs/dbraw/zinc/55/37/20/476553720.db2.gz HREVPNZWPNOFMI-LXZKKBNFSA-N 1 1 331.416 2.804 10 5 EFBEMO CC(C)c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)cc1[N+](=O)[O-] ZINC000364970695 476553728 /nfs/dbraw/zinc/55/37/28/476553728.db2.gz HREVPNZWPNOFMI-LXZKKBNFSA-N 1 1 331.416 2.804 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H]2CCCC[C@H]21 ZINC000377772122 476572429 /nfs/dbraw/zinc/57/24/29/476572429.db2.gz GGMJLNLNWMSYNT-IUODEOHRSA-N 1 1 333.388 2.806 10 5 EFBEMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000421711083 476690658 /nfs/dbraw/zinc/69/06/58/476690658.db2.gz NQTKTNXDTXTNFS-JTQLQIEISA-N 1 1 345.321 2.780 10 5 EFBEMO C[C@H]1CN(CC(F)(F)F)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000451869050 476690747 /nfs/dbraw/zinc/69/07/47/476690747.db2.gz FRJUCLLAOQLJTK-CYBMUJFWSA-N 1 1 345.365 2.953 10 5 EFBEMO Cc1noc(C)c1CO[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000375157934 476693054 /nfs/dbraw/zinc/69/30/54/476693054.db2.gz HDYXZDKPZXVYDJ-MRXNPFEDSA-N 1 1 331.372 2.991 10 5 EFBEMO Cc1noc(C)c1CO[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000375157934 476693058 /nfs/dbraw/zinc/69/30/58/476693058.db2.gz HDYXZDKPZXVYDJ-MRXNPFEDSA-N 1 1 331.372 2.991 10 5 EFBEMO Nc1c(C(=O)Nc2cccc3c2C[N@H+](C2CC2)C3)cccc1[N+](=O)[O-] ZINC000375236227 476729680 /nfs/dbraw/zinc/72/96/80/476729680.db2.gz FJBHCQKDXHHGDW-UHFFFAOYSA-N 1 1 338.367 2.907 10 5 EFBEMO O=[N+]([O-])c1cnc(NC[C@H]2CCCC[N@H+]2Cc2ccccc2)s1 ZINC000379681064 476730336 /nfs/dbraw/zinc/73/03/36/476730336.db2.gz OVNZMGBHLBPYPY-CQSZACIVSA-N 1 1 332.429 2.940 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@]4(C3)CCCOC4)o2)cc1 ZINC000375282320 476755365 /nfs/dbraw/zinc/75/53/65/476755365.db2.gz ZCQXORIDMBECHX-KRWDZBQOSA-N 1 1 344.371 2.647 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CCC(Oc2cnccn2)CC1 ZINC000365940289 476773695 /nfs/dbraw/zinc/77/36/95/476773695.db2.gz HFZXEJVVGVSMRX-HWKANZROSA-N 1 1 340.383 2.941 10 5 EFBEMO Cc1ccc(C[NH+]2CCC(Oc3cnccn3)CC2)cc1[N+](=O)[O-] ZINC000365939643 476773985 /nfs/dbraw/zinc/77/39/85/476773985.db2.gz BKFPBEZZFCKQNT-UHFFFAOYSA-N 1 1 328.372 2.737 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC(C)=C[C@@H](C)C1 ZINC000430274915 476800068 /nfs/dbraw/zinc/80/00/68/476800068.db2.gz FXOYEKWNFWXUGU-YPMHNXCESA-N 1 1 333.388 2.828 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC(C)=C[C@@H](C)C1 ZINC000430274915 476800074 /nfs/dbraw/zinc/80/00/74/476800074.db2.gz FXOYEKWNFWXUGU-YPMHNXCESA-N 1 1 333.388 2.828 10 5 EFBEMO CC1=C[C@H](C)C[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000430284553 476802580 /nfs/dbraw/zinc/80/25/80/476802580.db2.gz MPJFDLHHMDBZBW-LBPRGKRZSA-N 1 1 331.372 2.791 10 5 EFBEMO COC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000452096657 476821033 /nfs/dbraw/zinc/82/10/33/476821033.db2.gz YKJCEHPMASAFJB-ZIAGYGMSSA-N 1 1 335.404 2.670 10 5 EFBEMO O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457021539 476833254 /nfs/dbraw/zinc/83/32/54/476833254.db2.gz MNUQKFDBZNXFTF-GOSISDBHSA-N 1 1 339.395 2.701 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1C[C@H](C)[N@@H+](C)C[C@@H]1C ZINC000446301460 476856965 /nfs/dbraw/zinc/85/69/65/476856965.db2.gz YWFMNWCJQMNVAM-QWRGUYRKSA-N 1 1 325.796 2.721 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000446301460 476856976 /nfs/dbraw/zinc/85/69/76/476856976.db2.gz YWFMNWCJQMNVAM-QWRGUYRKSA-N 1 1 325.796 2.721 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@H]1C ZINC000446301458 476857137 /nfs/dbraw/zinc/85/71/37/476857137.db2.gz YWFMNWCJQMNVAM-GHMZBOCLSA-N 1 1 325.796 2.721 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000446301458 476857141 /nfs/dbraw/zinc/85/71/41/476857141.db2.gz YWFMNWCJQMNVAM-GHMZBOCLSA-N 1 1 325.796 2.721 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2nc(C3CC3)no2)C1 ZINC000375473484 476857123 /nfs/dbraw/zinc/85/71/23/476857123.db2.gz WKIZPIVQSGTLIF-GFCCVEGCSA-N 1 1 344.371 2.853 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000446315384 476860026 /nfs/dbraw/zinc/86/00/26/476860026.db2.gz IZVYEMGTWLMREY-JQWIXIFHSA-N 1 1 325.796 2.769 10 5 EFBEMO COC(=O)c1cc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc(C)c1[N+](=O)[O-] ZINC000370539639 476862595 /nfs/dbraw/zinc/86/25/95/476862595.db2.gz NJAJTOHTMOBUOK-GXTWGEPZSA-N 1 1 333.388 2.729 10 5 EFBEMO O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@@H]2CCC[N@H+]2Cc2ccccc21 ZINC000370581357 476881712 /nfs/dbraw/zinc/88/17/12/476881712.db2.gz CQBHPTJNASICAL-HNNXBMFYSA-N 1 1 338.367 2.615 10 5 EFBEMO Cc1cc(OCC(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000431634933 477065731 /nfs/dbraw/zinc/06/57/31/477065731.db2.gz HZPLYKXJBDTRTC-GASCZTMLSA-N 1 1 349.431 2.661 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411416478 477227812 /nfs/dbraw/zinc/22/78/12/477227812.db2.gz ORLYFQOVZKTDDL-RRQGHBQHSA-N 1 1 331.416 2.689 10 5 EFBEMO O=C(CC[N@H+]1CCOC[C@H]1CC1CCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411775196 477363454 /nfs/dbraw/zinc/36/34/54/477363454.db2.gz XGKCBRWLXZJVGU-QGZVFWFLSA-N 1 1 347.415 2.814 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@](C(N)=O)(c2ccccc2)C1 ZINC000411969021 477399893 /nfs/dbraw/zinc/39/98/93/477399893.db2.gz PKZBSKBXLRWSRB-IFXJQAMLSA-N 1 1 339.395 2.785 10 5 EFBEMO CC(C)(C)c1ccc(C(=O)N2CC[NH2+]C[C@@H]2C(F)F)cc1[N+](=O)[O-] ZINC000367391765 477489298 /nfs/dbraw/zinc/48/92/98/477489298.db2.gz HQZWPZJMWVPSCZ-CYBMUJFWSA-N 1 1 341.358 2.571 10 5 EFBEMO COCC[N@H+]1CCC[C@@H]1CNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413114516 477526346 /nfs/dbraw/zinc/52/63/46/477526346.db2.gz DVLFADPFOGGFAS-SNVBAGLBSA-N 1 1 348.325 2.531 10 5 EFBEMO COCC[N@H+]1CCC[C@@H]1CNc1nccc2ccc([N+](=O)[O-])cc21 ZINC000413116876 477528742 /nfs/dbraw/zinc/52/87/42/477528742.db2.gz ICPJNMGTJPUTDN-OAHLLOKOSA-N 1 1 330.388 2.666 10 5 EFBEMO CO[C@H](Cc1ccccc1)C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000450690096 477683368 /nfs/dbraw/zinc/68/33/68/477683368.db2.gz GEVWMKBDZSUCLC-QGZVFWFLSA-N 1 1 327.384 2.606 10 5 EFBEMO CO[C@H](Cc1ccccc1)C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000450690096 477683376 /nfs/dbraw/zinc/68/33/76/477683376.db2.gz GEVWMKBDZSUCLC-QGZVFWFLSA-N 1 1 327.384 2.606 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000413502285 477702043 /nfs/dbraw/zinc/70/20/43/477702043.db2.gz MYWWQYYVEAAKPZ-BVPBIZIASA-N 1 1 345.443 2.887 10 5 EFBEMO CCCC[N@@H+](C)C[C@H](C)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000426521645 477712942 /nfs/dbraw/zinc/71/29/42/477712942.db2.gz HSRCCWACRHMJME-NSHDSACASA-N 1 1 343.374 2.652 10 5 EFBEMO C[C@@H]1CN(c2ccc([N+](=O)[O-])nc2)CC[N@@H+](Cc2ccccc2)C1 ZINC000450807220 477724051 /nfs/dbraw/zinc/72/40/51/477724051.db2.gz GHCKQMDBSKRFAR-HNNXBMFYSA-N 1 1 326.400 2.948 10 5 EFBEMO C[C@]1(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)CCC[N@H+]1Cc1ccccc1 ZINC000427979331 477797592 /nfs/dbraw/zinc/79/75/92/477797592.db2.gz HWYUWGNHSXEXFY-GOSISDBHSA-N 1 1 342.399 2.707 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000438932146 477907077 /nfs/dbraw/zinc/90/70/77/477907077.db2.gz BEUIDOWBEDELNP-STQMWFEESA-N 1 1 337.807 2.913 10 5 EFBEMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)c1ccc([N+](=O)[O-])cn1 ZINC000533600476 478105180 /nfs/dbraw/zinc/10/51/80/478105180.db2.gz QCNGEFINUVQGOQ-UHFFFAOYSA-N 1 1 342.399 2.630 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H]2CC[C@@H](C1)[S@@]2=O ZINC000600202376 478278701 /nfs/dbraw/zinc/27/87/01/478278701.db2.gz GYBJNOYSKTYFRO-NQUBFNRKSA-N 1 1 334.441 2.984 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H]2CC[C@@H](C1)[S@]2=O ZINC000600202375 478279590 /nfs/dbraw/zinc/27/95/90/478279590.db2.gz GYBJNOYSKTYFRO-WCBAUVGUSA-N 1 1 334.441 2.984 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H]2CC[C@@H](C1)[S@@]2=O ZINC000600202373 478279715 /nfs/dbraw/zinc/27/97/15/478279715.db2.gz GYBJNOYSKTYFRO-XTOSZEFFSA-N 1 1 334.441 2.984 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](OC)C(C)(C)C2)c1 ZINC000590659230 478280195 /nfs/dbraw/zinc/28/01/95/478280195.db2.gz JWHPEJAGZGVJQW-HNNXBMFYSA-N 1 1 336.388 2.628 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](OC)C(C)(C)C2)c1 ZINC000590659230 478280203 /nfs/dbraw/zinc/28/02/03/478280203.db2.gz JWHPEJAGZGVJQW-HNNXBMFYSA-N 1 1 336.388 2.628 10 5 EFBEMO CNc1c(C(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)cccc1[N+](=O)[O-] ZINC000600230005 478300496 /nfs/dbraw/zinc/30/04/96/478300496.db2.gz NPCXXLUDBPBHJD-CQSZACIVSA-N 1 1 346.431 2.773 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000600468224 478382523 /nfs/dbraw/zinc/38/25/23/478382523.db2.gz DZQKNBVDDQXEKE-CQSZACIVSA-N 1 1 347.415 2.740 10 5 EFBEMO CCc1ccc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000600474571 478384813 /nfs/dbraw/zinc/38/48/13/478384813.db2.gz YXWCJDJZTIQPBZ-INIZCTEOSA-N 1 1 331.416 2.904 10 5 EFBEMO CCOC[C@@H]1CCCC[N@@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000590971083 478422750 /nfs/dbraw/zinc/42/27/50/478422750.db2.gz NAGUVOZLGHMYTL-HNNXBMFYSA-N 1 1 336.388 2.772 10 5 EFBEMO CCOC[C@@H]1CCCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000590971083 478422758 /nfs/dbraw/zinc/42/27/58/478422758.db2.gz NAGUVOZLGHMYTL-HNNXBMFYSA-N 1 1 336.388 2.772 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1 ZINC000594596546 478455841 /nfs/dbraw/zinc/45/58/41/478455841.db2.gz AOCVVFYDKBPKJJ-DZGCQCFKSA-N 1 1 333.388 2.810 10 5 EFBEMO O=c1[nH]c(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)nc2ccc([N+](=O)[O-])cc21 ZINC000594597585 478457958 /nfs/dbraw/zinc/45/79/58/478457958.db2.gz DATVULJVPDKVSQ-GJZGRUSLSA-N 1 1 343.387 2.672 10 5 EFBEMO [NH3+]CCCOCCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000600709998 478478958 /nfs/dbraw/zinc/47/89/58/478478958.db2.gz MFWRTDIKNOWJOQ-SFHVURJKSA-N 1 1 329.400 2.639 10 5 EFBEMO [NH3+]C1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCOCC1 ZINC000600772479 478513475 /nfs/dbraw/zinc/51/34/75/478513475.db2.gz CVYCNIBZOCTFOT-UHFFFAOYSA-N 1 1 347.440 2.921 10 5 EFBEMO COc1cc(C[N@H+]2C[C@@H](c3cnn(C)c3)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000571176540 478538821 /nfs/dbraw/zinc/53/88/21/478538821.db2.gz XBOXMDOOOGWSEF-HNNXBMFYSA-N 1 1 344.415 2.963 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000597856867 478542303 /nfs/dbraw/zinc/54/23/03/478542303.db2.gz BXCSCUDGPAHUMW-GFCCVEGCSA-N 1 1 337.445 2.676 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000597857596 478543828 /nfs/dbraw/zinc/54/38/28/478543828.db2.gz GIBRCXBZSDFUKN-LLVKDONJSA-N 1 1 325.796 2.851 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000597858893 478543977 /nfs/dbraw/zinc/54/39/77/478543977.db2.gz PWHPNOUNGQHNTF-ZDUSSCGKSA-N 1 1 337.445 2.676 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000597857368 478544755 /nfs/dbraw/zinc/54/47/55/478544755.db2.gz FPYUHQOGIMQMHA-GFCCVEGCSA-N 1 1 330.388 2.679 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000571382092 478581841 /nfs/dbraw/zinc/58/18/41/478581841.db2.gz HNZVQZKSFDYQOS-CPUCHLNUSA-N 1 1 333.432 2.887 10 5 EFBEMO CCN(C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](C)C1 ZINC000597947172 478590731 /nfs/dbraw/zinc/59/07/31/478590731.db2.gz UQYNJUACXPDSGZ-TZMCWYRMSA-N 1 1 337.445 2.628 10 5 EFBEMO CCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)[C@@H]1CC[N@@H+](C)C1 ZINC000597947592 478591898 /nfs/dbraw/zinc/59/18/98/478591898.db2.gz ZLKLSDLSMFNMEQ-CQSZACIVSA-N 1 1 335.404 2.548 10 5 EFBEMO Cc1c(C[NH2+]Cc2c(C(F)(F)F)cnn2C)cccc1[N+](=O)[O-] ZINC000594936309 478593656 /nfs/dbraw/zinc/59/36/56/478593656.db2.gz BYWSWUSPHDLGCE-UHFFFAOYSA-N 1 1 328.294 2.945 10 5 EFBEMO COc1cc(CNC[C@H]2CC[N@@H+]2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000594967807 478610520 /nfs/dbraw/zinc/61/05/20/478610520.db2.gz VQYXATILYSWWIG-CYBMUJFWSA-N 1 1 337.420 2.574 10 5 EFBEMO COc1cc(CNC[C@H]2CC[N@H+]2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000594967807 478610528 /nfs/dbraw/zinc/61/05/28/478610528.db2.gz VQYXATILYSWWIG-CYBMUJFWSA-N 1 1 337.420 2.574 10 5 EFBEMO CCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)[C@H]1CC[N@@H+](CC)C1 ZINC000598039444 478626712 /nfs/dbraw/zinc/62/67/12/478626712.db2.gz KBRAXVCPIDIGRU-HNNXBMFYSA-N 1 1 349.431 2.938 10 5 EFBEMO CCN(C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CC[N@@H+](CC)C1 ZINC000598039454 478626887 /nfs/dbraw/zinc/62/68/87/478626887.db2.gz KDILLHOATUVEST-TZMCWYRMSA-N 1 1 337.395 2.780 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cccnc1N(C)C ZINC000595005550 478627210 /nfs/dbraw/zinc/62/72/10/478627210.db2.gz AGMDQDDOPYHXAN-GFCCVEGCSA-N 1 1 330.388 2.915 10 5 EFBEMO CCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](CC)C1 ZINC000598041446 478629505 /nfs/dbraw/zinc/62/95/05/478629505.db2.gz MAOJMVCCXOYGLY-KRWDZBQOSA-N 1 1 348.447 2.730 10 5 EFBEMO CCN(C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)[C@H]1CC[N@@H+](CC)C1 ZINC000598044169 478630855 /nfs/dbraw/zinc/63/08/55/478630855.db2.gz ZALUSNYHJGCWOT-ZDUSSCGKSA-N 1 1 330.388 2.632 10 5 EFBEMO C[C@@H]1C[C@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC[N@H+]1C ZINC000582585118 478635265 /nfs/dbraw/zinc/63/52/65/478635265.db2.gz CTAITBNREMAQBJ-ZIAGYGMSSA-N 1 1 349.434 2.894 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)[C@@H](C)C1 ZINC000601119819 478667611 /nfs/dbraw/zinc/66/76/11/478667611.db2.gz WSLJQEFEVXAIJK-UWVGGRQHSA-N 1 1 349.357 2.514 10 5 EFBEMO COc1cccc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c1F ZINC000601149064 478689537 /nfs/dbraw/zinc/68/95/37/478689537.db2.gz IGSBZAAENJOTGO-KRWDZBQOSA-N 1 1 334.347 2.740 10 5 EFBEMO COc1ccc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000601150055 478690172 /nfs/dbraw/zinc/69/01/72/478690172.db2.gz SWJKHDNCEQVAGD-GOSISDBHSA-N 1 1 346.383 2.609 10 5 EFBEMO COc1ccc(C)cc1C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC000601148888 478690332 /nfs/dbraw/zinc/69/03/32/478690332.db2.gz HJCVLAUCFOJIHX-GOSISDBHSA-N 1 1 330.384 2.909 10 5 EFBEMO C[C@@](CO)([NH2+]Cc1ccnn1CC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000601150620 478690973 /nfs/dbraw/zinc/69/09/73/478690973.db2.gz ZSTWILMRLFLVEM-SFHVURJKSA-N 1 1 344.415 2.589 10 5 EFBEMO COc1cc(F)cc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c1 ZINC000601150525 478691381 /nfs/dbraw/zinc/69/13/81/478691381.db2.gz YTOWQQKAZMQGKV-QGZVFWFLSA-N 1 1 334.347 2.740 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3C[C@H](O)C[C@H]3[C@@H]3CCCOC3)c2c1 ZINC000601170621 478703028 /nfs/dbraw/zinc/70/30/28/478703028.db2.gz RMXZBSITUFIECO-DFHBCGBQSA-N 1 1 343.383 2.509 10 5 EFBEMO COc1cc(N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)c(Cl)cc1[N+](=O)[O-] ZINC000601184843 478711938 /nfs/dbraw/zinc/71/19/38/478711938.db2.gz OZOGDRJWLIYEMK-WDEREUQCSA-N 1 1 325.796 2.645 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000601190464 478714670 /nfs/dbraw/zinc/71/46/70/478714670.db2.gz ZGLSPESHTJSUOD-VHSXEESVSA-N 1 1 347.341 2.776 10 5 EFBEMO CO[C@@H]1CCC[C@H]([C@H](CO)Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1 ZINC000601191856 478716024 /nfs/dbraw/zinc/71/60/24/478716024.db2.gz QXXNZQADYIJIEB-WRSAYESZSA-N 1 1 345.399 2.543 10 5 EFBEMO CC[C@@H]1[C@@H](C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000601237887 478740180 /nfs/dbraw/zinc/74/01/80/478740180.db2.gz NOVJMFFORAIWDO-ZMSDIMECSA-N 1 1 349.456 2.899 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H]1CCCO1)[C@H]1CC[C@H](O)CC1 ZINC000592131008 478788947 /nfs/dbraw/zinc/78/89/47/478788947.db2.gz PDKBWAQRCJZWDI-ULQDDVLXSA-N 1 1 334.416 2.879 10 5 EFBEMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000592183068 478816046 /nfs/dbraw/zinc/81/60/46/478816046.db2.gz CPWMDKNIFHNDFW-IINYFYTJSA-N 1 1 345.321 2.656 10 5 EFBEMO C[C@@H]1[C@H](C)N(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)CC[N@H+]1C ZINC000601402778 478820588 /nfs/dbraw/zinc/82/05/88/478820588.db2.gz WCLAPABXTVZSMB-KGLIPLIRSA-N 1 1 331.416 2.568 10 5 EFBEMO C[C@@H]1[C@H](C)N(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)CC[N@@H+]1C ZINC000601402778 478820591 /nfs/dbraw/zinc/82/05/91/478820591.db2.gz WCLAPABXTVZSMB-KGLIPLIRSA-N 1 1 331.416 2.568 10 5 EFBEMO COc1cc(C[N@@H+](C)[C@H](CO)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000595591123 478872767 /nfs/dbraw/zinc/87/27/67/478872767.db2.gz DNWXRIYNPAWVCC-INIZCTEOSA-N 1 1 330.384 2.639 10 5 EFBEMO CC[N@@H+]1CCN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)[C@@H](C)C1 ZINC000601577869 478888665 /nfs/dbraw/zinc/88/86/65/478888665.db2.gz WFIOCPGLCKHJMS-AWEZNQCLSA-N 1 1 331.416 2.569 10 5 EFBEMO CC[N@H+]1CCN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)[C@@H](C)C1 ZINC000601577869 478888672 /nfs/dbraw/zinc/88/86/72/478888672.db2.gz WFIOCPGLCKHJMS-AWEZNQCLSA-N 1 1 331.416 2.569 10 5 EFBEMO CC[N@@H+]1CCN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)[C@H](C)C1 ZINC000601577871 478888753 /nfs/dbraw/zinc/88/87/53/478888753.db2.gz WFIOCPGLCKHJMS-CQSZACIVSA-N 1 1 331.416 2.569 10 5 EFBEMO CC[N@H+]1CCN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)[C@H](C)C1 ZINC000601577871 478888757 /nfs/dbraw/zinc/88/87/57/478888757.db2.gz WFIOCPGLCKHJMS-CQSZACIVSA-N 1 1 331.416 2.569 10 5 EFBEMO COC(=O)[C@@H]1C[C@H](C(F)(F)F)C[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000595620176 478894002 /nfs/dbraw/zinc/89/40/02/478894002.db2.gz AXWIPCMHUSWWAV-NEPJUHHUSA-N 1 1 346.305 2.768 10 5 EFBEMO COC(=O)[C@@H]1C[C@H](C(F)(F)F)C[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000595620176 478894014 /nfs/dbraw/zinc/89/40/14/478894014.db2.gz AXWIPCMHUSWWAV-NEPJUHHUSA-N 1 1 346.305 2.768 10 5 EFBEMO COC(=O)[C@@H]1C[C@H](C(F)(F)F)C[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000595630148 478901331 /nfs/dbraw/zinc/90/13/31/478901331.db2.gz QPSRPKAFUWBGGD-NEPJUHHUSA-N 1 1 346.305 2.768 10 5 EFBEMO COC(=O)[C@@H]1C[C@H](C(F)(F)F)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000595630148 478901339 /nfs/dbraw/zinc/90/13/39/478901339.db2.gz QPSRPKAFUWBGGD-NEPJUHHUSA-N 1 1 346.305 2.768 10 5 EFBEMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3cncc(Cl)c3)C2)nc1 ZINC000598596383 478918657 /nfs/dbraw/zinc/91/86/57/478918657.db2.gz PCDCPRXYDZOXAP-ZDUSSCGKSA-N 1 1 333.779 2.725 10 5 EFBEMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cncc(Cl)c3)C2)nc1 ZINC000598596383 478918662 /nfs/dbraw/zinc/91/86/62/478918662.db2.gz PCDCPRXYDZOXAP-ZDUSSCGKSA-N 1 1 333.779 2.725 10 5 EFBEMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@H]1CC[N@H+]1C(C)(C)C ZINC000595661477 478919578 /nfs/dbraw/zinc/91/95/78/478919578.db2.gz CCFLKSOEAMBIMZ-MRXNPFEDSA-N 1 1 348.447 2.652 10 5 EFBEMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CC[N@H+]1C(C)(C)C ZINC000595664441 478922461 /nfs/dbraw/zinc/92/24/61/478922461.db2.gz YNBJHLMQBNJSKP-CQSZACIVSA-N 1 1 334.420 2.609 10 5 EFBEMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CC[N@H+]1C(C)(C)C ZINC000595665556 478922492 /nfs/dbraw/zinc/92/24/92/478922492.db2.gz VSHQIZHHSZLNFX-OAHLLOKOSA-N 1 1 348.447 2.652 10 5 EFBEMO O=C1[C@H]([N@H+]2CCC[C@@H](CCF)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595756301 478978446 /nfs/dbraw/zinc/97/84/46/478978446.db2.gz SMROFWORNSVOSY-XJKSGUPXSA-N 1 1 335.379 2.772 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@@H]4COC[C@H]4C3)co2)cc1 ZINC000595826591 479019148 /nfs/dbraw/zinc/01/91/48/479019148.db2.gz AUNOEIHQSRNRLC-ZIAGYGMSSA-N 1 1 329.356 2.718 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H]2COC[C@@H]2C1 ZINC000595826968 479020115 /nfs/dbraw/zinc/02/01/15/479020115.db2.gz BMKKQIPVDUBGNC-XBFCOCLRSA-N 1 1 344.371 2.674 10 5 EFBEMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CC[C@H]2COC[C@@H]2C1 ZINC000595827105 479021144 /nfs/dbraw/zinc/02/11/44/479021144.db2.gz LNEBVTBQIHKVTA-RYUDHWBXSA-N 1 1 341.205 2.826 10 5 EFBEMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CC[C@H]2COC[C@@H]2C1 ZINC000595827105 479021152 /nfs/dbraw/zinc/02/11/52/479021152.db2.gz LNEBVTBQIHKVTA-RYUDHWBXSA-N 1 1 341.205 2.826 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000592747223 479023964 /nfs/dbraw/zinc/02/39/64/479023964.db2.gz PRLHRUICVJNQFJ-CYBMUJFWSA-N 1 1 345.403 2.533 10 5 EFBEMO CCOc1cc(C[N@H+]2CCC[C@@H](C(=O)NC(C)C)C2)ccc1[N+](=O)[O-] ZINC000595850719 479032517 /nfs/dbraw/zinc/03/25/17/479032517.db2.gz NNAQYRFSXFTRLY-OAHLLOKOSA-N 1 1 349.431 2.730 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000592765537 479033955 /nfs/dbraw/zinc/03/39/55/479033955.db2.gz KDTRRHICCUOZOI-LBPRGKRZSA-N 1 1 328.372 2.894 10 5 EFBEMO O=C(C[N@@H+](CCC1CC1)CC1CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595870765 479042572 /nfs/dbraw/zinc/04/25/72/479042572.db2.gz DRZGHRXEFJORPU-UHFFFAOYSA-N 1 1 343.427 2.996 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NCC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000595873045 479042609 /nfs/dbraw/zinc/04/26/09/479042609.db2.gz JDFZLCMDJLCDDS-UHFFFAOYSA-N 1 1 336.436 2.552 10 5 EFBEMO O=[N+]([O-])c1cc2c(nc1N1CCC[C@@H](c3[nH]cc[nH+]3)C1)CCCC2 ZINC000565713192 479069152 /nfs/dbraw/zinc/06/91/52/479069152.db2.gz UDWRBFCGHLRLQR-CYBMUJFWSA-N 1 1 327.388 2.976 10 5 EFBEMO O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000598966932 479106561 /nfs/dbraw/zinc/10/65/61/479106561.db2.gz MAECKWPCWWWCTR-KRWDZBQOSA-N 1 1 346.431 2.801 10 5 EFBEMO O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000598979129 479111917 /nfs/dbraw/zinc/11/19/17/479111917.db2.gz JVHWSOXEOBSPQR-QGZVFWFLSA-N 1 1 346.431 2.801 10 5 EFBEMO COc1cc(CNC[C@@H]2CC[N@H+]2C2CCCC2)c([N+](=O)[O-])cc1OC ZINC000598999124 479120691 /nfs/dbraw/zinc/12/06/91/479120691.db2.gz JRENTJVVRBTMEG-HNNXBMFYSA-N 1 1 349.431 2.719 10 5 EFBEMO COc1cc(C[NH2+]C[C@@H]2CCN2C2CCCC2)c([N+](=O)[O-])cc1OC ZINC000598999124 479120699 /nfs/dbraw/zinc/12/06/99/479120699.db2.gz JRENTJVVRBTMEG-HNNXBMFYSA-N 1 1 349.431 2.719 10 5 EFBEMO Cc1noc([C@@H]2OCC[C@@H]2[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000599021185 479128674 /nfs/dbraw/zinc/12/86/74/479128674.db2.gz TUSVOUGULAPMAL-QWHCGFSZSA-N 1 1 338.751 2.559 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@H]2C[C@@H](C)O)c1 ZINC000593028407 479131407 /nfs/dbraw/zinc/13/14/07/479131407.db2.gz FMDRKQYBPTZBHM-DOMZBBRYSA-N 1 1 336.388 2.507 10 5 EFBEMO CC(C)Oc1ccnc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000593027859 479132321 /nfs/dbraw/zinc/13/23/21/479132321.db2.gz YDBSKGBBXMRVTK-UHFFFAOYSA-N 1 1 345.403 2.811 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(Cn2c[nH+]c3c2C[C@H](C)[C@H](C)C3)c1 ZINC000593031738 479135033 /nfs/dbraw/zinc/13/50/33/479135033.db2.gz LRSWQDQBMQJRLI-NEPJUHHUSA-N 1 1 343.383 2.997 10 5 EFBEMO CCOc1ccc(NC(=O)C[N@@H+]2CCC23CCCC3)c([N+](=O)[O-])c1 ZINC000593038346 479137378 /nfs/dbraw/zinc/13/73/78/479137378.db2.gz IDGSSRKIESWIAX-UHFFFAOYSA-N 1 1 333.388 2.951 10 5 EFBEMO CCOc1ccc(NC(=O)C[N@H+]2CCC23CCCC3)c([N+](=O)[O-])c1 ZINC000593038346 479137385 /nfs/dbraw/zinc/13/73/85/479137385.db2.gz IDGSSRKIESWIAX-UHFFFAOYSA-N 1 1 333.388 2.951 10 5 EFBEMO COCC[N@H+]1CCC[C@@H]1CNc1cc(OC)c([N+](=O)[O-])cc1Cl ZINC000596109926 479143104 /nfs/dbraw/zinc/14/31/04/479143104.db2.gz HQRPTGIPSXQPQN-LLVKDONJSA-N 1 1 343.811 2.780 10 5 EFBEMO COC(=O)c1c(Cl)c(NC[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000596119250 479150558 /nfs/dbraw/zinc/15/05/58/479150558.db2.gz MFVWBZFUSXECKN-SNVBAGLBSA-N 1 1 341.795 2.789 10 5 EFBEMO CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000593070166 479156531 /nfs/dbraw/zinc/15/65/31/479156531.db2.gz UTAJPZBJLAJRNO-LBPRGKRZSA-N 1 1 341.795 2.688 10 5 EFBEMO CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000593070166 479156538 /nfs/dbraw/zinc/15/65/38/479156538.db2.gz UTAJPZBJLAJRNO-LBPRGKRZSA-N 1 1 341.795 2.688 10 5 EFBEMO COC(=O)c1c(Cl)c(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000596146820 479163778 /nfs/dbraw/zinc/16/37/78/479163778.db2.gz QGJPAEBHWFQGSH-NXEZZACHSA-N 1 1 341.795 2.929 10 5 EFBEMO CNC(=O)c1ccc(NC[C@@H]2CC[N@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000599127165 479170242 /nfs/dbraw/zinc/17/02/42/479170242.db2.gz QJZLBMGPEZZOMJ-HNNXBMFYSA-N 1 1 346.431 2.773 10 5 EFBEMO NC(=O)c1ccc(NC[C@@H]2CC[N@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000599126422 479170410 /nfs/dbraw/zinc/17/04/10/479170410.db2.gz GXVMAYGFSOYTRE-AWEZNQCLSA-N 1 1 332.404 2.513 10 5 EFBEMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000599128018 479172119 /nfs/dbraw/zinc/17/21/19/479172119.db2.gz VLSLJJIMDKBACS-HNNXBMFYSA-N 1 1 346.431 2.773 10 5 EFBEMO CCN(C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1 ZINC000596167397 479176060 /nfs/dbraw/zinc/17/60/60/479176060.db2.gz GNZCWGJLDZNATR-CJNGLKHVSA-N 1 1 334.420 2.782 10 5 EFBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593116866 479183940 /nfs/dbraw/zinc/18/39/40/479183940.db2.gz JKDNGBQWCVJCKB-HZMBPMFUSA-N 1 1 325.315 2.653 10 5 EFBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593116866 479183949 /nfs/dbraw/zinc/18/39/49/479183949.db2.gz JKDNGBQWCVJCKB-HZMBPMFUSA-N 1 1 325.315 2.653 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@@]4(CC4(F)F)C3)n2)cc1 ZINC000593117920 479186025 /nfs/dbraw/zinc/18/60/25/479186025.db2.gz OIJIPHGRIDUNJP-CQSZACIVSA-N 1 1 336.298 2.876 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@@]4(CC4(F)F)C3)n2)cc1 ZINC000593117920 479186032 /nfs/dbraw/zinc/18/60/32/479186032.db2.gz OIJIPHGRIDUNJP-CQSZACIVSA-N 1 1 336.298 2.876 10 5 EFBEMO COC(=O)c1c(Cl)c(N2CC[N@H+](C)[C@@H](C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000596181936 479186105 /nfs/dbraw/zinc/18/61/05/479186105.db2.gz HWTQKALXKODYDV-VHSXEESVSA-N 1 1 341.795 2.564 10 5 EFBEMO COC(=O)c1c(Cl)c(N2CC[N@@H+](C)[C@@H](C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000596181936 479186111 /nfs/dbraw/zinc/18/61/11/479186111.db2.gz HWTQKALXKODYDV-VHSXEESVSA-N 1 1 341.795 2.564 10 5 EFBEMO CCOC(=O)c1ccnc(NC[C@@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-] ZINC000599164025 479190449 /nfs/dbraw/zinc/19/04/49/479190449.db2.gz HWMWZZCUWMOVQC-ZDUSSCGKSA-N 1 1 348.403 2.595 10 5 EFBEMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)n1 ZINC000593126437 479192748 /nfs/dbraw/zinc/19/27/48/479192748.db2.gz VGZAMEBMCPFWJJ-ULQDDVLXSA-N 1 1 342.399 2.786 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCCC[C@H]3C3(O)CC3)o2)cc1 ZINC000556780274 479204630 /nfs/dbraw/zinc/20/46/30/479204630.db2.gz VRELRDVQKIFQRJ-AWEZNQCLSA-N 1 1 344.371 2.524 10 5 EFBEMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599207376 479210101 /nfs/dbraw/zinc/21/01/01/479210101.db2.gz ULOTWUXZTFNZDV-INIZCTEOSA-N 1 1 346.431 2.753 10 5 EFBEMO CC[C@@H]1C[N@H+](C)CCN1c1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl ZINC000596247871 479222190 /nfs/dbraw/zinc/22/21/90/479222190.db2.gz SGYHEINUNONGAF-SNVBAGLBSA-N 1 1 341.795 2.565 10 5 EFBEMO CC[C@@H]1C[N@@H+](C)CCN1c1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl ZINC000596247871 479222197 /nfs/dbraw/zinc/22/21/97/479222197.db2.gz SGYHEINUNONGAF-SNVBAGLBSA-N 1 1 341.795 2.565 10 5 EFBEMO COC(=O)c1c(Cl)c(N(C)C[C@H]2CCC[N@H+]2C)ccc1[N+](=O)[O-] ZINC000596279283 479235200 /nfs/dbraw/zinc/23/52/00/479235200.db2.gz RXRXSVZTHRJQEY-SNVBAGLBSA-N 1 1 341.795 2.565 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000593205436 479239242 /nfs/dbraw/zinc/23/92/42/479239242.db2.gz ZEYNKOFJMVNXND-UHFFFAOYSA-N 1 1 327.812 2.956 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000596307345 479247199 /nfs/dbraw/zinc/24/71/99/479247199.db2.gz KVKDYFCXJUKKEK-JTQLQIEISA-N 1 1 331.376 2.528 10 5 EFBEMO O=[N+]([O-])c1cc(F)ccc1NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000596423632 479288408 /nfs/dbraw/zinc/28/84/08/479288408.db2.gz MZELQWBVSGYAIM-MRXNPFEDSA-N 1 1 345.374 2.913 10 5 EFBEMO O=[N+]([O-])c1sccc1NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000596424989 479288639 /nfs/dbraw/zinc/28/86/39/479288639.db2.gz VYJOBRLKRHYGQA-CQSZACIVSA-N 1 1 333.413 2.835 10 5 EFBEMO O=[N+]([O-])c1cccc(F)c1NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000596424546 479288825 /nfs/dbraw/zinc/28/88/25/479288825.db2.gz RVGZYOSEEXROBN-OAHLLOKOSA-N 1 1 345.374 2.913 10 5 EFBEMO COc1cncc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000599433893 479296038 /nfs/dbraw/zinc/29/60/38/479296038.db2.gz MDQLLNHCDCPHES-AWEZNQCLSA-N 1 1 328.372 2.773 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCOC3CCOCC3)C2)cc1 ZINC000599434292 479296740 /nfs/dbraw/zinc/29/67/40/479296740.db2.gz XGZLJWMKBSARBS-MRXNPFEDSA-N 1 1 334.416 2.970 10 5 EFBEMO CCN(C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000596453679 479300727 /nfs/dbraw/zinc/30/07/27/479300727.db2.gz JUXCXVBZFHBSDX-DZGCQCFKSA-N 1 1 334.420 2.700 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](C(F)F)C2)cccc1[N+](=O)[O-] ZINC000611179378 479303398 /nfs/dbraw/zinc/30/33/98/479303398.db2.gz CADRALRXBDZFBM-LLVKDONJSA-N 1 1 327.331 2.819 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000596488480 479314185 /nfs/dbraw/zinc/31/41/85/479314185.db2.gz PYPMTMHSMGGVIV-UHFFFAOYSA-N 1 1 326.372 2.976 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000585717003 479315108 /nfs/dbraw/zinc/31/51/08/479315108.db2.gz SQMMAJGOJAUPRW-NVXWUHKLSA-N 1 1 333.432 2.843 10 5 EFBEMO C[N@H+]1CCO[C@H]2CCN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)C[C@@H]21 ZINC000585781969 479325416 /nfs/dbraw/zinc/32/54/16/479325416.db2.gz GYPISXYTXYITOH-HOTGVXAUSA-N 1 1 349.431 2.681 10 5 EFBEMO Cc1c(C[N@@H+]2CCOC[C@@H]2[C@@H]2CCCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000585800614 479331153 /nfs/dbraw/zinc/33/11/53/479331153.db2.gz BSVQNUUVBGPCNA-CGTJXYLNSA-N 1 1 334.416 2.655 10 5 EFBEMO Cc1c(C[N@H+]2CCOC[C@@H]2[C@@H]2CCCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000585800614 479331157 /nfs/dbraw/zinc/33/11/57/479331157.db2.gz BSVQNUUVBGPCNA-CGTJXYLNSA-N 1 1 334.416 2.655 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c1 ZINC000599552818 479331243 /nfs/dbraw/zinc/33/12/43/479331243.db2.gz JFTHXBNDJFMGDM-KGLIPLIRSA-N 1 1 336.413 2.851 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)[C@@H](C)C1 ZINC000611273853 479333109 /nfs/dbraw/zinc/33/31/09/479333109.db2.gz PRMZZFGRDIJYMV-DZGCQCFKSA-N 1 1 349.431 2.528 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000596579543 479346220 /nfs/dbraw/zinc/34/62/20/479346220.db2.gz OUEOMHSHHQYGCU-UHFFFAOYSA-N 1 1 336.436 2.823 10 5 EFBEMO CCN(C(=O)NCc1cccc([N+](=O)[O-])c1C)[C@@H]1CC[N@@H+](CC)C1 ZINC000596580352 479346478 /nfs/dbraw/zinc/34/64/78/479346478.db2.gz WEFJKNPLOKLFQO-OAHLLOKOSA-N 1 1 334.420 2.529 10 5 EFBEMO O=[N+]([O-])c1ccc2c(c1)nccc2N1CC[NH+](Cc2ccncc2)CC1 ZINC000593454217 479346825 /nfs/dbraw/zinc/34/68/25/479346825.db2.gz FDIVMKIHPCTWGH-UHFFFAOYSA-N 1 1 349.394 2.860 10 5 EFBEMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC(C)([NH+]2CCOCC2)CC1 ZINC000599623803 479356944 /nfs/dbraw/zinc/35/69/44/479356944.db2.gz XNEHKAKLLAVMNH-OAHLLOKOSA-N 1 1 333.432 2.843 10 5 EFBEMO CCC1(N2CCOCC2)CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000599668108 479379768 /nfs/dbraw/zinc/37/97/68/479379768.db2.gz CRBMPOGPOZLKMK-UHFFFAOYSA-N 1 1 347.459 2.980 10 5 EFBEMO CCC1(N2CCOCC2)CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000599669499 479381308 /nfs/dbraw/zinc/38/13/08/479381308.db2.gz NEXINSNUCZUJBQ-UHFFFAOYSA-N 1 1 333.432 2.672 10 5 EFBEMO CCC1([NH+]2CCOCC2)CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000599670120 479381442 /nfs/dbraw/zinc/38/14/42/479381442.db2.gz SQRFIEAKZGOWNV-UHFFFAOYSA-N 1 1 347.459 2.714 10 5 EFBEMO COC(=O)[C@@H]1C[C@@H](C)[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)[C@@H](C)C1 ZINC000599689875 479393429 /nfs/dbraw/zinc/39/34/29/479393429.db2.gz LDRKJYZSBBFGLF-CLLJXQQHSA-N 1 1 336.388 2.765 10 5 EFBEMO COC(=O)[C@@H]1C[C@@H](C)[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)[C@@H](C)C1 ZINC000599689875 479393433 /nfs/dbraw/zinc/39/34/33/479393433.db2.gz LDRKJYZSBBFGLF-CLLJXQQHSA-N 1 1 336.388 2.765 10 5 EFBEMO C[C@H]1CC[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@@H]1F ZINC000611501764 479397561 /nfs/dbraw/zinc/39/75/61/479397561.db2.gz IEIUGKXONBKFOQ-AAEUAGOBSA-N 1 1 337.351 2.573 10 5 EFBEMO C[C@H]1CC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@@H]1F ZINC000611501764 479397563 /nfs/dbraw/zinc/39/75/63/479397563.db2.gz IEIUGKXONBKFOQ-AAEUAGOBSA-N 1 1 337.351 2.573 10 5 EFBEMO COC(=O)[C@@H]1C[C@@H](C)[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000599709103 479401104 /nfs/dbraw/zinc/40/11/04/479401104.db2.gz PLGKAKIYCNMTES-DABQJJPHSA-N 1 1 336.388 2.765 10 5 EFBEMO COC(=O)[C@@H]1C[C@@H](C)[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000599709103 479401108 /nfs/dbraw/zinc/40/11/08/479401108.db2.gz PLGKAKIYCNMTES-DABQJJPHSA-N 1 1 336.388 2.765 10 5 EFBEMO COc1cc(C[N@H+]2CCc3ccc(O)cc3CC2)ccc1[N+](=O)[O-] ZINC000611516682 479402580 /nfs/dbraw/zinc/40/25/80/479402580.db2.gz SHGGDBVXQSTCBH-UHFFFAOYSA-N 1 1 328.368 2.910 10 5 EFBEMO COc1cc(C[N@H+](C)[C@H]2CCCc3c2cnn3C)ccc1[N+](=O)[O-] ZINC000611516754 479403044 /nfs/dbraw/zinc/40/30/44/479403044.db2.gz RHWPERNSUYYFKB-AWEZNQCLSA-N 1 1 330.388 2.846 10 5 EFBEMO COc1cc(C[N@@H+](C)[C@H]2CCCc3c2cnn3C)ccc1[N+](=O)[O-] ZINC000611516754 479403049 /nfs/dbraw/zinc/40/30/49/479403049.db2.gz RHWPERNSUYYFKB-AWEZNQCLSA-N 1 1 330.388 2.846 10 5 EFBEMO COc1ccc(OCC[N@@H+]2CCC[C@@H](OC(F)F)C2)c([N+](=O)[O-])c1 ZINC000611579054 479423525 /nfs/dbraw/zinc/42/35/25/479423525.db2.gz HLWPLPNKNQGFBO-GFCCVEGCSA-N 1 1 346.330 2.686 10 5 EFBEMO COc1ccc(OCC[N@H+]2CCC[C@@H](OC(F)F)C2)c([N+](=O)[O-])c1 ZINC000611579054 479423529 /nfs/dbraw/zinc/42/35/29/479423529.db2.gz HLWPLPNKNQGFBO-GFCCVEGCSA-N 1 1 346.330 2.686 10 5 EFBEMO Cn1ccnc1[C@H]([NH2+]CCC1(CO)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000593692464 479425395 /nfs/dbraw/zinc/42/53/95/479425395.db2.gz ZFCADAKQKGAQJA-MRXNPFEDSA-N 1 1 344.415 2.560 10 5 EFBEMO C[N@H+]1CCC[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599829843 479442365 /nfs/dbraw/zinc/44/23/65/479442365.db2.gz MSNUKFLVBYSELX-GFCCVEGCSA-N 1 1 343.387 2.606 10 5 EFBEMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599833737 479444427 /nfs/dbraw/zinc/44/44/27/479444427.db2.gz XVRLOPIZQQZOEY-NWDGAFQWSA-N 1 1 343.387 2.699 10 5 EFBEMO C[C@@H]1[C@H](C)N(C(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)CC[N@@H+]1C ZINC000599833736 479444449 /nfs/dbraw/zinc/44/44/49/479444449.db2.gz XVRLOPIZQQZOEY-NEPJUHHUSA-N 1 1 343.387 2.699 10 5 EFBEMO CCC[N@H+]1CC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599834928 479445709 /nfs/dbraw/zinc/44/57/09/479445709.db2.gz PJSJRZSGFZLEFP-LBPRGKRZSA-N 1 1 343.387 2.749 10 5 EFBEMO COc1ccc(NC(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000596833072 479446712 /nfs/dbraw/zinc/44/67/12/479446712.db2.gz VTLYGXSJALNXIK-LBPRGKRZSA-N 1 1 336.392 2.598 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000596842140 479450983 /nfs/dbraw/zinc/45/09/83/479450983.db2.gz CUKVFORJHMFTIL-UHFFFAOYSA-N 1 1 338.408 2.845 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000593760511 479451154 /nfs/dbraw/zinc/45/11/54/479451154.db2.gz UKACFLIDPLIRSC-UHFFFAOYSA-N 1 1 332.404 2.784 10 5 EFBEMO Cn1cc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)nn1 ZINC000611931205 479525548 /nfs/dbraw/zinc/52/55/48/479525548.db2.gz JPIIPQLICGUPKX-UHFFFAOYSA-N 1 1 329.385 2.742 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)C2CCC(OC)CC2)c1 ZINC000589500110 479533654 /nfs/dbraw/zinc/53/36/54/479533654.db2.gz XROGFEAMEIFHPQ-UHFFFAOYSA-N 1 1 336.388 2.771 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCOC[C@H](C3CCC3)C2)c1 ZINC000590053307 479596698 /nfs/dbraw/zinc/59/66/98/479596698.db2.gz BSDWFBSCBPMGCX-MRXNPFEDSA-N 1 1 348.399 2.630 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCOC[C@H](C3CCC3)C2)c1 ZINC000590053307 479596707 /nfs/dbraw/zinc/59/67/07/479596707.db2.gz BSDWFBSCBPMGCX-MRXNPFEDSA-N 1 1 348.399 2.630 10 5 EFBEMO C[N@H+]1C[C@H]2CCN(Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)[C@@H]2C1 ZINC000590183925 479614789 /nfs/dbraw/zinc/61/47/89/479614789.db2.gz DWIPWEVYHVRPCK-QMTHXVAHSA-N 1 1 329.322 2.750 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[NH+]1CCC(c3ccon3)CC1)OCCO2 ZINC000597230873 479632914 /nfs/dbraw/zinc/63/29/14/479632914.db2.gz ZUYFKJPGPXJRBU-UHFFFAOYSA-N 1 1 345.355 2.734 10 5 EFBEMO CC(C)NC(=O)[C@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000597231099 479632955 /nfs/dbraw/zinc/63/29/55/479632955.db2.gz IJIIFDHXXJQTJU-WHWKNOJMSA-N 1 1 331.416 2.845 10 5 EFBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c1 ZINC000597231846 479633848 /nfs/dbraw/zinc/63/38/48/479633848.db2.gz RUENYLHZMGHJBI-PWSUYJOCSA-N 1 1 328.315 2.665 10 5 EFBEMO CC(C)c1ccc(CN2CCC([N@H+]3CC[C@H](O)C3)CC2)cc1[N+](=O)[O-] ZINC000597235830 479634889 /nfs/dbraw/zinc/63/48/89/479634889.db2.gz LFRXXUTVOBSUFT-KRWDZBQOSA-N 1 1 347.459 2.749 10 5 EFBEMO C[C@H](O)[C@H]([NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccccc1 ZINC000597249694 479644754 /nfs/dbraw/zinc/64/47/54/479644754.db2.gz YDSWCFIFNOBFDT-SGTLLEGYSA-N 1 1 344.367 2.578 10 5 EFBEMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@H]21 ZINC000590445860 479649352 /nfs/dbraw/zinc/64/93/52/479649352.db2.gz TXOBBBMJRXDKIV-IUODEOHRSA-N 1 1 349.456 2.873 10 5 EFBEMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2C[N@@H+](C)C[C@@H]21 ZINC000590445869 479649537 /nfs/dbraw/zinc/64/95/37/479649537.db2.gz TXOBBBMJRXDKIV-WFASDCNBSA-N 1 1 349.456 2.873 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000619252188 479732130 /nfs/dbraw/zinc/73/21/30/479732130.db2.gz GNKLGIMCEVZZSX-CABCVRRESA-N 1 1 349.406 2.778 10 5 EFBEMO CC[C@@H]1C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000619434239 479789457 /nfs/dbraw/zinc/78/94/57/479789457.db2.gz OFAGMVFWQQXHDA-LBSIBSHJSA-N 1 1 332.400 2.878 10 5 EFBEMO CC[C@@H]1C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000619434239 479789462 /nfs/dbraw/zinc/78/94/62/479789462.db2.gz OFAGMVFWQQXHDA-LBSIBSHJSA-N 1 1 332.400 2.878 10 5 EFBEMO C[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1nnc2n1CCCCC2 ZINC000613062631 479857983 /nfs/dbraw/zinc/85/79/83/479857983.db2.gz GERJJLBWLBKPEK-CYBMUJFWSA-N 1 1 345.403 2.642 10 5 EFBEMO O=[N+]([O-])c1ncccc1N1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000619698922 479861354 /nfs/dbraw/zinc/86/13/54/479861354.db2.gz UDHSJZYVELOBNL-CYBMUJFWSA-N 1 1 327.388 2.907 10 5 EFBEMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCC[C@@H]1C1CC1 ZINC000609766294 480203132 /nfs/dbraw/zinc/20/31/32/480203132.db2.gz HANDRSIJOVCIJP-CQSZACIVSA-N 1 1 331.372 2.767 10 5 EFBEMO C[C@H]([NH2+]C1CCN(C[C@H]2CCCO2)CC1)c1ccccc1[N+](=O)[O-] ZINC000610420513 480301290 /nfs/dbraw/zinc/30/12/90/480301290.db2.gz DMOGHUWAIDIKGW-GOEBONIOSA-N 1 1 333.432 2.889 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@@]3(O)CCCC[C@@H]3C2)c([N+](=O)[O-])cc1F ZINC000184238030 533822744 /nfs/dbraw/zinc/82/27/44/533822744.db2.gz NPLJFSLJKTUJJO-DYVFJYSZSA-N 1 1 338.379 2.870 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@@]3(O)CCCC[C@@H]3C2)c([N+](=O)[O-])cc1F ZINC000184238030 533822751 /nfs/dbraw/zinc/82/27/51/533822751.db2.gz NPLJFSLJKTUJJO-DYVFJYSZSA-N 1 1 338.379 2.870 10 5 EFBEMO C[C@@H]1CC[C@](CO)([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000187985251 534264156 /nfs/dbraw/zinc/26/41/56/534264156.db2.gz GMJVPPIOXOWWMY-PXAZEXFGSA-N 1 1 346.387 2.628 10 5 EFBEMO CC(C)NC(=O)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180011981 519708859 /nfs/dbraw/zinc/70/88/59/519708859.db2.gz IWCIKLPRSIKENK-GOSISDBHSA-N 1 1 327.384 2.798 10 5 EFBEMO CC[N@H+]1CCC[C@@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000119610489 521620094 /nfs/dbraw/zinc/62/00/94/521620094.db2.gz IBVSAUZHNMZLNY-MRXNPFEDSA-N 1 1 348.447 2.701 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000176967059 521627522 /nfs/dbraw/zinc/62/75/22/521627522.db2.gz HZZUYGFMDYKZIB-QGZVFWFLSA-N 1 1 348.447 2.730 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000177044464 521652516 /nfs/dbraw/zinc/65/25/16/521652516.db2.gz FHWDKQUFPATRLH-ZDUSSCGKSA-N 1 1 325.796 2.805 10 5 EFBEMO CCc1ccc(C(=O)N(C)[C@@H]2CC[N@H+](CC)C[C@H]2C)cc1[N+](=O)[O-] ZINC000245408416 523881322 /nfs/dbraw/zinc/88/13/22/523881322.db2.gz HBMCNYGUZXICCH-CZUORRHYSA-N 1 1 333.432 2.960 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@H](Oc3cccnc3)C2)cc1[N+](=O)[O-] ZINC000152194123 524037910 /nfs/dbraw/zinc/03/79/10/524037910.db2.gz QENYVJPFKZGQKV-HNNXBMFYSA-N 1 1 329.356 2.652 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@H](Oc3cccnc3)C2)cc1[N+](=O)[O-] ZINC000152194123 524037914 /nfs/dbraw/zinc/03/79/14/524037914.db2.gz QENYVJPFKZGQKV-HNNXBMFYSA-N 1 1 329.356 2.652 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000068121764 524106634 /nfs/dbraw/zinc/10/66/34/524106634.db2.gz XJMBWIAGCMPMFH-OAHLLOKOSA-N 1 1 348.447 2.778 10 5 EFBEMO CNC(=O)[C@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC000178950026 524110531 /nfs/dbraw/zinc/11/05/31/524110531.db2.gz QDISNSFEHKTBCU-CQSZACIVSA-N 1 1 348.428 2.579 10 5 EFBEMO Cc1ccc(C)c([C@@H]2C[N@H+](CCn3cc([N+](=O)[O-])cn3)[C@@H](C)CO2)c1 ZINC000245409700 524206872 /nfs/dbraw/zinc/20/68/72/524206872.db2.gz NORMMGUEFCEZPS-YJBOKZPZSA-N 1 1 344.415 2.870 10 5 EFBEMO Cc1ccc(C)c([C@@H]2C[N@@H+](CCn3cc([N+](=O)[O-])cn3)[C@@H](C)CO2)c1 ZINC000245409700 524206880 /nfs/dbraw/zinc/20/68/80/524206880.db2.gz NORMMGUEFCEZPS-YJBOKZPZSA-N 1 1 344.415 2.870 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1C[N@@H+](C(C)C)C[C@@H]1C ZINC000179790419 524335796 /nfs/dbraw/zinc/33/57/96/524335796.db2.gz KDOVUTCLZBRITH-DZGCQCFKSA-N 1 1 333.432 2.979 10 5 EFBEMO Cc1cccc(N2CCC(Nc3cc(N)ccc3[N+](=O)[O-])CC2)[nH+]1 ZINC000193442286 524540544 /nfs/dbraw/zinc/54/05/44/524540544.db2.gz ZQIRWMPRZHUKFL-UHFFFAOYSA-N 1 1 327.388 2.961 10 5 EFBEMO Cc1cccc(N2CCC(NC(=O)c3ccc([N+](=O)[O-])s3)CC2)[nH+]1 ZINC000116670716 524540649 /nfs/dbraw/zinc/54/06/49/524540649.db2.gz MBGPXNZOCQCHKX-UHFFFAOYSA-N 1 1 346.412 2.759 10 5 EFBEMO Cc1ccc(N2CCC(NC(=O)c3ccc([N+](=O)[O-])cc3)CC2)[nH+]c1 ZINC000157708146 524943729 /nfs/dbraw/zinc/94/37/29/524943729.db2.gz LZNRIFUMUILPTP-UHFFFAOYSA-N 1 1 340.383 2.697 10 5 EFBEMO COc1ccc([C@@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1F ZINC000119757728 525156271 /nfs/dbraw/zinc/15/62/71/525156271.db2.gz MEJCVLJRTDUZAW-SNVBAGLBSA-N 1 1 347.346 2.692 10 5 EFBEMO C[C@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1cn[nH]c1 ZINC000229631266 525437440 /nfs/dbraw/zinc/43/74/40/525437440.db2.gz GKMXOCZFKVISRH-QMMMGPOBSA-N 1 1 325.166 2.931 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000245439623 525454747 /nfs/dbraw/zinc/45/47/47/525454747.db2.gz FYCSMEFTBHFUIN-HIFRSBDPSA-N 1 1 347.415 2.691 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](Oc2cccnc2)C1 ZINC000152391684 525461671 /nfs/dbraw/zinc/46/16/71/525461671.db2.gz PTGVWNRSNRPEKB-INIZCTEOSA-N 1 1 329.356 2.652 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](Oc2cccnc2)C1 ZINC000152391684 525461678 /nfs/dbraw/zinc/46/16/78/525461678.db2.gz PTGVWNRSNRPEKB-INIZCTEOSA-N 1 1 329.356 2.652 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@@]4(CCOC4)C3)o2)cc1 ZINC000187550136 534881067 /nfs/dbraw/zinc/88/10/67/534881067.db2.gz BOFNRKLWTGMDDC-SFHVURJKSA-N 1 1 344.367 2.846 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@@]4(CCOC4)C3)o2)cc1 ZINC000187550136 534881069 /nfs/dbraw/zinc/88/10/69/534881069.db2.gz BOFNRKLWTGMDDC-SFHVURJKSA-N 1 1 344.367 2.846 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H](N2CCN(C)CC2)C1 ZINC000245430997 526084643 /nfs/dbraw/zinc/08/46/43/526084643.db2.gz NVFAKEDLWBSHKP-VQIMIIECSA-N 1 1 346.475 2.758 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2cc[nH]n2)CC1 ZINC000195506356 526145235 /nfs/dbraw/zinc/14/52/35/526145235.db2.gz RBTPCJNEDRBMOK-GFCCVEGCSA-N 1 1 343.387 2.525 10 5 EFBEMO Cc1nc(C[C@@H]2CCC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)no1 ZINC000195518230 526920070 /nfs/dbraw/zinc/92/00/70/526920070.db2.gz YJSIVOUBDLUECI-LBPRGKRZSA-N 1 1 334.351 2.880 10 5 EFBEMO Cc1nc(C[C@@H]2CCC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)no1 ZINC000195518230 526920074 /nfs/dbraw/zinc/92/00/74/526920074.db2.gz YJSIVOUBDLUECI-LBPRGKRZSA-N 1 1 334.351 2.880 10 5 EFBEMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(OC[C@H]2CCCO2)CC1 ZINC000177451255 527357147 /nfs/dbraw/zinc/35/71/47/527357147.db2.gz KCUJUEDTXYUGLN-MRXNPFEDSA-N 1 1 338.379 2.894 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000188040310 527751610 /nfs/dbraw/zinc/75/16/10/527751610.db2.gz VAPDSYRMUPCGBL-IUODEOHRSA-N 1 1 349.431 2.714 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184228707 529068314 /nfs/dbraw/zinc/06/83/14/529068314.db2.gz UHHDSUNKWMMVGH-CYBMUJFWSA-N 1 1 325.384 2.659 10 5 EFBEMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000356809306 535017175 /nfs/dbraw/zinc/01/71/75/535017175.db2.gz OLPUAWHOORHIPX-SNVBAGLBSA-N 1 1 345.346 2.655 10 5 EFBEMO COC(=O)c1cc(NCCCC[N@@H+](C)C2CC2)cc(C)c1[N+](=O)[O-] ZINC000413349686 536566086 /nfs/dbraw/zinc/56/60/86/536566086.db2.gz SWWWEHRXKQFFTL-UHFFFAOYSA-N 1 1 335.404 2.976 10 5 EFBEMO COC(=O)/C=C\c1ccc(N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000757795579 575853125 /nfs/dbraw/zinc/85/31/25/575853125.db2.gz RCQGWAFMMOYAKE-ZNBMNBLBSA-N 1 1 345.399 2.676 10 5 EFBEMO COC(=O)/C=C\c1ccc(N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000757795577 575853182 /nfs/dbraw/zinc/85/31/82/575853182.db2.gz RCQGWAFMMOYAKE-YKHQIWRUSA-N 1 1 345.399 2.676 10 5 EFBEMO O=C(Cn1c[nH+]c2c1CCCC2)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000758324109 575866715 /nfs/dbraw/zinc/86/67/15/575866715.db2.gz KGFWPJRETJQHOI-UHFFFAOYSA-N 1 1 348.790 2.640 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cncc4ccccc43)CC2)cn1 ZINC000768302757 577265275 /nfs/dbraw/zinc/26/52/75/577265275.db2.gz MBXAXKKZCTXEQX-UHFFFAOYSA-N 1 1 349.394 2.860 10 5 EFBEMO Cc1nc(C)c(C(=O)NCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC001690994640 1247912287 /nfs/dbraw/zinc/91/22/87/1247912287.db2.gz LYUYZAIIDJVZCV-UHFFFAOYSA-N 1 1 348.428 2.530 10 5 EFBEMO Cc1nc(C)c(C(=O)NCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC001690994640 1247912294 /nfs/dbraw/zinc/91/22/94/1247912294.db2.gz LYUYZAIIDJVZCV-UHFFFAOYSA-N 1 1 348.428 2.530 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC001127741015 1255449947 /nfs/dbraw/zinc/44/99/47/1255449947.db2.gz SGEHVFSNLLZFJI-INIZCTEOSA-N 1 1 343.358 2.959 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](C)Cc2ccccc21 ZINC001127741015 1255449953 /nfs/dbraw/zinc/44/99/53/1255449953.db2.gz SGEHVFSNLLZFJI-INIZCTEOSA-N 1 1 343.358 2.959 10 5 EFBEMO 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IXQSDXXXKLJVKB-PWSUYJOCSA-N 1 1 343.424 2.594 10 5 EFBEMO CCC[C@H](C)C(=O)NCC[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872073517 1287420608 /nfs/dbraw/zinc/42/06/08/1287420608.db2.gz QHSQALIFBWHXRS-NWDGAFQWSA-N 1 1 325.384 2.937 10 5 EFBEMO O=C(C[NH2+][C@H]1CCCn2nccc21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC001175643118 1287499912 /nfs/dbraw/zinc/49/99/12/1287499912.db2.gz LVMYMSCRKGEHHM-NSHDSACASA-N 1 1 349.778 2.508 10 5 EFBEMO Cc1[nH+]ccn1CCCOC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000808563305 1281797412 /nfs/dbraw/zinc/79/74/12/1281797412.db2.gz MOWCWRXZQURXRK-UHFFFAOYSA-N 1 1 339.298 2.554 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCc2ccc([N+](=O)[O-])cc2F)C1 ZINC000811446907 1284322953 /nfs/dbraw/zinc/32/29/53/1284322953.db2.gz YIFLWMQQTWGFLD-INIZCTEOSA-N 1 1 342.342 2.990 10 5 EFBEMO C[N@@H+](CCNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2)C1CCCCC1 ZINC000811769049 1284583719 /nfs/dbraw/zinc/58/37/19/1284583719.db2.gz PBUDIZMQMJTTJT-UHFFFAOYSA-N 1 1 348.403 2.602 10 5 EFBEMO Cc1[nH+]ccn1-c1ncccc1CNc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000811826335 1284690727 /nfs/dbraw/zinc/69/07/27/1284690727.db2.gz WIDYZGKDTBFQTO-UHFFFAOYSA-N 1 1 349.354 2.972 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000812848227 1285472984 /nfs/dbraw/zinc/47/29/84/1285472984.db2.gz IKDJSVUUQMQHFJ-QGZVFWFLSA-N 1 1 335.379 2.696 10 5 EFBEMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@@H]([C@H]4CCOC4)C3)c2c1 ZINC000747828699 1285556456 /nfs/dbraw/zinc/55/64/56/1285556456.db2.gz HPGFWKCZLQXIGS-CABCVRRESA-N 1 1 330.388 2.651 10 5 EFBEMO CSC[C@@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172658 1285703456 /nfs/dbraw/zinc/70/34/56/1285703456.db2.gz PSODNGKNKKYBCD-DOMZBBRYSA-N 1 1 338.429 2.711 10 5 EFBEMO CSC[C@@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172658 1285703461 /nfs/dbraw/zinc/70/34/61/1285703461.db2.gz PSODNGKNKKYBCD-DOMZBBRYSA-N 1 1 338.429 2.711 10 5 EFBEMO 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ZINC001176880467 1288158884 /nfs/dbraw/zinc/15/88/84/1288158884.db2.gz VNPAVYSQURUHOI-LLVKDONJSA-N 1 1 335.795 2.756 10 5 EFBEMO CC(C)[C@@H]1C[C@@H](N2CCCC2)C[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001176887188 1288162659 /nfs/dbraw/zinc/16/26/59/1288162659.db2.gz PGFOPJIELKVBKW-QYZOEREBSA-N 1 1 347.459 2.823 10 5 EFBEMO CC(C)[C@@H]1C[C@@H](N2CCCC2)C[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001176887188 1288162666 /nfs/dbraw/zinc/16/26/66/1288162666.db2.gz PGFOPJIELKVBKW-QYZOEREBSA-N 1 1 347.459 2.823 10 5 EFBEMO CC[N@H+]1C[C@@H](NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C(C)(C)C1 ZINC001178870038 1288951013 /nfs/dbraw/zinc/95/10/13/1288951013.db2.gz XBFFOIJRDQDEFH-OAHLLOKOSA-N 1 1 337.395 2.513 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCCC[N@H+]1CC ZINC001136754869 1289394300 /nfs/dbraw/zinc/39/43/00/1289394300.db2.gz GTXLLWVBFFTFMF-CYBMUJFWSA-N 1 1 335.404 2.598 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccsn1 ZINC001273530042 1291034163 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CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C(C)(C)C)cc1 ZINC001267241507 1093338798 /nfs/dbraw/zinc/33/87/98/1093338798.db2.gz ZQVGRLIOWHSMTG-IAGOWNOFSA-N 1 1 347.459 2.587 10 5 EFBEMO CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C(C)(C)C)cc1 ZINC001267241507 1093338804 /nfs/dbraw/zinc/33/88/04/1093338804.db2.gz ZQVGRLIOWHSMTG-IAGOWNOFSA-N 1 1 347.459 2.587 10 5 EFBEMO CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C(C)(C)C)cc1 ZINC001267241507 1093338813 /nfs/dbraw/zinc/33/88/13/1093338813.db2.gz ZQVGRLIOWHSMTG-IAGOWNOFSA-N 1 1 347.459 2.587 10 5 EFBEMO CCC[N@H+]1CC[C@@H](CNc2c3cc(F)ccc3ncc2[N+](=O)[O-])C1 ZINC001650677153 1093481717 /nfs/dbraw/zinc/48/17/17/1093481717.db2.gz TWQQTRDXYQTFJH-LBPRGKRZSA-N 1 1 332.379 2.848 10 5 EFBEMO C[N@H+]1CCN(c2nc3ccccn3c2[N+](=O)[O-])CC12CCCCC2 ZINC001651079559 1093523293 /nfs/dbraw/zinc/52/32/93/1093523293.db2.gz NWDCMSSFNGIXFB-UHFFFAOYSA-N 1 1 329.404 2.697 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1ccns1)Cc1ccc([N+](=O)[O-])cc1 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1 1 344.415 2.870 10 5 EFBEMO Cc1ccc(C)c([C@@H]2C[N@@H+](CCn3cc([N+](=O)[O-])cn3)[C@H](C)CO2)c1 ZINC000174876753 231331178 /nfs/dbraw/zinc/33/11/78/231331178.db2.gz NORMMGUEFCEZPS-QAPCUYQASA-N 1 1 344.415 2.870 10 5 EFBEMO CC[C@H]([NH2+]Cc1cc(=O)n2ccsc2n1)c1cccc([N+](=O)[O-])c1 ZINC000181528826 529623803 /nfs/dbraw/zinc/62/38/03/529623803.db2.gz ZVIKNXQSPMWQPY-AWEZNQCLSA-N 1 1 344.396 2.905 10 5 EFBEMO CC(C)[C@H](c1cccnc1)[N@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000069351636 215386772 /nfs/dbraw/zinc/38/67/72/215386772.db2.gz FDFLGLWXDVWPTG-QGZVFWFLSA-N 1 1 342.399 2.918 10 5 EFBEMO CC(C)[C@H](c1cccnc1)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000069351636 215386774 /nfs/dbraw/zinc/38/67/74/215386774.db2.gz FDFLGLWXDVWPTG-QGZVFWFLSA-N 1 1 342.399 2.918 10 5 EFBEMO COc1cc(C[NH+]2CCC(c3ccnn3C)CC2)c([N+](=O)[O-])cc1F ZINC000184193807 235329523 /nfs/dbraw/zinc/32/95/23/235329523.db2.gz FZQBXDXSGZUQTI-UHFFFAOYSA-N 1 1 348.378 2.856 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@]1(CO)CC[C@H](C)C1 ZINC000187936558 236348054 /nfs/dbraw/zinc/34/80/54/236348054.db2.gz UZYUJSDCKFANQA-SCLBCKFNSA-N 1 1 349.431 2.715 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@]1(CO)CC[C@H](C)C1 ZINC000187967276 236362161 /nfs/dbraw/zinc/36/21/61/236362161.db2.gz VZGLXQHAYMBTLY-UGSOOPFHSA-N 1 1 349.431 2.715 10 5 EFBEMO Cc1ccc([C@@H](C)NC(=O)N2CC[N@H+]3CCCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000246940672 243337986 /nfs/dbraw/zinc/33/79/86/243337986.db2.gz HMQQBLBIRRUDHL-ZBFHGGJFSA-N 1 1 346.431 2.844 10 5 EFBEMO C[C@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000078870243 217134986 /nfs/dbraw/zinc/13/49/86/217134986.db2.gz LZMLDTKOCNKTJF-WDEREUQCSA-N 1 1 325.796 2.803 10 5 EFBEMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@H](c3nnc[nH]3)C2)c1 ZINC000425527496 247123196 /nfs/dbraw/zinc/12/31/96/247123196.db2.gz AOVNETQESDRTJJ-VIFPVBQESA-N 1 1 341.293 2.721 10 5 EFBEMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H](c3nnc[nH]3)C2)c1 ZINC000425527496 247123201 /nfs/dbraw/zinc/12/32/01/247123201.db2.gz AOVNETQESDRTJJ-VIFPVBQESA-N 1 1 341.293 2.721 10 5 EFBEMO C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000426006141 247225838 /nfs/dbraw/zinc/22/58/38/247225838.db2.gz ZUFBCOYYOLOARQ-DGCLKSJQSA-N 1 1 333.413 2.921 10 5 EFBEMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CCN(c2cnccn2)CC1 ZINC000434738805 248184185 /nfs/dbraw/zinc/18/41/85/248184185.db2.gz SDZSDYAWMNFMAR-UHFFFAOYSA-N 1 1 345.378 2.625 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441198692 250006695 /nfs/dbraw/zinc/00/66/95/250006695.db2.gz NNGAXRSRHLKXIM-GJZGRUSLSA-N 1 1 347.415 2.590 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441274768 250013672 /nfs/dbraw/zinc/01/36/72/250013672.db2.gz GALQIEGYWUZACB-CABCVRRESA-N 1 1 347.415 2.590 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441274768 250013676 /nfs/dbraw/zinc/01/36/76/250013676.db2.gz GALQIEGYWUZACB-CABCVRRESA-N 1 1 347.415 2.590 10 5 EFBEMO COc1cc(CN(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000093644320 218238654 /nfs/dbraw/zinc/23/86/54/218238654.db2.gz CAZDXQAKJXRZKC-JSGCOSHPSA-N 1 1 337.420 2.527 10 5 EFBEMO COc1cc(C[N@@H+]2CCC[C@H]([C@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000444739596 250340309 /nfs/dbraw/zinc/34/03/09/250340309.db2.gz VCORMAJQIWBKQT-FZMZJTMJSA-N 1 1 348.321 2.739 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@H]([C@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000444739596 250340312 /nfs/dbraw/zinc/34/03/12/250340312.db2.gz VCORMAJQIWBKQT-FZMZJTMJSA-N 1 1 348.321 2.739 10 5 EFBEMO O=[N+]([O-])c1cccc(C[N@@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c1 ZINC000449420663 251021335 /nfs/dbraw/zinc/02/13/35/251021335.db2.gz JZARQFDWADVHIQ-ZWKOTPCHSA-N 1 1 330.359 2.895 10 5 EFBEMO O=[N+]([O-])c1cccc(C[N@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c1 ZINC000449420663 251021340 /nfs/dbraw/zinc/02/13/40/251021340.db2.gz JZARQFDWADVHIQ-ZWKOTPCHSA-N 1 1 330.359 2.895 10 5 EFBEMO C[C@@H]1C[C@@H](N(C)C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC[N@H+]1C ZINC000267440411 251060238 /nfs/dbraw/zinc/06/02/38/251060238.db2.gz YROUQKYSNGCHLO-MNOVXSKESA-N 1 1 325.796 2.803 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000449664803 251105364 /nfs/dbraw/zinc/10/53/64/251105364.db2.gz BURDROUXXOPMPM-QDFGCFFBSA-N 1 1 330.306 2.853 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1 ZINC000449673626 251110978 /nfs/dbraw/zinc/11/09/78/251110978.db2.gz PKOPVGMRSYRRKP-BXKDBHETSA-N 1 1 338.713 2.993 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1 ZINC000449673626 251110981 /nfs/dbraw/zinc/11/09/81/251110981.db2.gz PKOPVGMRSYRRKP-BXKDBHETSA-N 1 1 338.713 2.993 10 5 EFBEMO C[C@H]1OCC[C@H]1[N@@H+](CCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000449679066 251113227 /nfs/dbraw/zinc/11/32/27/251113227.db2.gz QULGHDCWCNCCCC-CZUORRHYSA-N 1 1 346.383 2.827 10 5 EFBEMO C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000449676090 251114079 /nfs/dbraw/zinc/11/40/79/251114079.db2.gz FBUAAJAQOURHEB-DYVFJYSZSA-N 1 1 346.383 2.827 10 5 EFBEMO C[C@@H]1CN(CC(F)(F)F)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000449664735 251105763 /nfs/dbraw/zinc/10/57/63/251105763.db2.gz LVMGTORCXIMWQB-LBPRGKRZSA-N 1 1 331.338 2.911 10 5 EFBEMO C[C@@H]1CN(CC(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000449664735 251105765 /nfs/dbraw/zinc/10/57/65/251105765.db2.gz LVMGTORCXIMWQB-LBPRGKRZSA-N 1 1 331.338 2.911 10 5 EFBEMO COC(=O)Cc1ccc(NCC[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000450257428 251318537 /nfs/dbraw/zinc/31/85/37/251318537.db2.gz LMFARWPGVLNSLS-CYBMUJFWSA-N 1 1 335.404 2.597 10 5 EFBEMO Cc1nc(NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)ncc1[N+](=O)[O-] ZINC000450347093 251354756 /nfs/dbraw/zinc/35/47/56/251354756.db2.gz GVMNLPBMUGPTGP-SWLSCSKDSA-N 1 1 347.444 2.672 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c1 ZINC000451339683 251532165 /nfs/dbraw/zinc/53/21/65/251532165.db2.gz ITQIPHMLMFSUQB-KZNAEPCWSA-N 1 1 334.416 2.989 10 5 EFBEMO CN(C(=O)c1ccc([N+](=O)[O-])o1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000268556262 252019848 /nfs/dbraw/zinc/01/98/48/252019848.db2.gz NOAJHASXMOXPJH-AWEZNQCLSA-N 1 1 329.356 2.534 10 5 EFBEMO CCn1cc(C[N@H+]2CCCN(c3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000112695452 220376188 /nfs/dbraw/zinc/37/61/88/220376188.db2.gz QINKOKGZRJFSAK-UHFFFAOYSA-N 1 1 329.404 2.524 10 5 EFBEMO CCOc1ccc(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000344639779 142053772 /nfs/dbraw/zinc/05/37/72/142053772.db2.gz HDBLHSZIEVJQIN-INIZCTEOSA-N 1 1 349.431 2.844 10 5 EFBEMO Cc1cn2cc(Nc3ccc([N+](=O)[O-])cc3S(C)(=O)=O)ccc2[nH+]1 ZINC000344967151 142104861 /nfs/dbraw/zinc/10/48/61/142104861.db2.gz LVAYANHNDAKLBZ-UHFFFAOYSA-N 1 1 346.368 2.698 10 5 EFBEMO CC[N@H+]1C[C@@H](C)N(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@H]1C ZINC000345942991 142121829 /nfs/dbraw/zinc/12/18/29/142121829.db2.gz FKJYJXDCHYRNOF-VXGBXAGGSA-N 1 1 330.388 2.631 10 5 EFBEMO O=C(CC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)Nc1ccc(F)cc1 ZINC000347782170 142271296 /nfs/dbraw/zinc/27/12/96/142271296.db2.gz HXTIJULYEASHJI-UHFFFAOYSA-N 1 1 344.346 2.516 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](Cc1cncc(Br)c1)CC2 ZINC000347789056 142272328 /nfs/dbraw/zinc/27/23/28/142272328.db2.gz SBHMTKWFKDMJMY-UHFFFAOYSA-N 1 1 349.188 2.706 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](Cc1cncc(Br)c1)CC2 ZINC000347789056 142272329 /nfs/dbraw/zinc/27/23/29/142272329.db2.gz SBHMTKWFKDMJMY-UHFFFAOYSA-N 1 1 349.188 2.706 10 5 EFBEMO C[C@@H](C(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000347843169 142281041 /nfs/dbraw/zinc/28/10/41/142281041.db2.gz JGOYOVXUMBHEGG-BXUZGUMPSA-N 1 1 335.379 2.533 10 5 EFBEMO C[C@@H](NC(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000349692528 142348378 /nfs/dbraw/zinc/34/83/78/142348378.db2.gz JTBXTZQHLNZAGD-WBMJQRKESA-N 1 1 332.404 2.534 10 5 EFBEMO C[C@H](c1cccc(Nc2ccncc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000352642486 142523235 /nfs/dbraw/zinc/52/32/35/142523235.db2.gz ZJHYDLXUIRSVMQ-CYBMUJFWSA-N 1 1 328.372 2.549 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342912313 145219925 /nfs/dbraw/zinc/21/99/25/145219925.db2.gz CCCMOIPNRQENTD-LBPRGKRZSA-N 1 1 330.388 2.680 10 5 EFBEMO O=C(CC[N@H+]1CCc2ccccc2C1)NCc1ccccc1[N+](=O)[O-] ZINC000348943254 146027975 /nfs/dbraw/zinc/02/79/75/146027975.db2.gz WMWYVOHDAHKJLJ-UHFFFAOYSA-N 1 1 339.395 2.659 10 5 EFBEMO COc1cc(C[N@H+](C)Cc2ccc3c(c2)OCO3)ccc1[N+](=O)[O-] ZINC000351971758 146252216 /nfs/dbraw/zinc/25/22/16/146252216.db2.gz VZZVNMOJVYWGMH-UHFFFAOYSA-N 1 1 330.340 2.964 10 5 EFBEMO COc1cc(C[N@@H+](C)Cc2ccc3c(c2)OCO3)ccc1[N+](=O)[O-] ZINC000351971758 146252217 /nfs/dbraw/zinc/25/22/17/146252217.db2.gz VZZVNMOJVYWGMH-UHFFFAOYSA-N 1 1 330.340 2.964 10 5 EFBEMO CCNc1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](CC)C[C@H]2C)cc1[N+](=O)[O-] ZINC000356286020 147200249 /nfs/dbraw/zinc/20/02/49/147200249.db2.gz QRAYJVYIWAQJDI-CZUORRHYSA-N 1 1 348.447 2.829 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000356340699 147217066 /nfs/dbraw/zinc/21/70/66/147217066.db2.gz PDFJKPYOFXNJEW-BBRMVZONSA-N 1 1 333.432 2.814 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC2(CCOCC2)[C@H]1C ZINC000363790554 149012873 /nfs/dbraw/zinc/01/28/73/149012873.db2.gz ALPCQGFSUABSCQ-CQSZACIVSA-N 1 1 347.415 2.733 10 5 EFBEMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(c2nnc3n2CCC3)CC1 ZINC000368680814 150180724 /nfs/dbraw/zinc/18/07/24/150180724.db2.gz QALIOVVCVOQWKA-UHFFFAOYSA-N 1 1 345.378 2.651 10 5 EFBEMO COc1ccc(C(=O)N2CCC(n3c[nH+]cc3C)CC2)cc1[N+](=O)[O-] ZINC000373476200 151176375 /nfs/dbraw/zinc/17/63/75/151176375.db2.gz PZMMDRARTZNIRP-UHFFFAOYSA-N 1 1 344.371 2.586 10 5 EFBEMO CC[C@@H]1C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000373495955 151179238 /nfs/dbraw/zinc/17/92/38/151179238.db2.gz OFAGMVFWQQXHDA-MPKNPAPTSA-N 1 1 332.400 2.878 10 5 EFBEMO CC[C@@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000373495955 151179241 /nfs/dbraw/zinc/17/92/41/151179241.db2.gz OFAGMVFWQQXHDA-MPKNPAPTSA-N 1 1 332.400 2.878 10 5 EFBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000373865582 151239839 /nfs/dbraw/zinc/23/98/39/151239839.db2.gz IQFASAVVISYQEW-HNNXBMFYSA-N 1 1 346.431 2.825 10 5 EFBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000373865583 151240137 /nfs/dbraw/zinc/24/01/37/151240137.db2.gz IQFASAVVISYQEW-OAHLLOKOSA-N 1 1 346.431 2.825 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000122956155 222189917 /nfs/dbraw/zinc/18/99/17/222189917.db2.gz FCBMMIURZPFFLZ-CYBMUJFWSA-N 1 1 336.392 2.551 10 5 EFBEMO CSc1ccc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000123115419 222218483 /nfs/dbraw/zinc/21/84/83/222218483.db2.gz GHLJXRPZVJUPOA-YPMHNXCESA-N 1 1 337.445 2.871 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000123152110 222225113 /nfs/dbraw/zinc/22/51/13/222225113.db2.gz BUXVFZHZXSBZBH-NWDGAFQWSA-N 1 1 336.392 2.550 10 5 EFBEMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H](CNc3ccccn3)C2)cc1 ZINC000171640509 227189314 /nfs/dbraw/zinc/18/93/14/227189314.db2.gz YYLYXTSDRGACPK-HNNXBMFYSA-N 1 1 342.399 2.803 10 5 EFBEMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](CNc3ccccn3)C2)cc1 ZINC000171641885 227193990 /nfs/dbraw/zinc/19/39/90/227193990.db2.gz KJLGQDLYGNEXPC-MRXNPFEDSA-N 1 1 326.400 2.966 10 5 EFBEMO C[C@@H]1C(=O)NCCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000189088696 265173033 /nfs/dbraw/zinc/17/30/33/265173033.db2.gz FCPBAUFMZHCZOU-GFCCVEGCSA-N 1 1 329.356 2.565 10 5 EFBEMO C[C@@H]1C(=O)NCCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000189088696 265173038 /nfs/dbraw/zinc/17/30/38/265173038.db2.gz FCPBAUFMZHCZOU-GFCCVEGCSA-N 1 1 329.356 2.565 10 5 EFBEMO CN(C)C(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172173739 273023098 /nfs/dbraw/zinc/02/30/98/273023098.db2.gz RBXGUTYBWUMJRO-UHFFFAOYSA-N 1 1 325.796 2.548 10 5 EFBEMO COC(=O)c1cc(N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc(C)c1[N+](=O)[O-] ZINC000268841190 274000381 /nfs/dbraw/zinc/00/03/81/274000381.db2.gz OPJMSHJGPLBHFJ-BBRMVZONSA-N 1 1 347.415 2.610 10 5 EFBEMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425463535 274083690 /nfs/dbraw/zinc/08/36/90/274083690.db2.gz XZFXPUFGKQEDGQ-TXEJJXNPSA-N 1 1 329.194 2.967 10 5 EFBEMO C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cn1)c1ccccc1[N+](=O)[O-] ZINC000342302881 274245219 /nfs/dbraw/zinc/24/52/19/274245219.db2.gz OMOFNPLMYGNEEU-SNVBAGLBSA-N 1 1 334.763 2.933 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1 ZINC000376742305 274828828 /nfs/dbraw/zinc/82/88/28/274828828.db2.gz NKDCRGXHVFZVLF-UHFFFAOYSA-N 1 1 332.389 2.650 10 5 EFBEMO O=[N+]([O-])c1ccc(N[C@@H]2CCc3[nH+]c[nH]c3C2)nc1-c1ccccc1 ZINC000357574094 275034936 /nfs/dbraw/zinc/03/49/36/275034936.db2.gz WSVPCDAINVEOIO-CYBMUJFWSA-N 1 1 335.367 2.771 10 5 EFBEMO O=[N+]([O-])c1ccc(N[C@@H]2CCc3[nH]c[nH+]c3C2)nc1-c1ccccc1 ZINC000357574094 275034937 /nfs/dbraw/zinc/03/49/37/275034937.db2.gz WSVPCDAINVEOIO-CYBMUJFWSA-N 1 1 335.367 2.771 10 5 EFBEMO O=[N+]([O-])c1ccc(N[C@H]2CCc3[nH+]c[nH]c3C2)nc1-c1ccccc1 ZINC000357574097 275035088 /nfs/dbraw/zinc/03/50/88/275035088.db2.gz WSVPCDAINVEOIO-ZDUSSCGKSA-N 1 1 335.367 2.771 10 5 EFBEMO O=[N+]([O-])c1ccc(N[C@H]2CCc3[nH]c[nH+]c3C2)nc1-c1ccccc1 ZINC000357574097 275035089 /nfs/dbraw/zinc/03/50/89/275035089.db2.gz WSVPCDAINVEOIO-ZDUSSCGKSA-N 1 1 335.367 2.771 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]1CN1CCOCC1 ZINC000174877879 275035671 /nfs/dbraw/zinc/03/56/71/275035671.db2.gz GEZJTFNDKYHRAF-OAHLLOKOSA-N 1 1 339.823 2.545 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H]1CN1CCOCC1 ZINC000174877879 275035673 /nfs/dbraw/zinc/03/56/73/275035673.db2.gz GEZJTFNDKYHRAF-OAHLLOKOSA-N 1 1 339.823 2.545 10 5 EFBEMO CC[NH+]1CCN(c2cc(N3CCCCC3)c([N+](=O)[O-])cc2F)CC1 ZINC000004168631 276202612 /nfs/dbraw/zinc/20/26/12/276202612.db2.gz IMDPAQFLFXEEJF-UHFFFAOYSA-N 1 1 336.411 2.866 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@H]1c1ccccc1 ZINC000247966428 277137112 /nfs/dbraw/zinc/13/71/12/277137112.db2.gz DRXKWPPWBDCTAN-IUODEOHRSA-N 1 1 331.397 2.832 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@H]1c1ccccc1 ZINC000247966428 277137113 /nfs/dbraw/zinc/13/71/13/277137113.db2.gz DRXKWPPWBDCTAN-IUODEOHRSA-N 1 1 331.397 2.832 10 5 EFBEMO Cc1cc(N2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n[nH]1 ZINC000187214335 280559505 /nfs/dbraw/zinc/55/95/05/280559505.db2.gz IMEODKRRPSNGDV-CQSZACIVSA-N 1 1 329.404 2.818 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000175008959 281192064 /nfs/dbraw/zinc/19/20/64/281192064.db2.gz UZQVYBIQEWRFMP-QWHCGFSZSA-N 1 1 337.807 2.947 10 5 EFBEMO C[N@H+]1CCO[C@H]2CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])C[C@H]21 ZINC000408027666 290114629 /nfs/dbraw/zinc/11/46/29/290114629.db2.gz ORLDTUJZRFRGCL-OLZOCXBDSA-N 1 1 346.214 2.811 10 5 EFBEMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000130316532 293161435 /nfs/dbraw/zinc/16/14/35/293161435.db2.gz YCISQWRTCRLQON-CHWSQXEVSA-N 1 1 344.415 2.926 10 5 EFBEMO CC(=O)N[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000153868141 293398620 /nfs/dbraw/zinc/39/86/20/293398620.db2.gz RTMZAABUYSBSOQ-CQSZACIVSA-N 1 1 343.383 2.955 10 5 EFBEMO CC[C@@H](NC(=O)[C@@H]1CCn2c(C)[nH+]cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000290489064 294100394 /nfs/dbraw/zinc/10/03/94/294100394.db2.gz VYBPZIDMDUBFQN-RHSMWYFYSA-N 1 1 342.399 2.930 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+](C2CC2)C[C@@H](C)C1 ZINC000295765435 295372896 /nfs/dbraw/zinc/37/28/96/295372896.db2.gz WHWKDFHVCVSMAZ-XDPMZMSMSA-N 1 1 343.427 2.941 10 5 EFBEMO Cc1cc(Cl)c(C(=O)N2[C@H](C)C[NH+](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000296642429 310833318 /nfs/dbraw/zinc/83/33/18/310833318.db2.gz WSLQMTZJRHMCEU-GHMZBOCLSA-N 1 1 325.796 2.721 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000298744581 311019700 /nfs/dbraw/zinc/01/97/00/311019700.db2.gz YTSTUODMSWGWJE-LBPRGKRZSA-N 1 1 332.404 2.766 10 5 EFBEMO COC(=O)/C=C/c1ccc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000301102216 311119019 /nfs/dbraw/zinc/11/90/19/311119019.db2.gz OOAJVPIWUWIGLL-DODUIYEKSA-N 1 1 345.399 2.820 10 5 EFBEMO CC[N@H+]1CCCN(c2cc(C)nc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000301265199 311127833 /nfs/dbraw/zinc/12/78/33/311127833.db2.gz WBMGFEBPXQOOPW-UHFFFAOYSA-N 1 1 341.415 2.892 10 5 EFBEMO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@@H+]1CCOC[C@@H]1C ZINC000301411168 311136193 /nfs/dbraw/zinc/13/61/93/311136193.db2.gz YEDGVGSXKCDTCK-MNOVXSKESA-N 1 1 345.346 2.717 10 5 EFBEMO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@H+]1CCOC[C@@H]1C ZINC000301411168 311136194 /nfs/dbraw/zinc/13/61/94/311136194.db2.gz YEDGVGSXKCDTCK-MNOVXSKESA-N 1 1 345.346 2.717 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1N1CCC[C@@H]1C[N@@H+]1CCC[C@H]1CO ZINC000301728107 311155256 /nfs/dbraw/zinc/15/52/56/311155256.db2.gz RATMFQXIHOHMCH-KGLIPLIRSA-N 1 1 339.823 2.674 10 5 EFBEMO O=[N+]([O-])c1ccc(CO)cc1N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000302065811 311175801 /nfs/dbraw/zinc/17/58/01/311175801.db2.gz UIJPVKFFHUPWCN-GDBMZVCRSA-N 1 1 331.416 2.540 10 5 EFBEMO C[N@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])cn2)[C@H]1c1cccs1 ZINC000302169598 311181921 /nfs/dbraw/zinc/18/19/21/311181921.db2.gz TYZSWDVBPSKOGP-FZMZJTMJSA-N 1 1 333.417 2.941 10 5 EFBEMO C[C@@H]1C[NH+](Cc2cccc(Nc3ncc([N+](=O)[O-])cn3)c2)C[C@@H](C)O1 ZINC000302174323 311182165 /nfs/dbraw/zinc/18/21/65/311182165.db2.gz WGGGSEXAOBEACH-CHWSQXEVSA-N 1 1 343.387 2.738 10 5 EFBEMO C[C@@H]1C[N@@H+](Cc2cccc(Nc3ncc([N+](=O)[O-])cn3)c2)C[C@H](C)O1 ZINC000302174322 311182370 /nfs/dbraw/zinc/18/23/70/311182370.db2.gz WGGGSEXAOBEACH-BETUJISGSA-N 1 1 343.387 2.738 10 5 EFBEMO C[C@@H]1C[N@H+](Cc2cccc(Nc3ncc([N+](=O)[O-])cn3)c2)C[C@H](C)O1 ZINC000302174322 311182372 /nfs/dbraw/zinc/18/23/72/311182372.db2.gz WGGGSEXAOBEACH-BETUJISGSA-N 1 1 343.387 2.738 10 5 EFBEMO C[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cn2)[C@@H]1c1ccc(Cl)cc1 ZINC000302245531 311187116 /nfs/dbraw/zinc/18/71/16/311187116.db2.gz ZZNCJZSZTCMFCA-KGLIPLIRSA-N 1 1 333.779 2.896 10 5 EFBEMO C[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cn2)[C@@H]1c1ccc(Cl)cc1 ZINC000302245531 311187118 /nfs/dbraw/zinc/18/71/18/311187118.db2.gz ZZNCJZSZTCMFCA-KGLIPLIRSA-N 1 1 333.779 2.896 10 5 EFBEMO C[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cn2)[C@H]1c1ccc(Cl)cc1 ZINC000302245533 311187180 /nfs/dbraw/zinc/18/71/80/311187180.db2.gz ZZNCJZSZTCMFCA-ZIAGYGMSSA-N 1 1 333.779 2.896 10 5 EFBEMO C[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cn2)[C@H]1c1ccc(Cl)cc1 ZINC000302245533 311187181 /nfs/dbraw/zinc/18/71/81/311187181.db2.gz ZZNCJZSZTCMFCA-ZIAGYGMSSA-N 1 1 333.779 2.896 10 5 EFBEMO CC(C)(C)c1ccc(NC(=O)NCC(F)(F)C[NH3+])cc1[N+](=O)[O-] ZINC000415701378 312166470 /nfs/dbraw/zinc/16/64/70/312166470.db2.gz ODUXYEMRHABCMD-UHFFFAOYSA-N 1 1 330.335 2.608 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@](O)(C(F)(F)F)C1 ZINC000470178692 313130259 /nfs/dbraw/zinc/13/02/59/313130259.db2.gz MIALOUVREKXTID-SMJHDNPOSA-N 1 1 330.306 2.997 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@](O)(C(F)(F)F)C1 ZINC000470178692 313130261 /nfs/dbraw/zinc/13/02/61/313130261.db2.gz MIALOUVREKXTID-SMJHDNPOSA-N 1 1 330.306 2.997 10 5 EFBEMO CCC(=O)N[C@H]1CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000470182008 313130509 /nfs/dbraw/zinc/13/05/09/313130509.db2.gz IONKRDRUZIMCHE-DNXIFWLFSA-N 1 1 331.416 2.989 10 5 EFBEMO COc1cccc([C@H](C)[NH+]2CCN(c3ccncc3[N+](=O)[O-])CC2)c1 ZINC000505613202 315461684 /nfs/dbraw/zinc/46/16/84/315461684.db2.gz QXTQRUTYYUBBQD-AWEZNQCLSA-N 1 1 342.399 2.882 10 5 EFBEMO CNc1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)cc1[N+](=O)[O-] ZINC000524776143 316174670 /nfs/dbraw/zinc/17/46/70/316174670.db2.gz XHQRSGJAIXYEKT-CABCVRRESA-N 1 1 346.431 2.724 10 5 EFBEMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cn2)C1 ZINC000532136974 317360300 /nfs/dbraw/zinc/36/03/00/317360300.db2.gz BWMGROANQYOIPP-ZFWWWQNUSA-N 1 1 340.383 2.555 10 5 EFBEMO C[N@@H+](CCC(=O)N1CCc2ncc([N+](=O)[O-])cc2C1)C1CCCCC1 ZINC000548720783 318136353 /nfs/dbraw/zinc/13/63/53/318136353.db2.gz CJEYCSYIRQNHDG-UHFFFAOYSA-N 1 1 346.431 2.529 10 5 EFBEMO Cc1ccc(OC[C@H](O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000554849368 318338109 /nfs/dbraw/zinc/33/81/09/318338109.db2.gz YIYPGMSSHRDWNL-GOSISDBHSA-N 1 1 344.411 2.817 10 5 EFBEMO C[C@H](C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000555312821 318352891 /nfs/dbraw/zinc/35/28/91/318352891.db2.gz KHIDHGWQUKQHDW-WWTUQBGBSA-N 1 1 331.416 2.830 10 5 EFBEMO CC(C)(NC(=O)Cn1c[nH+]c2c1CCCC2)c1ccccc1[N+](=O)[O-] ZINC000557975797 318455426 /nfs/dbraw/zinc/45/54/26/318455426.db2.gz ZTDDRVOPTWZDIS-UHFFFAOYSA-N 1 1 342.399 2.722 10 5 EFBEMO COCC1(CC[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000564965840 318915833 /nfs/dbraw/zinc/91/58/33/318915833.db2.gz KTUWLTYOOVGCRH-MRXNPFEDSA-N 1 1 344.415 2.824 10 5 EFBEMO Cc1cnc(CC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)c1 ZINC000566007106 319022736 /nfs/dbraw/zinc/02/27/36/319022736.db2.gz FZBGHHGVAAQUEU-OAHLLOKOSA-N 1 1 341.415 2.731 10 5 EFBEMO COC(=O)CC1([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000569347155 319372278 /nfs/dbraw/zinc/37/22/78/319372278.db2.gz ORSJHEDARDWAGL-UHFFFAOYSA-N 1 1 347.396 2.904 10 5 EFBEMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000577090518 320077068 /nfs/dbraw/zinc/07/70/68/320077068.db2.gz GJEIZXQTZZUTEC-ZDUSSCGKSA-N 1 1 335.404 2.550 10 5 EFBEMO COc1cccc([N+](=O)[O-])c1NCCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000577540609 320120141 /nfs/dbraw/zinc/12/01/41/320120141.db2.gz FMMTWNBZJPVTKU-OKILXGFUSA-N 1 1 337.420 2.905 10 5 EFBEMO C[C@H]1CN(c2nc3c(cc2[N+](=O)[O-])CCCC3)CC[N@H+](C2CC2)C1 ZINC000577949635 320158995 /nfs/dbraw/zinc/15/89/95/320158995.db2.gz YPAGIMXCKFNGNB-CYBMUJFWSA-N 1 1 330.432 2.789 10 5 EFBEMO COCC[N@H+]1CCC[C@@H]1CNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000112079951 473241222 /nfs/dbraw/zinc/24/12/22/473241222.db2.gz JGHUDEFDWLOGAN-CYBMUJFWSA-N 1 1 330.388 2.666 10 5 EFBEMO C[N@H+](Cc1cccnc1)C[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000190483592 473290864 /nfs/dbraw/zinc/29/08/64/473290864.db2.gz XXNPJIDVIBFOFB-SFHVURJKSA-N 1 1 340.427 2.944 10 5 EFBEMO CN(Cc1cccnc1)C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000190483592 473290873 /nfs/dbraw/zinc/29/08/73/473290873.db2.gz XXNPJIDVIBFOFB-SFHVURJKSA-N 1 1 340.427 2.944 10 5 EFBEMO Cc1cc(C(=O)N2CCC(Cc3[nH+]ccn3C)CC2)cc([N+](=O)[O-])c1 ZINC000162341046 473328539 /nfs/dbraw/zinc/32/85/39/473328539.db2.gz ZSKUBGXEOOIBGW-UHFFFAOYSA-N 1 1 342.399 2.732 10 5 EFBEMO CC(C)(C)OC(=O)[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083243446 473337990 /nfs/dbraw/zinc/33/79/90/473337990.db2.gz AGNLJRBKVDKWCC-NSHDSACASA-N 1 1 347.371 2.900 10 5 EFBEMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083243446 473337999 /nfs/dbraw/zinc/33/79/99/473337999.db2.gz AGNLJRBKVDKWCC-NSHDSACASA-N 1 1 347.371 2.900 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)CC[N@H+](C)C1CCN(C)CC1 ZINC000177375484 473367441 /nfs/dbraw/zinc/36/74/41/473367441.db2.gz NIBGCTWHRNLVDI-HNNXBMFYSA-N 1 1 334.464 2.614 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)CC[N@@H+](C)C1CCN(C)CC1 ZINC000177375484 473367446 /nfs/dbraw/zinc/36/74/46/473367446.db2.gz NIBGCTWHRNLVDI-HNNXBMFYSA-N 1 1 334.464 2.614 10 5 EFBEMO CCc1n[nH]c(C2CC[NH+](CCOc3ccccc3[N+](=O)[O-])CC2)n1 ZINC000190694980 473363986 /nfs/dbraw/zinc/36/39/86/473363986.db2.gz HYWCZXALKAKWFM-UHFFFAOYSA-N 1 1 345.403 2.534 10 5 EFBEMO CCc1nc(C2CC[NH+](CCOc3ccccc3[N+](=O)[O-])CC2)n[nH]1 ZINC000190694980 473363993 /nfs/dbraw/zinc/36/39/93/473363993.db2.gz HYWCZXALKAKWFM-UHFFFAOYSA-N 1 1 345.403 2.534 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)c1 ZINC000113233308 473372596 /nfs/dbraw/zinc/37/25/96/473372596.db2.gz RIYRGDKRQRKRFH-VXGBXAGGSA-N 1 1 335.429 2.625 10 5 EFBEMO Cn1cc[nH+]c1CC1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000162724235 473374202 /nfs/dbraw/zinc/37/42/02/473374202.db2.gz IEPJFCXINRRRBN-UHFFFAOYSA-N 1 1 343.387 2.815 10 5 EFBEMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000113367257 473389439 /nfs/dbraw/zinc/38/94/39/473389439.db2.gz LUEOEPHBISKJQC-CMPLNLGQSA-N 1 1 338.795 2.949 10 5 EFBEMO CC[C@@H]1[C@H](CO)CC[N@@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000395242458 476842374 /nfs/dbraw/zinc/84/23/74/476842374.db2.gz ZGQFWFYYXJLILZ-WCQYABFASA-N 1 1 343.221 2.950 10 5 EFBEMO CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000395242458 476842380 /nfs/dbraw/zinc/84/23/80/476842380.db2.gz ZGQFWFYYXJLILZ-WCQYABFASA-N 1 1 343.221 2.950 10 5 EFBEMO Cc1ccccc1C1([NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000592139414 478793391 /nfs/dbraw/zinc/79/33/91/478793391.db2.gz FMRSZIGMECNOQO-UHFFFAOYSA-N 1 1 325.368 2.781 10 5 EFBEMO CC1(C)CCC[C@H]1[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000592153590 478802377 /nfs/dbraw/zinc/80/23/77/478802377.db2.gz HCPIGNRPOBOKPI-ZBFHGGJFSA-N 1 1 333.432 2.905 10 5 EFBEMO C[C@@H](NC(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000595479642 478810900 /nfs/dbraw/zinc/81/09/00/478810900.db2.gz GGQZZLHYCJVADB-DOMZBBRYSA-N 1 1 334.420 2.828 10 5 EFBEMO CC[N@H+]1CCC[C@@H](Nc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000040713428 472039569 /nfs/dbraw/zinc/03/95/69/472039569.db2.gz LOZAQRUWZAEYGJ-SNVBAGLBSA-N 1 1 329.198 2.649 10 5 EFBEMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000075969161 472230577 /nfs/dbraw/zinc/23/05/77/472230577.db2.gz VZICVVGFBCYHTH-HZPDHXFCSA-N 1 1 333.432 2.843 10 5 EFBEMO COC(=O)[C@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089892686 472536803 /nfs/dbraw/zinc/53/68/03/472536803.db2.gz JLNNBSCXJRWXTB-ZDUSSCGKSA-N 1 1 345.355 2.635 10 5 EFBEMO COC(=O)[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089892686 472536808 /nfs/dbraw/zinc/53/68/08/472536808.db2.gz JLNNBSCXJRWXTB-ZDUSSCGKSA-N 1 1 345.355 2.635 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000155603817 472578688 /nfs/dbraw/zinc/57/86/88/472578688.db2.gz MAQXTOOWVNHUTI-CABCVRRESA-N 1 1 347.415 2.550 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000155603714 472579107 /nfs/dbraw/zinc/57/91/07/472579107.db2.gz MAQXTOOWVNHUTI-HUUCEWRRSA-N 1 1 347.415 2.550 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000130133075 472586441 /nfs/dbraw/zinc/58/64/41/472586441.db2.gz PHZFCKUKUKVICO-GFCCVEGCSA-N 1 1 330.388 2.680 10 5 EFBEMO C[N@H+](Cc1ccc(F)cc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000046704041 472587749 /nfs/dbraw/zinc/58/77/49/472587749.db2.gz JEKDSWPRWYNBCJ-MRXNPFEDSA-N 1 1 334.347 2.606 10 5 EFBEMO CC(C)[N@@H+]1C[C@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000155701723 472598018 /nfs/dbraw/zinc/59/80/18/472598018.db2.gz OSESNFCTVOMORX-HZMBPMFUSA-N 1 1 325.796 2.707 10 5 EFBEMO Cc1ccc(OC[C@@H](O)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000046835973 472608451 /nfs/dbraw/zinc/60/84/51/472608451.db2.gz MMGJNXFNQVZCNC-INIZCTEOSA-N 1 1 330.384 2.775 10 5 EFBEMO Cc1ccc(OC[C@@H](O)C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000046835973 472608455 /nfs/dbraw/zinc/60/84/55/472608455.db2.gz MMGJNXFNQVZCNC-INIZCTEOSA-N 1 1 330.384 2.775 10 5 EFBEMO CC(C)[N@@H+]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Cl)[C@@H](C)C1 ZINC000155755793 472609800 /nfs/dbraw/zinc/60/98/00/472609800.db2.gz XERWRORAQNDLTK-HZMBPMFUSA-N 1 1 325.796 2.707 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000047142658 472660053 /nfs/dbraw/zinc/66/00/53/472660053.db2.gz VHHLVHYVIZWAOX-LLVKDONJSA-N 1 1 325.796 2.852 10 5 EFBEMO COc1ccccc1CC[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000104711150 472685335 /nfs/dbraw/zinc/68/53/35/472685335.db2.gz LXSHJBIDPKMDJR-UHFFFAOYSA-N 1 1 343.383 2.716 10 5 EFBEMO COc1ccccc1CC[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000104711150 472685343 /nfs/dbraw/zinc/68/53/43/472685343.db2.gz LXSHJBIDPKMDJR-UHFFFAOYSA-N 1 1 343.383 2.716 10 5 EFBEMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000104976033 472708550 /nfs/dbraw/zinc/70/85/50/472708550.db2.gz NGIAEFKDDLCGPV-LBPRGKRZSA-N 1 1 338.795 2.950 10 5 EFBEMO CC[C@@H]1CN(C/C=C/c2ccccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000120920545 472768122 /nfs/dbraw/zinc/76/81/22/472768122.db2.gz XAUFESRYYZCGFX-DBWMJRBXSA-N 1 1 333.432 2.651 10 5 EFBEMO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CCCN(c2cccnn2)C1 ZINC000105804332 472779245 /nfs/dbraw/zinc/77/92/45/472779245.db2.gz DPJVUTLCLIMVBR-CYBMUJFWSA-N 1 1 345.378 2.625 10 5 EFBEMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CCCN(c2cccnn2)C1 ZINC000105804332 472779253 /nfs/dbraw/zinc/77/92/53/472779253.db2.gz DPJVUTLCLIMVBR-CYBMUJFWSA-N 1 1 345.378 2.625 10 5 EFBEMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN(c2cccnn2)C1 ZINC000105803857 472779585 /nfs/dbraw/zinc/77/95/85/472779585.db2.gz JRFXMFQVSUFZSE-QGZVFWFLSA-N 1 1 341.415 2.528 10 5 EFBEMO Cc1nc(C)n(C[C@@H]2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000105885403 472795355 /nfs/dbraw/zinc/79/53/55/472795355.db2.gz HXLDFCKUAZRFBB-QGZVFWFLSA-N 1 1 343.431 2.758 10 5 EFBEMO Cc1nc(C)n(C[C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000105884781 472795773 /nfs/dbraw/zinc/79/57/73/472795773.db2.gz MRSJOYFRVVFYBV-MRXNPFEDSA-N 1 1 329.404 2.715 10 5 EFBEMO Cc1nc(C)n(C[C@H]2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000105885405 472796350 /nfs/dbraw/zinc/79/63/50/472796350.db2.gz HXLDFCKUAZRFBB-KRWDZBQOSA-N 1 1 343.431 2.758 10 5 EFBEMO Cc1cnn([C@@H]2CCC[N@@H+](CCOc3ccccc3[N+](=O)[O-])C2)c1 ZINC000105901545 472806900 /nfs/dbraw/zinc/80/69/00/472806900.db2.gz PSRACASEIAJMII-OAHLLOKOSA-N 1 1 330.388 2.816 10 5 EFBEMO CCC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000106867587 472901320 /nfs/dbraw/zinc/90/13/20/472901320.db2.gz JWVXHVJMYBSGSJ-CQSZACIVSA-N 1 1 335.404 2.814 10 5 EFBEMO CCC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000106867587 472901324 /nfs/dbraw/zinc/90/13/24/472901324.db2.gz JWVXHVJMYBSGSJ-CQSZACIVSA-N 1 1 335.404 2.814 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+](C)C[C@@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000121841970 472927668 /nfs/dbraw/zinc/92/76/68/472927668.db2.gz HJHDVPSZBTXOPJ-AWEZNQCLSA-N 1 1 335.404 2.733 10 5 EFBEMO COCC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000092649500 472951629 /nfs/dbraw/zinc/95/16/29/472951629.db2.gz LTGBDIKQUQRUDA-ZDUSSCGKSA-N 1 1 330.388 2.666 10 5 EFBEMO CCOc1cc(N2CCCC[C@H]2C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000092652992 472952702 /nfs/dbraw/zinc/95/27/02/472952702.db2.gz IWDKJKBNVFDSPZ-INIZCTEOSA-N 1 1 349.431 2.685 10 5 EFBEMO CCc1nn(C)c(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1[N+](=O)[O-] ZINC000092830220 472995893 /nfs/dbraw/zinc/99/58/93/472995893.db2.gz PIIWUAWBOQQJFV-UHFFFAOYSA-N 1 1 344.419 2.675 10 5 EFBEMO COc1cc(C[N@H+](C)C[C@H]2CCCO2)c([N+](=O)[O-])cc1OC(F)F ZINC000052102827 473086901 /nfs/dbraw/zinc/08/69/01/473086901.db2.gz QVMFMXMVWGAOMV-LLVKDONJSA-N 1 1 346.330 2.816 10 5 EFBEMO COc1cc(C[N@@H+](C)C[C@H]2CCCO2)c([N+](=O)[O-])cc1OC(F)F ZINC000052102827 473086904 /nfs/dbraw/zinc/08/69/04/473086904.db2.gz QVMFMXMVWGAOMV-LLVKDONJSA-N 1 1 346.330 2.816 10 5 EFBEMO Cc1c(C[N@H+]2CCCC[C@H]2CN2CCOCC2)cccc1[N+](=O)[O-] ZINC000109818958 473128128 /nfs/dbraw/zinc/12/81/28/473128128.db2.gz PVDPSYVLESYVRD-KRWDZBQOSA-N 1 1 333.432 2.590 10 5 EFBEMO CC(C)C[C@@H](CO)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000185364212 473407321 /nfs/dbraw/zinc/40/73/21/473407321.db2.gz SODKQXFNTAWNNZ-LBPRGKRZSA-N 1 1 343.811 2.526 10 5 EFBEMO CC(C)C[C@@H](CO)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000185364212 473407325 /nfs/dbraw/zinc/40/73/25/473407325.db2.gz SODKQXFNTAWNNZ-LBPRGKRZSA-N 1 1 343.811 2.526 10 5 EFBEMO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1CCCN(c2cccnn2)C1 ZINC000171551912 473409184 /nfs/dbraw/zinc/40/91/84/473409184.db2.gz NQAVILFEFJSWPZ-OAHLLOKOSA-N 1 1 345.378 2.625 10 5 EFBEMO CCC[C@@H]([NH2+]C[C@@H](O)CN1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000151300428 473440080 /nfs/dbraw/zinc/44/00/80/473440080.db2.gz YPHNVVDQEQZIOB-QZTJIDSGSA-N 1 1 335.448 2.872 10 5 EFBEMO COC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000172123448 473528810 /nfs/dbraw/zinc/52/88/10/473528810.db2.gz SHGKUQYAEIJPMD-KRWDZBQOSA-N 1 1 344.367 2.939 10 5 EFBEMO CCC[N@@H+]1Cc2cccc(NC(=O)c3nn(CC)cc3[N+](=O)[O-])c2C1 ZINC000191594428 473558702 /nfs/dbraw/zinc/55/87/02/473558702.db2.gz PSIDYLRKJXLGDZ-UHFFFAOYSA-N 1 1 343.387 2.789 10 5 EFBEMO CCC[N@H+]1Cc2cccc(NC(=O)c3nn(CC)cc3[N+](=O)[O-])c2C1 ZINC000191594428 473558703 /nfs/dbraw/zinc/55/87/03/473558703.db2.gz PSIDYLRKJXLGDZ-UHFFFAOYSA-N 1 1 343.387 2.789 10 5 EFBEMO Cc1sc(C(=O)NCCCNc2ccc(C)c[nH+]2)cc1[N+](=O)[O-] ZINC000172364238 473591867 /nfs/dbraw/zinc/59/18/67/473591867.db2.gz RMYFIMWDLISULB-UHFFFAOYSA-N 1 1 334.401 2.900 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H](Cn2cncn2)C1 ZINC000116279581 473645917 /nfs/dbraw/zinc/64/59/17/473645917.db2.gz DRVRLHNHWIYEKX-LBPRGKRZSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](Cn2cncn2)C1 ZINC000116279581 473645920 /nfs/dbraw/zinc/64/59/20/473645920.db2.gz DRVRLHNHWIYEKX-LBPRGKRZSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H]2c2ccco2)c1 ZINC000116298350 473647669 /nfs/dbraw/zinc/64/76/69/473647669.db2.gz OACJUTGXBPTWQA-GDBMZVCRSA-N 1 1 332.356 2.765 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nc(CN3CC[N@H+]4CCC[C@@H]4C3)co2)cc1 ZINC000179191238 473650013 /nfs/dbraw/zinc/65/00/13/473650013.db2.gz GZSJAHGDDBPFSW-MRXNPFEDSA-N 1 1 328.372 2.530 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1OC[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000154013375 473659072 /nfs/dbraw/zinc/65/90/72/473659072.db2.gz JWPTUXIFZVSREZ-GOSISDBHSA-N 1 1 342.395 2.701 10 5 EFBEMO Cc1c(OC[C@@H](O)C[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000154022837 473660523 /nfs/dbraw/zinc/66/05/23/473660523.db2.gz ZOJGFGKTQFOFTO-KRWDZBQOSA-N 1 1 342.395 2.701 10 5 EFBEMO CC[N@H+]1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000173088813 473741869 /nfs/dbraw/zinc/74/18/69/473741869.db2.gz QORBHCMHOJMVHU-NSHDSACASA-N 1 1 345.321 2.828 10 5 EFBEMO CCCNC(=O)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180003243 473773310 /nfs/dbraw/zinc/77/33/10/473773310.db2.gz PTDQFDWQLMRWED-SFHVURJKSA-N 1 1 327.384 2.800 10 5 EFBEMO C[N@H+](Cc1ccc(F)cc1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000193331487 473782570 /nfs/dbraw/zinc/78/25/70/473782570.db2.gz CEPRSKKFGPBIQE-HNNXBMFYSA-N 1 1 334.347 2.606 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H]1c1ccccc1 ZINC000180097777 473796933 /nfs/dbraw/zinc/79/69/33/473796933.db2.gz GJFJDJRYQUCOMM-IRXDYDNUSA-N 1 1 343.358 2.909 10 5 EFBEMO CC(C)C(=O)NC[C@@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000263684045 473806257 /nfs/dbraw/zinc/80/62/57/473806257.db2.gz FYFZPNGUJPLLFT-LBPRGKRZSA-N 1 1 325.434 2.641 10 5 EFBEMO CC(C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000263684045 473806266 /nfs/dbraw/zinc/80/62/66/473806266.db2.gz FYFZPNGUJPLLFT-LBPRGKRZSA-N 1 1 325.434 2.641 10 5 EFBEMO Cc1c(CC(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cccc1[N+](=O)[O-] ZINC000269703975 473867910 /nfs/dbraw/zinc/86/79/10/473867910.db2.gz MRBUELXGGHEJAL-MQVJKMGUSA-N 1 1 331.416 2.577 10 5 EFBEMO COc1ccc(OCC[NH+]2CCC(c3ccn[nH]3)CC2)c([N+](=O)[O-])c1 ZINC000173606382 473888593 /nfs/dbraw/zinc/88/85/93/473888593.db2.gz QVTNHMJUGZYQHJ-UHFFFAOYSA-N 1 1 346.387 2.585 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2COc3ccccc3[C@H]2O)c1 ZINC000288459983 473949784 /nfs/dbraw/zinc/94/97/84/473949784.db2.gz DTSBGIVNJUDVRW-GOEBONIOSA-N 1 1 334.759 2.832 10 5 EFBEMO C[C@H]([NH2+]Cc1cccc(N2CCOCC2)n1)c1cccc([N+](=O)[O-])c1 ZINC000274788017 473959601 /nfs/dbraw/zinc/95/96/01/473959601.db2.gz MTHIINOFYXHKSD-AWEZNQCLSA-N 1 1 342.399 2.677 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000246905655 474000311 /nfs/dbraw/zinc/00/03/11/474000311.db2.gz HVQLIONIBKLLMG-YPMHNXCESA-N 1 1 337.807 2.947 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@]1(CO)CCOc2ccccc21 ZINC000282391929 474048796 /nfs/dbraw/zinc/04/87/96/474048796.db2.gz PBOWFFUSYSWQRL-GOSISDBHSA-N 1 1 328.368 2.663 10 5 EFBEMO Cn1cc(-c2cc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)on2)cn1 ZINC000282422306 474060101 /nfs/dbraw/zinc/06/01/01/474060101.db2.gz JNGSWRUDPXDISH-UHFFFAOYSA-N 1 1 341.371 2.658 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@H](C)C1 ZINC000174779412 474096239 /nfs/dbraw/zinc/09/62/39/474096239.db2.gz QNEKLPRETOXPBT-RHSMWYFYSA-N 1 1 348.447 2.504 10 5 EFBEMO CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC000288964464 474105444 /nfs/dbraw/zinc/10/54/44/474105444.db2.gz UBCXBHTWYIUNNW-CABCVRRESA-N 1 1 329.404 2.977 10 5 EFBEMO CC1CCC([N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@H]2CCCO2)CC1 ZINC000174876660 474111473 /nfs/dbraw/zinc/11/14/73/474111473.db2.gz PKAVUGKHCNZGFK-VMBOVVBDSA-N 1 1 336.436 2.851 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@H](N2CCN(C)CC2)C1 ZINC000174884561 474112971 /nfs/dbraw/zinc/11/29/71/474112971.db2.gz NVFAKEDLWBSHKP-LPHOPBHVSA-N 1 1 346.475 2.758 10 5 EFBEMO CCOc1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000247336147 474122667 /nfs/dbraw/zinc/12/26/67/474122667.db2.gz JAQVMDFJLWNPFI-GXTWGEPZSA-N 1 1 335.404 2.548 10 5 EFBEMO CCOc1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](CC)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000247380281 474133252 /nfs/dbraw/zinc/13/32/52/474133252.db2.gz LJSJGMJRNGKEHU-DZGCQCFKSA-N 1 1 349.431 2.796 10 5 EFBEMO Cc1cccc(N2CCN(C[C@H]3CCCC[N@@H+]3C)CC2)c1[N+](=O)[O-] ZINC000275374993 474162936 /nfs/dbraw/zinc/16/29/36/474162936.db2.gz ADXPJVOIGFADCP-MRXNPFEDSA-N 1 1 332.448 2.510 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@]3(O)CCCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000248043529 474249457 /nfs/dbraw/zinc/24/94/57/474249457.db2.gz UHCBMHLIRYZNFD-XJKSGUPXSA-N 1 1 335.360 2.630 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@]3(O)CCCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000248043529 474249463 /nfs/dbraw/zinc/24/94/63/474249463.db2.gz UHCBMHLIRYZNFD-XJKSGUPXSA-N 1 1 335.360 2.630 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1 ZINC000183076042 474320914 /nfs/dbraw/zinc/32/09/14/474320914.db2.gz SPHHVGXABSVVJT-BUUHPPLQSA-N 1 1 329.400 2.740 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000275842707 474336872 /nfs/dbraw/zinc/33/68/72/474336872.db2.gz HEJDSYBVCZHPFM-STQMWFEESA-N 1 1 337.807 2.913 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(c2ccc(O)cc2)CC1 ZINC000183226453 474354871 /nfs/dbraw/zinc/35/48/71/474354871.db2.gz VYRASSWUXSYNFA-UHFFFAOYSA-N 1 1 327.384 2.931 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(c2ccccc2O)CC1 ZINC000183227582 474355422 /nfs/dbraw/zinc/35/54/22/474355422.db2.gz UXLUROCNEIEBCT-UHFFFAOYSA-N 1 1 327.384 2.931 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CCC(N)=O)Cc1ccccc1 ZINC000183245219 474358579 /nfs/dbraw/zinc/35/85/79/474358579.db2.gz YNYVPNNRDSFHQV-UHFFFAOYSA-N 1 1 327.384 2.781 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCN(CC(F)(F)F)CC1 ZINC000183254705 474359407 /nfs/dbraw/zinc/35/94/07/474359407.db2.gz SHZSKPRXDXXOMN-UHFFFAOYSA-N 1 1 331.338 2.973 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCN(CC(F)(F)F)CC1 ZINC000183254705 474359413 /nfs/dbraw/zinc/35/94/13/474359413.db2.gz SHZSKPRXDXXOMN-UHFFFAOYSA-N 1 1 331.338 2.973 10 5 EFBEMO CO[C@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@H]1C ZINC000189332741 474363251 /nfs/dbraw/zinc/36/32/51/474363251.db2.gz SZRDHILWFDKRQY-RISCZKNCSA-N 1 1 332.360 2.502 10 5 EFBEMO CO[C@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@H]1C ZINC000189332741 474363260 /nfs/dbraw/zinc/36/32/60/474363260.db2.gz SZRDHILWFDKRQY-RISCZKNCSA-N 1 1 332.360 2.502 10 5 EFBEMO CO[C@@H]1C[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC[C@@H]1C ZINC000189346652 474367785 /nfs/dbraw/zinc/36/77/85/474367785.db2.gz AXVFJXJFVZZSGA-DETPVDSQSA-N 1 1 335.404 2.587 10 5 EFBEMO CO[C@@H]1C[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC[C@@H]1C ZINC000189346652 474367789 /nfs/dbraw/zinc/36/77/89/474367789.db2.gz AXVFJXJFVZZSGA-DETPVDSQSA-N 1 1 335.404 2.587 10 5 EFBEMO C[C@@H](C(=O)NCC[N@H+]1CCCC[C@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000248599915 474373249 /nfs/dbraw/zinc/37/32/49/474373249.db2.gz USIROKGOBDTJSC-CHWSQXEVSA-N 1 1 337.395 2.828 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000248614765 474377241 /nfs/dbraw/zinc/37/72/41/474377241.db2.gz IBWXLRUOFQEHLF-KGLIPLIRSA-N 1 1 337.395 2.801 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H]([NH+](C)CC(=O)[O-])CC1 ZINC000248696630 474407965 /nfs/dbraw/zinc/40/79/65/474407965.db2.gz COTMJLLKSFTCNK-UKRRQHHQSA-N 1 1 335.404 2.527 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H]([NH+](C)CC(=O)[O-])CC1 ZINC000248696630 474407975 /nfs/dbraw/zinc/40/79/75/474407975.db2.gz COTMJLLKSFTCNK-UKRRQHHQSA-N 1 1 335.404 2.527 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC[C@@H]([N@H+](C)CC(=O)[O-])CC1 ZINC000248696630 474407979 /nfs/dbraw/zinc/40/79/79/474407979.db2.gz COTMJLLKSFTCNK-UKRRQHHQSA-N 1 1 335.404 2.527 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC[C@@H]([N@@H+](C)CC(=O)[O-])CC1 ZINC000248696630 474407990 /nfs/dbraw/zinc/40/79/90/474407990.db2.gz COTMJLLKSFTCNK-UKRRQHHQSA-N 1 1 335.404 2.527 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C(F)(F)F)[C@@H](CO)C1 ZINC000289797698 474430497 /nfs/dbraw/zinc/43/04/97/474430497.db2.gz SGZOKNOJTPCSLP-OCCSQVGLSA-N 1 1 332.322 2.896 10 5 EFBEMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCN(c2ccccn2)CC1 ZINC000183866242 474439996 /nfs/dbraw/zinc/43/99/96/474439996.db2.gz GHLBNXXMIYJEEY-UHFFFAOYSA-N 1 1 330.363 2.841 10 5 EFBEMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCCN(c2ccccn2)CC1 ZINC000183866242 474440001 /nfs/dbraw/zinc/44/00/01/474440001.db2.gz GHLBNXXMIYJEEY-UHFFFAOYSA-N 1 1 330.363 2.841 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@H+](C)C[C@@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000266692342 474450150 /nfs/dbraw/zinc/45/01/50/474450150.db2.gz DVTPSNDLLJZZEX-KGLIPLIRSA-N 1 1 335.404 2.731 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)C[C@@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000266692342 474450157 /nfs/dbraw/zinc/45/01/57/474450157.db2.gz DVTPSNDLLJZZEX-KGLIPLIRSA-N 1 1 335.404 2.731 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184334089 474501671 /nfs/dbraw/zinc/50/16/71/474501671.db2.gz ILCGXBIGOGJFMM-GZBFAFLISA-N 1 1 349.406 2.923 10 5 EFBEMO COc1ccc(C)cc1C[NH+]1CCN(c2ccncc2[N+](=O)[O-])CC1 ZINC000608971872 480107928 /nfs/dbraw/zinc/10/79/28/480107928.db2.gz VPQRSLKFHBZWAC-UHFFFAOYSA-N 1 1 342.399 2.629 10 5 EFBEMO CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC[C@@H]1C(F)(F)F ZINC000190206922 474563172 /nfs/dbraw/zinc/56/31/72/474563172.db2.gz PWOKOHQGFMYNAY-LBPRGKRZSA-N 1 1 347.337 2.667 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@]1(CO)CC[C@@H](C)C1 ZINC000249593130 474597488 /nfs/dbraw/zinc/59/74/88/474597488.db2.gz VZGLXQHAYMBTLY-FZKQIMNGSA-N 1 1 349.431 2.715 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@]1(CO)CC[C@@H](C)C1 ZINC000249593128 474597696 /nfs/dbraw/zinc/59/76/96/474597696.db2.gz VZGLXQHAYMBTLY-ACJLOTCBSA-N 1 1 349.431 2.715 10 5 EFBEMO Cc1sc(C(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000249734068 474608866 /nfs/dbraw/zinc/60/88/66/474608866.db2.gz CVZMWEPEOKKGOU-GHMZBOCLSA-N 1 1 325.434 2.815 10 5 EFBEMO CO[C@H]1C[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC[C@H]1C ZINC000251940401 474652660 /nfs/dbraw/zinc/65/26/60/474652660.db2.gz UPZSDNMONMSYFL-WBMJQRKESA-N 1 1 335.404 2.589 10 5 EFBEMO CCN1CC[NH+](CCCNc2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000291711283 474655120 /nfs/dbraw/zinc/65/51/20/474655120.db2.gz VNFOMRJRCJUGFI-UHFFFAOYSA-N 1 1 343.431 2.583 10 5 EFBEMO CC(C)[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCOC1 ZINC000291743520 474665154 /nfs/dbraw/zinc/66/51/54/474665154.db2.gz KCNQTHIAOWTVLQ-LBPRGKRZSA-N 1 1 341.795 2.686 10 5 EFBEMO CC(C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCOC1 ZINC000291743520 474665162 /nfs/dbraw/zinc/66/51/62/474665162.db2.gz KCNQTHIAOWTVLQ-LBPRGKRZSA-N 1 1 341.795 2.686 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCC[N@@H+]2CCCC[C@H]2C)c1 ZINC000344389179 474711291 /nfs/dbraw/zinc/71/12/91/474711291.db2.gz JAQYISDQHPXRFH-OAHLLOKOSA-N 1 1 349.431 2.663 10 5 EFBEMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@H](CC(F)(F)F)C2)c1 ZINC000278659423 474761491 /nfs/dbraw/zinc/76/14/91/474761491.db2.gz HRQZSHWLDXIZJA-WCQYABFASA-N 1 1 348.321 2.609 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H](Cn2cncn2)C1 ZINC000255073481 474798763 /nfs/dbraw/zinc/79/87/63/474798763.db2.gz HOKCJENTJKRIPC-QZDDGCDVSA-N 1 1 327.388 2.612 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[N@H+](C2CCOCC2)C[C@H]1C ZINC000278731450 474800224 /nfs/dbraw/zinc/80/02/24/474800224.db2.gz SOMKGBRJIHNCPR-HUUCEWRRSA-N 1 1 333.432 2.841 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2ccnn2C)n1 ZINC000284880943 474811369 /nfs/dbraw/zinc/81/13/69/474811369.db2.gz NHWDVBGNCOGCJJ-XJKSGUPXSA-N 1 1 344.419 2.527 10 5 EFBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255520665 474867130 /nfs/dbraw/zinc/86/71/30/474867130.db2.gz HWVWRNZXUPVXRJ-UXHZXRBQSA-N 1 1 340.383 2.804 10 5 EFBEMO C[N@H+]1CCO[C@@H]2CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C[C@@H]21 ZINC000285170726 474914280 /nfs/dbraw/zinc/91/42/80/474914280.db2.gz UWXZGLUNFBBXDP-UONOGXRCSA-N 1 1 345.321 2.523 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2F)[C@@H](C)C1 ZINC000273474141 474918107 /nfs/dbraw/zinc/91/81/07/474918107.db2.gz PAZUTYSOGSPSIG-NHYWBVRUSA-N 1 1 338.383 2.928 10 5 EFBEMO CC[N@H+]1CC[C@H]2OCCN(Cc3ccc([N+](=O)[O-])cc3Cl)[C@H]2C1 ZINC000293376023 474952712 /nfs/dbraw/zinc/95/27/12/474952712.db2.gz VRLLOJMXLSNYJY-JKSUJKDBSA-N 1 1 339.823 2.543 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000341083689 474954376 /nfs/dbraw/zinc/95/43/76/474954376.db2.gz BSZUZNSVYJXNKV-GASCZTMLSA-N 1 1 348.447 2.699 10 5 EFBEMO CN(C)C(=O)C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000341509790 475101501 /nfs/dbraw/zinc/10/15/01/475101501.db2.gz WGHPZDDZVNCCJY-AWEZNQCLSA-N 1 1 333.413 2.966 10 5 EFBEMO C[C@@H]([NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(=O)NCCF ZINC000337556739 475123466 /nfs/dbraw/zinc/12/34/66/475123466.db2.gz RUGWIJFGCXVRTI-CXAGYDPISA-N 1 1 345.374 2.748 10 5 EFBEMO COc1ccc(CC(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000609346808 480151078 /nfs/dbraw/zinc/15/10/78/480151078.db2.gz PMHPPEVQBPDFTC-OKILXGFUSA-N 1 1 349.431 2.525 10 5 EFBEMO CC[N@H+]1CC[C@H]2OCCN(Cc3ccc(Cl)cc3[N+](=O)[O-])[C@H]2C1 ZINC000339395710 475193392 /nfs/dbraw/zinc/19/33/92/475193392.db2.gz PIISNMNTNUACRG-JKSUJKDBSA-N 1 1 339.823 2.543 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N[C@H]2CCc3nc[nH]c3C2)cc1[N+](=O)[O-] ZINC000357954875 475289766 /nfs/dbraw/zinc/28/97/66/475289766.db2.gz HYBUPJGHCLQDRA-AAEUAGOBSA-N 1 1 343.387 2.544 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(CN3CCC(c4[nH]cc[nH+]4)CC3)nc2c1 ZINC000361271431 475317389 /nfs/dbraw/zinc/31/73/89/475317389.db2.gz GNKNFJCPMYCPRU-UHFFFAOYSA-N 1 1 326.360 2.574 10 5 EFBEMO CNC(=O)c1cccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000352543484 475396973 /nfs/dbraw/zinc/39/69/73/475396973.db2.gz FRXWMJAIOWOBFS-UHFFFAOYSA-N 1 1 327.384 2.629 10 5 EFBEMO CC1=CC[N@@H+](CCNC(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000358190166 475474330 /nfs/dbraw/zinc/47/43/30/475474330.db2.gz NNYWFLIBJKBBMH-AWEZNQCLSA-N 1 1 332.404 2.607 10 5 EFBEMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000358226150 475507689 /nfs/dbraw/zinc/50/76/89/475507689.db2.gz CUXSHSKMEIXSHS-INIZCTEOSA-N 1 1 330.388 2.809 10 5 EFBEMO CCN(CC)C(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000352691278 475535563 /nfs/dbraw/zinc/53/55/63/475535563.db2.gz LHQFRSQQSCSEOV-UHFFFAOYSA-N 1 1 337.395 2.814 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCCCC[C@H]2CCO)cccc1[N+](=O)[O-] ZINC000342054115 475535921 /nfs/dbraw/zinc/53/59/21/475535921.db2.gz XROLLVYVAZZZNA-HNNXBMFYSA-N 1 1 349.431 2.859 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCCCC[C@@H]2CCO)cccc1[N+](=O)[O-] ZINC000342054116 475536297 /nfs/dbraw/zinc/53/62/97/475536297.db2.gz XROLLVYVAZZZNA-OAHLLOKOSA-N 1 1 349.431 2.859 10 5 EFBEMO CC[C@@H](NC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000297019327 475577982 /nfs/dbraw/zinc/57/79/82/475577982.db2.gz LHHBTVSWLFUFNV-UCMJJCQDSA-N 1 1 346.431 2.970 10 5 EFBEMO CNC(=O)C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccccc1 ZINC000361645522 475625031 /nfs/dbraw/zinc/62/50/31/475625031.db2.gz DPLIDFIDDFXHKT-INIZCTEOSA-N 1 1 343.383 2.570 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000297154315 475632351 /nfs/dbraw/zinc/63/23/51/475632351.db2.gz VPKFFCFVEOLBAY-BDHPRHBFSA-N 1 1 329.400 2.740 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@H]3COCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000355128562 475686083 /nfs/dbraw/zinc/68/60/83/475686083.db2.gz CNZDIPSFDVJJGZ-JSGCOSHPSA-N 1 1 336.388 2.613 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@@H]3COCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000355128565 475686273 /nfs/dbraw/zinc/68/62/73/475686273.db2.gz CNZDIPSFDVJJGZ-TZMCWYRMSA-N 1 1 336.388 2.613 10 5 EFBEMO Cc1c(CNC(=O)NCC[N@@H+]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000358549535 475763888 /nfs/dbraw/zinc/76/38/88/475763888.db2.gz YIWWFKSYOUOHIT-ZDUSSCGKSA-N 1 1 334.420 2.577 10 5 EFBEMO C[C@H](NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000297457546 475764423 /nfs/dbraw/zinc/76/44/23/475764423.db2.gz CCBXPMSVNNMFJX-XEZPLFJOSA-N 1 1 334.420 2.780 10 5 EFBEMO CCOc1ccc(C[NH+]2CCN(c3ccncc3[N+](=O)[O-])CC2)cc1 ZINC000340156588 475808977 /nfs/dbraw/zinc/80/89/77/475808977.db2.gz IWCMJFDELXVJAM-UHFFFAOYSA-N 1 1 342.399 2.711 10 5 EFBEMO CCCC[N@@H+](C)CC1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)CC1 ZINC000340258244 475895390 /nfs/dbraw/zinc/89/53/90/475895390.db2.gz LLFVZCAXVZEJIK-UHFFFAOYSA-N 1 1 346.435 2.586 10 5 EFBEMO C[N@@H+](CCNC(=O)NCCc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000338455528 475921691 /nfs/dbraw/zinc/92/16/91/475921691.db2.gz GDLMFEBICQEUSB-UHFFFAOYSA-N 1 1 348.447 2.701 10 5 EFBEMO CCn1nccc1C[N@H+](CCO)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000355521090 476004921 /nfs/dbraw/zinc/00/49/21/476004921.db2.gz YPNINVDYPULUHL-PTNGSMBKSA-N 1 1 344.415 2.709 10 5 EFBEMO CCn1nccc1C[N@@H+](CCO)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000355521090 476004929 /nfs/dbraw/zinc/00/49/29/476004929.db2.gz YPNINVDYPULUHL-PTNGSMBKSA-N 1 1 344.415 2.709 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1cc([O-])ccc1[N+](=O)[O-] ZINC000349873715 476012506 /nfs/dbraw/zinc/01/25/06/476012506.db2.gz KVANMXBIAXIOPR-ZDUSSCGKSA-N 1 1 335.404 2.685 10 5 EFBEMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000347017494 476037877 /nfs/dbraw/zinc/03/78/77/476037877.db2.gz OXNAELRBVNAQRE-IUODEOHRSA-N 1 1 349.456 2.771 10 5 EFBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@]2(CCCOC2)C1 ZINC000357098040 476229879 /nfs/dbraw/zinc/22/98/79/476229879.db2.gz JJQRIABAOMNSGZ-KSSFIOAISA-N 1 1 347.415 2.814 10 5 EFBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000357098040 476229886 /nfs/dbraw/zinc/22/98/86/476229886.db2.gz JJQRIABAOMNSGZ-KSSFIOAISA-N 1 1 347.415 2.814 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@]2(CCCOC2)C1 ZINC000357099790 476231262 /nfs/dbraw/zinc/23/12/62/476231262.db2.gz MRRUQHYKMYHRHQ-SFHVURJKSA-N 1 1 347.415 2.734 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000357099790 476231267 /nfs/dbraw/zinc/23/12/67/476231267.db2.gz MRRUQHYKMYHRHQ-SFHVURJKSA-N 1 1 347.415 2.734 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]3COCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000362447011 476257182 /nfs/dbraw/zinc/25/71/82/476257182.db2.gz JVEBWDFQAHYREY-YOEHRIQHSA-N 1 1 347.415 2.733 10 5 EFBEMO CO[C@H](C)C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)C ZINC000360003448 476281441 /nfs/dbraw/zinc/28/14/41/476281441.db2.gz IZBPMBRNDJDYQK-GFCCVEGCSA-N 1 1 334.376 2.890 10 5 EFBEMO CNC(=O)C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000360767375 476375019 /nfs/dbraw/zinc/37/50/19/476375019.db2.gz UOEVMYANFWGFKV-MRXNPFEDSA-N 1 1 331.347 2.701 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2csc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC000362775023 476401876 /nfs/dbraw/zinc/40/18/76/476401876.db2.gz AOSZEEFHSXTADT-HIFRSBDPSA-N 1 1 349.387 2.971 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2csc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC000362775023 476401883 /nfs/dbraw/zinc/40/18/83/476401883.db2.gz AOSZEEFHSXTADT-HIFRSBDPSA-N 1 1 349.387 2.971 10 5 EFBEMO Nc1ccc(C(=O)Nc2cccc3c2C[N@H+](C2CC2)C3)cc1[N+](=O)[O-] ZINC000374839368 476550498 /nfs/dbraw/zinc/55/04/98/476550498.db2.gz VUUZBKKMHHJFON-UHFFFAOYSA-N 1 1 338.367 2.907 10 5 EFBEMO CO[C@@H](C)C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)C ZINC000354370247 476617311 /nfs/dbraw/zinc/61/73/11/476617311.db2.gz ZQAFTWZAUNTKON-LBPRGKRZSA-N 1 1 334.376 2.890 10 5 EFBEMO COc1cccc(C2=CC[N@@H+](CCn3cc([N+](=O)[O-])cn3)CC2)c1 ZINC000370001131 476625072 /nfs/dbraw/zinc/62/50/72/476625072.db2.gz GUDUYWZCZHAAMW-UHFFFAOYSA-N 1 1 328.372 2.589 10 5 EFBEMO CCOc1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](CC)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000354438031 476661797 /nfs/dbraw/zinc/66/17/97/476661797.db2.gz UKLXGFXENBHLNR-DZGCQCFKSA-N 1 1 349.431 2.938 10 5 EFBEMO CCOc1ccc(C(=O)N(C)[C@H]2CC[N@@H+](CC)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000354438033 476662070 /nfs/dbraw/zinc/66/20/70/476662070.db2.gz UKLXGFXENBHLNR-HIFRSBDPSA-N 1 1 349.431 2.938 10 5 EFBEMO CO[C@@H](C)C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000354454996 476672199 /nfs/dbraw/zinc/67/21/99/476672199.db2.gz NVMQMQBJFMTWCW-AWEZNQCLSA-N 1 1 337.420 2.977 10 5 EFBEMO CCOc1cc(C[N@@H+]2CC[C@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000451883878 476698665 /nfs/dbraw/zinc/69/86/65/476698665.db2.gz FRMJFKZSZPJUMG-SMDDNHRTSA-N 1 1 348.321 2.739 10 5 EFBEMO CCOc1cc(C[N@H+]2CC[C@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000451883878 476698668 /nfs/dbraw/zinc/69/86/68/476698668.db2.gz FRMJFKZSZPJUMG-SMDDNHRTSA-N 1 1 348.321 2.739 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCC[C@]3(CCOC3)C2)cccc1[N+](=O)[O-] ZINC000451901848 476711695 /nfs/dbraw/zinc/71/16/95/476711695.db2.gz NKXDVAMAMVNLBH-SFHVURJKSA-N 1 1 347.415 2.734 10 5 EFBEMO Nc1nccc([C@H]2CCC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n1 ZINC000365989756 476800734 /nfs/dbraw/zinc/80/07/34/476800734.db2.gz ONXKNGDYYAQOAE-LBPRGKRZSA-N 1 1 347.806 2.830 10 5 EFBEMO Nc1nccc([C@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n1 ZINC000365989756 476800740 /nfs/dbraw/zinc/80/07/40/476800740.db2.gz ONXKNGDYYAQOAE-LBPRGKRZSA-N 1 1 347.806 2.830 10 5 EFBEMO COC[C@@H]1CCC[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000452089984 476816090 /nfs/dbraw/zinc/81/60/90/476816090.db2.gz RVSOUAAFCYLPEK-CQSZACIVSA-N 1 1 335.404 2.590 10 5 EFBEMO COC[C@@H]1CCC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000452089984 476816097 /nfs/dbraw/zinc/81/60/97/476816097.db2.gz RVSOUAAFCYLPEK-CQSZACIVSA-N 1 1 335.404 2.590 10 5 EFBEMO Cc1sc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000456986040 476818485 /nfs/dbraw/zinc/81/84/85/476818485.db2.gz IYEGZIWNCSRFBZ-CYBMUJFWSA-N 1 1 331.397 2.751 10 5 EFBEMO COC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000452096279 476821060 /nfs/dbraw/zinc/82/10/60/476821060.db2.gz YBKOCKIWUYBLFQ-KGLIPLIRSA-N 1 1 335.404 2.670 10 5 EFBEMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000446070546 476821202 /nfs/dbraw/zinc/82/12/02/476821202.db2.gz HKKUIKXMLXEOHZ-YUTCNCBUSA-N 1 1 335.404 2.730 10 5 EFBEMO COC[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000452105097 476827031 /nfs/dbraw/zinc/82/70/31/476827031.db2.gz OVPYYHDDVNRUEI-CQSZACIVSA-N 1 1 335.404 2.672 10 5 EFBEMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](c3nc(C4CC4)no3)C2)cc1 ZINC000375428754 476833124 /nfs/dbraw/zinc/83/31/24/476833124.db2.gz WJCQRZSPUGDPFM-AWEZNQCLSA-N 1 1 328.372 2.887 10 5 EFBEMO CCOc1ccc(C(=O)NCC[N@H+]2CCCC2(C)C)cc1[N+](=O)[O-] ZINC000457076631 476860472 /nfs/dbraw/zinc/86/04/72/476860472.db2.gz OCILWYCEJXGBDB-UHFFFAOYSA-N 1 1 335.404 2.598 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cn2)C1 ZINC000366127247 476873705 /nfs/dbraw/zinc/87/37/05/476873705.db2.gz PAZRNAQHVBFFJN-CABCVRRESA-N 1 1 346.431 2.716 10 5 EFBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@H]2CCc3[nH]cnc3C2)c1 ZINC000370730649 476956183 /nfs/dbraw/zinc/95/61/83/476956183.db2.gz PSHKWWCQQBGWBO-JTQLQIEISA-N 1 1 338.314 2.566 10 5 EFBEMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@H]([NH3+])c1ccccc1 ZINC000423237002 476971908 /nfs/dbraw/zinc/97/19/08/476971908.db2.gz HTRIOZXQOHPGCU-GUYCJALGSA-N 1 1 342.399 2.602 10 5 EFBEMO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CCN(c2cnccn2)CC1 ZINC000375920751 477084648 /nfs/dbraw/zinc/08/46/48/477084648.db2.gz OKLXYNKHHAEVNU-UHFFFAOYSA-N 1 1 345.378 2.625 10 5 EFBEMO C[N@@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC000366858075 477225328 /nfs/dbraw/zinc/22/53/28/477225328.db2.gz WACWNYONGBXRCE-IRXDYDNUSA-N 1 1 343.358 2.909 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC000366858075 477225333 /nfs/dbraw/zinc/22/53/33/477225333.db2.gz WACWNYONGBXRCE-IRXDYDNUSA-N 1 1 343.358 2.909 10 5 EFBEMO Nc1nccc([C@@H]2CCC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)n1 ZINC000366989603 477288574 /nfs/dbraw/zinc/28/85/74/477288574.db2.gz PXMYBEQXRACWQI-LLVKDONJSA-N 1 1 347.806 2.830 10 5 EFBEMO Nc1nccc([C@@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)n1 ZINC000366989603 477288582 /nfs/dbraw/zinc/28/85/82/477288582.db2.gz PXMYBEQXRACWQI-LLVKDONJSA-N 1 1 347.806 2.830 10 5 EFBEMO C[N@H+]1C[C@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000371528342 477373074 /nfs/dbraw/zinc/37/30/74/477373074.db2.gz LCHOWKGOEIPVOA-CVEARBPZSA-N 1 1 343.358 2.562 10 5 EFBEMO C[C@H](NC(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000458886789 477642768 /nfs/dbraw/zinc/64/27/68/477642768.db2.gz IRFLRLNSIJAGLS-LRDDRELGSA-N 1 1 332.404 2.534 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000413502286 477702780 /nfs/dbraw/zinc/70/27/80/477702780.db2.gz MYWWQYYVEAAKPZ-RNJTYBCJSA-N 1 1 345.443 2.887 10 5 EFBEMO C[C@H]([NH2+]Cc1cc(-c2cnn(C)c2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000451106137 477827062 /nfs/dbraw/zinc/82/70/62/477827062.db2.gz VGMVNIXSHYNQHD-NSHDSACASA-N 1 1 327.344 2.834 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@H](C(C)C)C1 ZINC000438478869 477846587 /nfs/dbraw/zinc/84/65/87/477846587.db2.gz AGGWFJKFJAFNNM-OLZOCXBDSA-N 1 1 335.404 2.908 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](O)CC12CCC2 ZINC000420991231 477883609 /nfs/dbraw/zinc/88/36/09/477883609.db2.gz IGFANDNJNOHVRN-HNNXBMFYSA-N 1 1 347.415 2.611 10 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O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@](O)(CO)C2)s1 ZINC000459727801 478061715 /nfs/dbraw/zinc/06/17/15/478061715.db2.gz REFQRTZWBKOMNX-QGZVFWFLSA-N 1 1 348.424 2.643 10 5 EFBEMO CNc1ccc(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000517396882 478091100 /nfs/dbraw/zinc/09/11/00/478091100.db2.gz PKCRVYMAIWUSFF-BETUJISGSA-N 1 1 334.420 2.629 10 5 EFBEMO COC(=O)c1cc(NC[C@H]2CC[N@H+](C3CC3)C2)cc(C)c1[N+](=O)[O-] ZINC000562305271 478230379 /nfs/dbraw/zinc/23/03/79/478230379.db2.gz KMQWGSOOONBTKQ-GFCCVEGCSA-N 1 1 333.388 2.586 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000600229869 478300751 /nfs/dbraw/zinc/30/07/51/478300751.db2.gz WIAHCBFZIZZZPE-HNNXBMFYSA-N 1 1 347.415 2.740 10 5 EFBEMO COCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)[C@H]1CCOC1 ZINC000490083778 478312211 /nfs/dbraw/zinc/31/22/11/478312211.db2.gz FQKQJGYEZNNCET-INIZCTEOSA-N 1 1 338.404 2.619 10 5 EFBEMO COCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)[C@H]1CCOC1 ZINC000490083778 478312214 /nfs/dbraw/zinc/31/22/14/478312214.db2.gz FQKQJGYEZNNCET-INIZCTEOSA-N 1 1 338.404 2.619 10 5 EFBEMO O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600471478 478382874 /nfs/dbraw/zinc/38/28/74/478382874.db2.gz KYXRECPHBKYPNQ-KRWDZBQOSA-N 1 1 331.416 2.661 10 5 EFBEMO O=c1[nH]c(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)nc2ccc([N+](=O)[O-])cc21 ZINC000594597586 478457698 /nfs/dbraw/zinc/45/76/98/478457698.db2.gz DATVULJVPDKVSQ-HUUCEWRRSA-N 1 1 343.387 2.672 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCC[C@@H]3C3(O)CC3)n2)c1 ZINC000581929493 478467789 /nfs/dbraw/zinc/46/77/89/478467789.db2.gz FTZULAOORBCKNS-CQSZACIVSA-N 1 1 344.371 2.524 10 5 EFBEMO CC[C@H](CSc1ccccc1[N+](=O)[O-])NCC1([NH3+])CCOCC1 ZINC000600707437 478478928 /nfs/dbraw/zinc/47/89/28/478478928.db2.gz HPGKTQKFQNEDRJ-CYBMUJFWSA-N 1 1 339.461 2.563 10 5 EFBEMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(N)CCOCC1 ZINC000600707437 478478938 /nfs/dbraw/zinc/47/89/38/478478938.db2.gz HPGKTQKFQNEDRJ-CYBMUJFWSA-N 1 1 339.461 2.563 10 5 EFBEMO [NH3+]CCCOCCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000600709997 478479302 /nfs/dbraw/zinc/47/93/02/478479302.db2.gz MFWRTDIKNOWJOQ-GOSISDBHSA-N 1 1 329.400 2.639 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2C[N@H+](C)Cc3ccccc32)c1 ZINC000541117673 478537777 /nfs/dbraw/zinc/53/77/77/478537777.db2.gz WNAYZZLSHWYPBG-MRXNPFEDSA-N 1 1 341.367 2.980 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2C[N@@H+](C)Cc3ccccc32)c1 ZINC000541117673 478537781 /nfs/dbraw/zinc/53/77/81/478537781.db2.gz WNAYZZLSHWYPBG-MRXNPFEDSA-N 1 1 341.367 2.980 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000597856859 478541897 /nfs/dbraw/zinc/54/18/97/478541897.db2.gz BNBBYVIZPRNYQG-CYBMUJFWSA-N 1 1 339.823 2.780 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000597858847 478544669 /nfs/dbraw/zinc/54/46/69/478544669.db2.gz POLUEHBKRZHTHW-GFCCVEGCSA-N 1 1 330.388 2.679 10 5 EFBEMO CC(C)Oc1cc(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC000597861291 478548739 /nfs/dbraw/zinc/54/87/39/478548739.db2.gz SHVURVWNFDESLU-CQSZACIVSA-N 1 1 349.431 2.985 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000597925542 478579243 /nfs/dbraw/zinc/57/92/43/478579243.db2.gz WVCLXAHLCBPMOR-NSHDSACASA-N 1 1 330.388 2.679 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000571382095 478581667 /nfs/dbraw/zinc/58/16/67/478581667.db2.gz HNZVQZKSFDYQOS-ZQIUZPCESA-N 1 1 333.432 2.887 10 5 EFBEMO C[C@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)S(C)(=O)=O ZINC000541847490 478595175 /nfs/dbraw/zinc/59/51/75/478595175.db2.gz LKZCVGJXSVFUER-DYVFJYSZSA-N 1 1 348.424 2.707 10 5 EFBEMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000600997675 478604731 /nfs/dbraw/zinc/60/47/31/478604731.db2.gz AVPKPUYDZVKGOR-DLBZAZTESA-N 1 1 343.427 2.760 10 5 EFBEMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000600997680 478605029 /nfs/dbraw/zinc/60/50/29/478605029.db2.gz AVPKPUYDZVKGOR-SJORKVTESA-N 1 1 343.427 2.760 10 5 EFBEMO CCOc1ccc(NCc2cc(OC)c(OC)cc2[N+](=O)[O-])[nH+]c1C ZINC000594999850 478623872 /nfs/dbraw/zinc/62/38/72/478623872.db2.gz FZEJYNNXSRMPFF-UHFFFAOYSA-N 1 1 347.371 2.748 10 5 EFBEMO CCN(C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)[C@H]1CC[N@@H+](CC)C1 ZINC000598039453 478626929 /nfs/dbraw/zinc/62/69/29/478626929.db2.gz KDILLHOATUVEST-OCCSQVGLSA-N 1 1 337.395 2.780 10 5 EFBEMO CCN(C(=O)CSc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598041269 478628319 /nfs/dbraw/zinc/62/83/19/478628319.db2.gz KTJVRNDXODSVNE-CQSZACIVSA-N 1 1 337.445 2.630 10 5 EFBEMO CCOc1ccc(C(=O)N(CC)[C@H]2CC[N@@H+](CC)C2)cc1[N+](=O)[O-] ZINC000598041795 478628646 /nfs/dbraw/zinc/62/86/46/478628646.db2.gz MZIAJMOKIZMVJG-AWEZNQCLSA-N 1 1 335.404 2.550 10 5 EFBEMO O=[N+]([O-])c1cc(F)cnc1NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000601105949 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479618624 /nfs/dbraw/zinc/61/86/24/479618624.db2.gz MNDKAMVCUYWNEO-UHFFFAOYSA-N 1 1 345.399 2.857 10 5 EFBEMO COc1ccc(-c2ccc(CN(C)CC3C[NH+](C)C3)o2)c([N+](=O)[O-])c1 ZINC000597203077 479618632 /nfs/dbraw/zinc/61/86/32/479618632.db2.gz MNDKAMVCUYWNEO-UHFFFAOYSA-N 1 1 345.399 2.857 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC(CO)(CO)C3)s2)cc1 ZINC000597218310 479626258 /nfs/dbraw/zinc/62/62/58/479626258.db2.gz HQUNPNVWLXULGB-UHFFFAOYSA-N 1 1 348.424 2.500 10 5 EFBEMO CC(C)c1ccc(C[N@@H+]2CC[C@H](N(C)C(=O)N(C)C)C2)cc1[N+](=O)[O-] ZINC000597224836 479630978 /nfs/dbraw/zinc/63/09/78/479630978.db2.gz QRIJKIXPBPTKDB-HNNXBMFYSA-N 1 1 348.447 2.906 10 5 EFBEMO CC(C)c1ccc(C[N@H+]2CC[C@H](N(C)C(=O)N(C)C)C2)cc1[N+](=O)[O-] ZINC000597224836 479630982 /nfs/dbraw/zinc/63/09/82/479630982.db2.gz QRIJKIXPBPTKDB-HNNXBMFYSA-N 1 1 348.447 2.906 10 5 EFBEMO CC(C)NC(=O)[C@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000597231098 479633488 /nfs/dbraw/zinc/63/34/88/479633488.db2.gz IJIIFDHXXJQTJU-SBSDFTTDSA-N 1 1 331.416 2.845 10 5 EFBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCCc3n[nH]cc3C2)c1 ZINC000597257656 479648033 /nfs/dbraw/zinc/64/80/33/479648033.db2.gz HIPPCXJWQCAOSR-UHFFFAOYSA-N 1 1 338.314 2.868 10 5 EFBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCCc3n[nH]cc3C2)c1 ZINC000597257656 479648039 /nfs/dbraw/zinc/64/80/39/479648039.db2.gz HIPPCXJWQCAOSR-UHFFFAOYSA-N 1 1 338.314 2.868 10 5 EFBEMO C[C@H]([NH2+][C@@H](c1cnn(C)c1)C1(CO)CCC1)c1ccccc1[N+](=O)[O-] ZINC000590599287 479666516 /nfs/dbraw/zinc/66/65/16/479666516.db2.gz GCIKBYNDGZDQBW-GUYCJALGSA-N 1 1 344.415 2.883 10 5 EFBEMO C[C@@H]([NH2+][C@H](c1cnn(C)c1)C1(CO)CCC1)c1ccccc1[N+](=O)[O-] ZINC000590599285 479666795 /nfs/dbraw/zinc/66/67/95/479666795.db2.gz GCIKBYNDGZDQBW-CXAGYDPISA-N 1 1 344.415 2.883 10 5 EFBEMO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]C2CC(N3CCCCC3)C2)n1 ZINC000619466099 479802609 /nfs/dbraw/zinc/80/26/09/479802609.db2.gz MBMZHZFWBZQCQB-GQGLESIBSA-N 1 1 347.463 2.882 10 5 EFBEMO C[N@@H+]1CCC[C@@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000609598850 480185053 /nfs/dbraw/zinc/18/50/53/480185053.db2.gz ZILCKOREZPBFTE-CYBMUJFWSA-N 1 1 332.429 2.902 10 5 EFBEMO C[N@H+]1CCC[C@@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000609598850 480185060 /nfs/dbraw/zinc/18/50/60/480185060.db2.gz ZILCKOREZPBFTE-CYBMUJFWSA-N 1 1 332.429 2.902 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@H](Cc4ccncc4)C3)nc2c1 ZINC000618305245 480614340 /nfs/dbraw/zinc/61/43/40/480614340.db2.gz NEBPFRNDNIOXLZ-CQSZACIVSA-N 1 1 337.383 2.931 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](Cc4ccncc4)C3)nc2c1 ZINC000618305245 480614347 /nfs/dbraw/zinc/61/43/47/480614347.db2.gz NEBPFRNDNIOXLZ-CQSZACIVSA-N 1 1 337.383 2.931 10 5 EFBEMO C[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CCS1 ZINC000131309465 533958158 /nfs/dbraw/zinc/95/81/58/533958158.db2.gz BKGXWUCCYOITJY-LBPRGKRZSA-N 1 1 332.429 2.933 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000177044448 521630839 /nfs/dbraw/zinc/63/08/39/521630839.db2.gz FHWDKQUFPATRLH-CYBMUJFWSA-N 1 1 325.796 2.805 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000177418811 521651821 /nfs/dbraw/zinc/65/18/21/521651821.db2.gz MSLJKSSWPHWULD-BBRMVZONSA-N 1 1 334.420 2.782 10 5 EFBEMO CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000177330292 522600112 /nfs/dbraw/zinc/60/01/12/522600112.db2.gz YCQSDQCSVAEDEM-ZDUSSCGKSA-N 1 1 346.362 2.970 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000245571205 523317339 /nfs/dbraw/zinc/31/73/39/523317339.db2.gz ZBKQNUCXZUNTRP-GJZGRUSLSA-N 1 1 349.431 2.541 10 5 EFBEMO CCn1cnnc1[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000195520279 523607913 /nfs/dbraw/zinc/60/79/13/523607913.db2.gz BYYKCQNXSZHNIY-ZDUSSCGKSA-N 1 1 345.403 2.594 10 5 EFBEMO CCc1ccc(C(=O)N2C[C@H]3CCC[N@@H+]3C[C@H]2CC)cc1[N+](=O)[O-] ZINC000245407816 523888858 /nfs/dbraw/zinc/88/88/58/523888858.db2.gz CZNLMPIOFVVRMS-HZPDHXFCSA-N 1 1 331.416 2.856 10 5 EFBEMO Cc1cccc(N2CCC(NC(=O)c3ccccc3[N+](=O)[O-])CC2)[nH+]1 ZINC000116668862 524540947 /nfs/dbraw/zinc/54/09/47/524540947.db2.gz PRRKLOSLRFJMEQ-UHFFFAOYSA-N 1 1 340.383 2.697 10 5 EFBEMO Cc1ccc(N2CCC(NC(=O)c3ccccc3[N+](=O)[O-])CC2)[nH+]c1 ZINC000157707108 524941922 /nfs/dbraw/zinc/94/19/22/524941922.db2.gz ZNCUUDCGCRLTPQ-UHFFFAOYSA-N 1 1 340.383 2.697 10 5 EFBEMO O=C1[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CCN1Cc1ccc(F)cc1 ZINC000191758492 534843207 /nfs/dbraw/zinc/84/32/07/534843207.db2.gz BJEMGONZBJGHIZ-CQSZACIVSA-N 1 1 349.387 2.686 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](CNc2ccccn2)C1 ZINC000195515603 525458431 /nfs/dbraw/zinc/45/84/31/525458431.db2.gz WWGIJSUNFXBINU-AWEZNQCLSA-N 1 1 342.399 2.932 10 5 EFBEMO Cc1c(Br)c(NC[C@@H]2CCC[N@H+]2C)ncc1[N+](=O)[O-] ZINC000230580840 525523669 /nfs/dbraw/zinc/52/36/69/525523669.db2.gz BFPUZFJTDQPPNW-VIFPVBQESA-N 1 1 329.198 2.567 10 5 EFBEMO Cc1c(Br)c(NC[C@@H]2CCC[N@@H+]2C)ncc1[N+](=O)[O-] ZINC000230580840 525523670 /nfs/dbraw/zinc/52/36/70/525523670.db2.gz BFPUZFJTDQPPNW-VIFPVBQESA-N 1 1 329.198 2.567 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1CN1CCC([N@H+]2CCO[C@H](C)C2)CC1 ZINC000183290940 525564468 /nfs/dbraw/zinc/56/44/68/525564468.db2.gz WHZPLKOEFIVSSR-OAHLLOKOSA-N 1 1 333.432 2.588 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1CN1CCC([N@@H+]2CCO[C@H](C)C2)CC1 ZINC000183290940 525564479 /nfs/dbraw/zinc/56/44/79/525564479.db2.gz WHZPLKOEFIVSSR-OAHLLOKOSA-N 1 1 333.432 2.588 10 5 EFBEMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H](Oc3cccnc3)C2)cc1 ZINC000152364157 527372525 /nfs/dbraw/zinc/37/25/25/527372525.db2.gz LLFHFLIWIPYOGY-QGZVFWFLSA-N 1 1 329.356 2.522 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](Oc4cccnc4)C3)nc2c1 ZINC000152225933 527381540 /nfs/dbraw/zinc/38/15/40/527381540.db2.gz PDYLIOZRDBDDRO-CQSZACIVSA-N 1 1 340.339 2.784 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](Oc4cccnc4)C3)nc2c1 ZINC000152225933 527381545 /nfs/dbraw/zinc/38/15/45/527381545.db2.gz PDYLIOZRDBDDRO-CQSZACIVSA-N 1 1 340.339 2.784 10 5 EFBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000177190733 527441998 /nfs/dbraw/zinc/44/19/98/527441998.db2.gz JMAHZMXJEABSDE-ZDUSSCGKSA-N 1 1 332.335 2.544 10 5 EFBEMO CC[N@H+]1CCC[C@@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000175436014 529054064 /nfs/dbraw/zinc/05/40/64/529054064.db2.gz TZXSAASOFYBCCH-CQSZACIVSA-N 1 1 334.420 2.613 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000174533101 529096833 /nfs/dbraw/zinc/09/68/33/529096833.db2.gz NSNNOPZJDWWYQG-LBPRGKRZSA-N 1 1 325.796 2.805 10 5 EFBEMO CC(C)Oc1cc(C(=O)N2[C@H](C)C[NH+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000412216490 534946910 /nfs/dbraw/zinc/94/69/10/534946910.db2.gz ODSKDFXRVMLEAX-CHWSQXEVSA-N 1 1 335.404 2.547 10 5 EFBEMO CCC[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2C)CC[N@H+]1CCOC ZINC000349958272 535436646 /nfs/dbraw/zinc/43/66/46/535436646.db2.gz AUUZQDRLPCQMPY-GOSISDBHSA-N 1 1 335.448 2.836 10 5 EFBEMO COc1cc(C[N@H+](C)C[C@@H]2COc3ccccc3O2)ccc1[N+](=O)[O-] ZINC000351977186 536748497 /nfs/dbraw/zinc/74/84/97/536748497.db2.gz FWHNHMXBKCZJGW-CQSZACIVSA-N 1 1 344.367 2.875 10 5 EFBEMO COc1cc(C[N@@H+](C)C[C@@H]2COc3ccccc3O2)ccc1[N+](=O)[O-] ZINC000351977186 536748505 /nfs/dbraw/zinc/74/85/05/536748505.db2.gz FWHNHMXBKCZJGW-CQSZACIVSA-N 1 1 344.367 2.875 10 5 EFBEMO COc1ccccc1NC(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000342288644 537083268 /nfs/dbraw/zinc/08/32/68/537083268.db2.gz ZGPVPGKUYDCOEO-LBPRGKRZSA-N 1 1 329.356 2.893 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000754255470 575411334 /nfs/dbraw/zinc/41/13/34/575411334.db2.gz CBLRPHNZUKWQSA-QAAVPBIRSA-N 1 1 329.400 2.693 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCCNc1cccc(C)[nH+]1 ZINC000755418702 575584929 /nfs/dbraw/zinc/58/49/29/575584929.db2.gz ZJKTWZWHTLUILP-OUKQBFOZSA-N 1 1 340.383 2.930 10 5 EFBEMO NC(=O)Cc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000756900719 575798803 /nfs/dbraw/zinc/79/88/03/575798803.db2.gz YOUOGBCNXBBJIO-UHFFFAOYSA-N 1 1 333.775 2.566 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761291821 576141077 /nfs/dbraw/zinc/14/10/77/576141077.db2.gz KBUAOJGIWCPLOO-LSDHHAIUSA-N 1 1 344.415 2.959 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761291815 576141142 /nfs/dbraw/zinc/14/11/42/576141142.db2.gz KBUAOJGIWCPLOO-GJZGRUSLSA-N 1 1 344.415 2.959 10 5 EFBEMO CC(=O)c1c(NCCC[NH+]2C[C@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000763206421 576366983 /nfs/dbraw/zinc/36/69/83/576366983.db2.gz IASLLUUMPWYCKO-STQMWFEESA-N 1 1 335.404 2.709 10 5 EFBEMO Cc1nn(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)c2ncc([N+](=O)[O-])cc12 ZINC000766094341 577106803 /nfs/dbraw/zinc/10/68/03/577106803.db2.gz WTQZCBAQGHWZKX-SNVBAGLBSA-N 1 1 343.309 2.880 10 5 EFBEMO Cc1nn(C[N@H+]2CC[C@H](CC(F)(F)F)C2)c2ncc([N+](=O)[O-])cc12 ZINC000766094341 577106804 /nfs/dbraw/zinc/10/68/04/577106804.db2.gz WTQZCBAQGHWZKX-SNVBAGLBSA-N 1 1 343.309 2.880 10 5 EFBEMO Cc1[nH+]ccn1-c1ccc(CNc2nc3cc([N+](=O)[O-])ccc3[nH]2)cn1 ZINC000774654456 581496640 /nfs/dbraw/zinc/49/66/40/581496640.db2.gz QLEGWXSWOWPABS-UHFFFAOYSA-N 1 1 349.354 2.972 10 5 EFBEMO Cc1ccc(F)cc1C(=O)NCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001690966825 1247900707 /nfs/dbraw/zinc/90/07/07/1247900707.db2.gz VXCIUDNPJPMKKZ-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO C[C@](CO)([NH2+]Cc1nccc2c1CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000922308653 1265441149 /nfs/dbraw/zinc/44/11/49/1265441149.db2.gz ZAGUCMPHHZMLDB-LJQANCHMSA-N 1 1 341.411 2.866 10 5 EFBEMO COC(OC)[C@@H](C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000922312026 1265459100 /nfs/dbraw/zinc/45/91/00/1265459100.db2.gz PWNGCUJGGKVYSN-SNVBAGLBSA-N 1 1 337.401 2.815 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1cccnc1)Cc1cccc([N+](=O)[O-])c1 ZINC001691173770 1248507448 /nfs/dbraw/zinc/50/74/48/1248507448.db2.gz KSLYLKQKHYCBTL-UHFFFAOYSA-N 1 1 342.399 2.632 10 5 EFBEMO O=C(CC(F)(F)F)NCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001691203697 1248536736 /nfs/dbraw/zinc/53/67/36/1248536736.db2.gz ZYLVNDRBYJEEKI-UHFFFAOYSA-N 1 1 345.321 2.628 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[NH2+][C@H]1C[C@@H](O)c3ccccc31)OCCO2 ZINC000850371564 1250452231 /nfs/dbraw/zinc/45/22/31/1250452231.db2.gz KUHCRTBVKGPSDA-GOEBONIOSA-N 1 1 342.351 2.634 10 5 EFBEMO COc1cc(C[NH2+][C@H]2C[C@@H](O)c3ccccc32)c([N+](=O)[O-])cc1O ZINC000850371456 1250452491 /nfs/dbraw/zinc/45/24/91/1250452491.db2.gz JVNZALLKDDDPES-DZGCQCFKSA-N 1 1 330.340 2.577 10 5 EFBEMO COc1cc(C[NH2+][C@@H]2C[C@H](O)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000850372493 1250453404 /nfs/dbraw/zinc/45/34/04/1250453404.db2.gz VJDRHBZMOBCKES-ZBFHGGJFSA-N 1 1 344.367 2.880 10 5 EFBEMO COc1cc(C[NH2+][C@H]2C[C@H](O)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000850372492 1250453614 /nfs/dbraw/zinc/45/36/14/1250453614.db2.gz VJDRHBZMOBCKES-HOCLYGCPSA-N 1 1 344.367 2.880 10 5 EFBEMO Cc1c[nH]cc1C(=O)N(C)CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001484768152 1252970780 /nfs/dbraw/zinc/97/07/80/1252970780.db2.gz HBZYGVIMNITYRI-UHFFFAOYSA-N 1 1 344.415 2.825 10 5 EFBEMO C[C@@H]1CN(Cc2cc([N+](=O)[O-])ccc2Br)C[C@H]1CC[NH3+] ZINC000923429177 1261636561 /nfs/dbraw/zinc/63/65/61/1261636561.db2.gz QXKJBLGVXXJMEQ-GHMZBOCLSA-N 1 1 342.237 2.774 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)c1 ZINC000824655703 1278221953 /nfs/dbraw/zinc/22/19/53/1278221953.db2.gz ZASKKDIEARTERB-XFJVYGCCSA-N 1 1 340.807 2.610 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H]([C@@H](O)C(F)(F)F)C2)ccc1Cl ZINC000825124446 1278420882 /nfs/dbraw/zinc/42/08/82/1278420882.db2.gz QAEYMWYIOSPQPF-BXKDBHETSA-N 1 1 338.713 2.993 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H]([C@@H](O)C(F)(F)F)C2)ccc1Cl ZINC000825124446 1278420888 /nfs/dbraw/zinc/42/08/88/1278420888.db2.gz QAEYMWYIOSPQPF-BXKDBHETSA-N 1 1 338.713 2.993 10 5 EFBEMO CCC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](CC)C(=O)OCC ZINC001169234142 1272748580 /nfs/dbraw/zinc/74/85/80/1272748580.db2.gz QGNFSDOJTVNYLS-JKSUJKDBSA-N 1 1 338.404 2.682 10 5 EFBEMO CCC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](CC)C(=O)OCC ZINC001169234142 1272748588 /nfs/dbraw/zinc/74/85/88/1272748588.db2.gz QGNFSDOJTVNYLS-JKSUJKDBSA-N 1 1 338.404 2.682 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(Cn3cnnc3)CC2)c1 ZINC000844413375 1278962650 /nfs/dbraw/zinc/96/26/50/1278962650.db2.gz RIXIGEQISAMHAR-UHFFFAOYSA-N 1 1 335.795 2.752 10 5 EFBEMO CN(C(=O)C[N@@H+]1CCC[C@]2(CC2(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000844441424 1279010758 /nfs/dbraw/zinc/01/07/58/1279010758.db2.gz YVMNVESKCPUCQD-HNNXBMFYSA-N 1 1 339.342 2.679 10 5 EFBEMO CN(C(=O)C[N@H+]1CCC[C@]2(CC2(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000844441424 1279010765 /nfs/dbraw/zinc/01/07/65/1279010765.db2.gz YVMNVESKCPUCQD-HNNXBMFYSA-N 1 1 339.342 2.679 10 5 EFBEMO CN(C)Cc1cc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000819073250 1276621070 /nfs/dbraw/zinc/62/10/70/1276621070.db2.gz LNBZEJLOSJVRGN-GOSISDBHSA-N 1 1 347.390 2.619 10 5 EFBEMO CC(C)[N@H+]1CC[C@H](CNC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001136430833 1277511635 /nfs/dbraw/zinc/51/16/35/1277511635.db2.gz IFTCHKHRMFMSPS-CYBMUJFWSA-N 1 1 339.823 2.637 10 5 EFBEMO CC(C)(CO)[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1cccnc1 ZINC000821336506 1277522085 /nfs/dbraw/zinc/52/20/85/1277522085.db2.gz CCZFZXRDYTUONB-INIZCTEOSA-N 1 1 333.363 2.978 10 5 EFBEMO C/C(=C/C(=O)NCc1c[nH+]c2n1CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000791391198 1278079975 /nfs/dbraw/zinc/07/99/75/1278079975.db2.gz VKTQUFHLOIDQPH-RAXLEYEMSA-N 1 1 340.383 2.847 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@H]1C ZINC000844642813 1279162286 /nfs/dbraw/zinc/16/22/86/1279162286.db2.gz LPHVCSSPWHODJO-XUNCZOGOSA-N 1 1 331.416 2.938 10 5 EFBEMO C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H]1CO)c1c(F)cccc1[N+](=O)[O-] ZINC000872035003 1287406782 /nfs/dbraw/zinc/40/67/82/1287406782.db2.gz JMZGIJCDINKCJI-KBPBESRZSA-N 1 1 339.411 2.621 10 5 EFBEMO C[C@H](NCCCC[N@@H+]1CCC[C@H]1CO)c1c(F)cccc1[N+](=O)[O-] ZINC000872035003 1287406786 /nfs/dbraw/zinc/40/67/86/1287406786.db2.gz JMZGIJCDINKCJI-KBPBESRZSA-N 1 1 339.411 2.621 10 5 EFBEMO C[C@H](NCCCC[N@H+]1CCC[C@H]1CO)c1c(F)cccc1[N+](=O)[O-] ZINC000872035003 1287406789 /nfs/dbraw/zinc/40/67/89/1287406789.db2.gz JMZGIJCDINKCJI-KBPBESRZSA-N 1 1 339.411 2.621 10 5 EFBEMO CCN(C)C(=O)[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(C)C ZINC000872075315 1287420655 /nfs/dbraw/zinc/42/06/55/1287420655.db2.gz PQRFARZOWIYYHP-NHYWBVRUSA-N 1 1 325.384 2.887 10 5 EFBEMO CCC[C@@H](C)C(=O)NCC[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872073515 1287420853 /nfs/dbraw/zinc/42/08/53/1287420853.db2.gz QHSQALIFBWHXRS-NEPJUHHUSA-N 1 1 325.384 2.937 10 5 EFBEMO C[C@H]([NH2+]CCC(C)(C)S(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-] ZINC000872079707 1287422722 /nfs/dbraw/zinc/42/27/22/1287422722.db2.gz ONPTXCIZXVEJQJ-JTQLQIEISA-N 1 1 332.397 2.598 10 5 EFBEMO C[C@@H]([NH2+]CC[S@@](=O)CC(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872085875 1287424398 /nfs/dbraw/zinc/42/43/98/1287424398.db2.gz RNSRSYPCMFDDOO-CWMRNNLJSA-N 1 1 342.314 2.696 10 5 EFBEMO Cc1ccnc([C@H]2CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000846969231 1280670544 /nfs/dbraw/zinc/67/05/44/1280670544.db2.gz MRXUXAVYCQWITG-MAUKXSAKSA-N 1 1 327.384 2.821 10 5 EFBEMO Cn1ncc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)n1 ZINC000808416969 1281707465 /nfs/dbraw/zinc/70/74/65/1281707465.db2.gz URIZBMLXZABOTE-UHFFFAOYSA-N 1 1 329.385 2.742 10 5 EFBEMO O=C(C[N@@H+]1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000872281530 1287520805 /nfs/dbraw/zinc/52/08/05/1287520805.db2.gz TXEUQNNJIHZUFU-OAHLLOKOSA-N 1 1 347.415 2.957 10 5 EFBEMO O=C(C[N@H+]1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000872281530 1287520811 /nfs/dbraw/zinc/52/08/11/1287520811.db2.gz TXEUQNNJIHZUFU-OAHLLOKOSA-N 1 1 347.415 2.957 10 5 EFBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C(C)(C)O)C1 ZINC001175890540 1287579098 /nfs/dbraw/zinc/57/90/98/1287579098.db2.gz BENLQHOPRANWTH-WCQYABFASA-N 1 1 346.387 2.799 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCc2csc([N+](=O)[O-])c2)C1 ZINC000811447882 1284325593 /nfs/dbraw/zinc/32/55/93/1284325593.db2.gz QKMYDKQYLWWXHC-CQSZACIVSA-N 1 1 330.381 2.912 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000811449538 1284326216 /nfs/dbraw/zinc/32/62/16/1284326216.db2.gz RQHJPPRAHUCUOM-INIZCTEOSA-N 1 1 342.342 2.990 10 5 EFBEMO O=C(CCC(F)F)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172657 1285704172 /nfs/dbraw/zinc/70/41/72/1285704172.db2.gz PSLMGDPARHQUDD-ZDUSSCGKSA-N 1 1 328.315 2.758 10 5 EFBEMO O=C(CCC(F)F)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172657 1285704179 /nfs/dbraw/zinc/70/41/79/1285704179.db2.gz PSLMGDPARHQUDD-ZDUSSCGKSA-N 1 1 328.315 2.758 10 5 EFBEMO CCOC1CC(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000813171615 1285704271 /nfs/dbraw/zinc/70/42/71/1285704271.db2.gz NDGQVYYXKPVSBO-WIHSUSGWSA-N 1 1 348.399 2.527 10 5 EFBEMO CCOC1CC(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000813171615 1285704276 /nfs/dbraw/zinc/70/42/76/1285704276.db2.gz NDGQVYYXKPVSBO-WIHSUSGWSA-N 1 1 348.399 2.527 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H]2C[C@H](O)CC[C@@H]2C1 ZINC001171936716 1285933973 /nfs/dbraw/zinc/93/39/73/1285933973.db2.gz FTPMHONWHIOBDT-JKIFEVAISA-N 1 1 334.416 2.975 10 5 EFBEMO CCOC(=O)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC001176650012 1288077880 /nfs/dbraw/zinc/07/78/80/1288077880.db2.gz NELOWSYXCUFCSZ-CYBMUJFWSA-N 1 1 336.388 2.767 10 5 EFBEMO CCOC(=O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC001176650012 1288077882 /nfs/dbraw/zinc/07/78/82/1288077882.db2.gz NELOWSYXCUFCSZ-CYBMUJFWSA-N 1 1 336.388 2.767 10 5 EFBEMO O=C(CC[N@H+]1CCCC[C@@H]1[C@@H]1CCCO1)Nc1ccccc1[N+](=O)[O-] ZINC001176927497 1288176367 /nfs/dbraw/zinc/17/63/67/1288176367.db2.gz SLENAVGMHCNJHN-SJORKVTESA-N 1 1 347.415 2.957 10 5 EFBEMO CCN(C(=O)Nc1cccc([N+](=O)[O-])c1Cl)[C@H]1CC[N@@H+](C)C1 ZINC000823254566 1289250725 /nfs/dbraw/zinc/25/07/25/1289250725.db2.gz YLQNWBMUIFCVBI-JTQLQIEISA-N 1 1 326.784 2.806 10 5 EFBEMO O=[N+]([O-])c1cnc2ccccc2c1N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC001186872771 1291031274 /nfs/dbraw/zinc/03/12/74/1291031274.db2.gz PVGRITZCFMROHG-JKSUJKDBSA-N 1 1 326.400 2.994 10 5 EFBEMO C[C@@H](C[N@H+](C)CCC[NH+](C)C)Nc1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC001186999086 1291077922 /nfs/dbraw/zinc/07/79/22/1291077922.db2.gz HUWTZWFOCSQESL-AWEZNQCLSA-N 1 1 349.479 2.553 10 5 EFBEMO C[C@@H](C[N@@H+](C)CCC[NH+](C)C)Nc1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC001186999086 1291077929 /nfs/dbraw/zinc/07/79/29/1291077929.db2.gz HUWTZWFOCSQESL-AWEZNQCLSA-N 1 1 349.479 2.553 10 5 EFBEMO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC001186999086 1291077937 /nfs/dbraw/zinc/07/79/37/1291077937.db2.gz HUWTZWFOCSQESL-AWEZNQCLSA-N 1 1 349.479 2.553 10 5 EFBEMO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC001186999086 1291077945 /nfs/dbraw/zinc/07/79/45/1291077945.db2.gz HUWTZWFOCSQESL-AWEZNQCLSA-N 1 1 349.479 2.553 10 5 EFBEMO COC(=O)C=Cc1ccc(NCc2[nH]c(C)[nH+]c2C)c([N+](=O)[O-])c1 ZINC001187670004 1291210338 /nfs/dbraw/zinc/21/03/38/1291210338.db2.gz XKSIZZVUPKMNBH-ALCCZGGFSA-N 1 1 330.344 2.733 10 5 EFBEMO [NH3+]C[C@H]1Cc2cc(F)ccc2N(Cc2cc(O)ccc2[N+](=O)[O-])C1 ZINC000903567610 1312877199 /nfs/dbraw/zinc/87/71/99/1312877199.db2.gz CMHQDTSMOVKDNG-LLVKDONJSA-N 1 1 331.347 2.577 10 5 EFBEMO C[N@H+](CCc1ccncc1)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001192261446 1292847344 /nfs/dbraw/zinc/84/73/44/1292847344.db2.gz FKWLEJRPNAKYCL-UHFFFAOYSA-N 1 1 339.355 2.714 10 5 EFBEMO C[N@@H+](CCc1ccncc1)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001192261446 1292847351 /nfs/dbraw/zinc/84/73/51/1292847351.db2.gz FKWLEJRPNAKYCL-UHFFFAOYSA-N 1 1 339.355 2.714 10 5 EFBEMO C[C@@H]1CN(Cc2c(Br)cccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C ZINC001192313276 1292865817 /nfs/dbraw/zinc/86/58/17/1292865817.db2.gz CCMYGQAWKVOFBV-MNOVXSKESA-N 1 1 342.237 2.882 10 5 EFBEMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCC[C@]2(CCOC2)O1 ZINC001194262298 1293574920 /nfs/dbraw/zinc/57/49/20/1293574920.db2.gz MAMPPSNECPOAPR-SJLPKXTDSA-N 1 1 334.416 2.797 10 5 EFBEMO COc1ccc2c(c1)C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCO2 ZINC001194418186 1293625338 /nfs/dbraw/zinc/62/53/38/1293625338.db2.gz PODPGXCDPMHNGM-UHFFFAOYSA-N 1 1 344.367 2.877 10 5 EFBEMO COc1ccc2c(c1)C[N@H+](CCOc1cccc([N+](=O)[O-])c1)CCO2 ZINC001194418186 1293625343 /nfs/dbraw/zinc/62/53/43/1293625343.db2.gz PODPGXCDPMHNGM-UHFFFAOYSA-N 1 1 344.367 2.877 10 5 EFBEMO CC(C)[N@@H+](C)CCCNC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC000930182847 1294087198 /nfs/dbraw/zinc/08/71/98/1294087198.db2.gz XJWRZLJUQFJYGG-UHFFFAOYSA-N 1 1 325.384 2.513 10 5 EFBEMO C[C@@H]([NH2+]Cc1cc(=O)n2ccsc2n1)c1ccc([N+](=O)[O-])cc1 ZINC001197646547 1294641032 /nfs/dbraw/zinc/64/10/32/1294641032.db2.gz HAWYLYGTCFPUTL-SNVBAGLBSA-N 1 1 330.369 2.515 10 5 EFBEMO Cc1cc([C@@H]2CCCC[N@@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC001198130935 1294888945 /nfs/dbraw/zinc/88/89/45/1294888945.db2.gz LJUNUPDMUOELQS-DLBZAZTESA-N 1 1 330.388 2.887 10 5 EFBEMO Cc1cc([C@@H]2CCCC[N@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC001198130935 1294888951 /nfs/dbraw/zinc/88/89/51/1294888951.db2.gz LJUNUPDMUOELQS-DLBZAZTESA-N 1 1 330.388 2.887 10 5 EFBEMO Cc1cc([C@@H]2CCCC[N@@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC001198130937 1294889374 /nfs/dbraw/zinc/88/93/74/1294889374.db2.gz LJUNUPDMUOELQS-IRXDYDNUSA-N 1 1 330.388 2.887 10 5 EFBEMO Cc1cc([C@@H]2CCCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC001198130937 1294889381 /nfs/dbraw/zinc/88/93/81/1294889381.db2.gz LJUNUPDMUOELQS-IRXDYDNUSA-N 1 1 330.388 2.887 10 5 EFBEMO O=C(NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1F ZINC001273814407 1296053899 /nfs/dbraw/zinc/05/38/99/1296053899.db2.gz HSAYTFASNIYNHU-ONEGZZNKSA-N 1 1 349.387 2.871 10 5 EFBEMO C[N@H+]1CCCC[C@@H]1CCC(=O)OCCOc1cccc([N+](=O)[O-])c1 ZINC000803859371 1313265409 /nfs/dbraw/zinc/26/54/09/1313265409.db2.gz ZNQDDFNBHXSFAR-CQSZACIVSA-N 1 1 336.388 2.781 10 5 EFBEMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2C[N@H+](C)C[C@H]21 ZINC000931626075 1297357804 /nfs/dbraw/zinc/35/78/04/1297357804.db2.gz NOYDXSHQIVWBEN-IINYFYTJSA-N 1 1 338.795 2.724 10 5 EFBEMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2C[N@H+](C)C[C@@H]21 ZINC000931626074 1297358580 /nfs/dbraw/zinc/35/85/80/1297358580.db2.gz NOYDXSHQIVWBEN-HZMBPMFUSA-N 1 1 338.795 2.724 10 5 EFBEMO C[C@H](CCc1ccccc1[N+](=O)[O-])N[C@@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903975306 1313522612 /nfs/dbraw/zinc/52/26/12/1313522612.db2.gz ZOASMQWRWKISJL-WBVHZDCISA-N 1 1 347.459 2.664 10 5 EFBEMO C[N@@H+](CCCNC(=O)C1(C(F)F)CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001490196885 1298626781 /nfs/dbraw/zinc/62/67/81/1298626781.db2.gz QJSOZEONBUGACQ-UHFFFAOYSA-N 1 1 341.358 2.578 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H](c3ccccn3)C2)cc1 ZINC000852084095 1299541703 /nfs/dbraw/zinc/54/17/03/1299541703.db2.gz PYAVKUNSPAZCHX-YJBOKZPZSA-N 1 1 327.384 2.903 10 5 EFBEMO C[C@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776590097 1299686840 /nfs/dbraw/zinc/68/68/40/1299686840.db2.gz CDXKCLZDFUJGLJ-OMWUSAIZSA-N 1 1 342.395 2.952 10 5 EFBEMO C[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H](C)O1 ZINC000852586541 1299772901 /nfs/dbraw/zinc/77/29/01/1299772901.db2.gz IXZDPORDUXCHJM-NEPJUHHUSA-N 1 1 339.367 2.562 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)cc1 ZINC000852758681 1299870595 /nfs/dbraw/zinc/87/05/95/1299870595.db2.gz DENKMAAPCJFQLZ-KURKYZTESA-N 1 1 332.400 2.521 10 5 EFBEMO COc1cc(NC[C@H]2C[N@H+]3CCC[C@H]3CO2)c(Cl)cc1[N+](=O)[O-] ZINC000853242736 1300062599 /nfs/dbraw/zinc/06/25/99/1300062599.db2.gz WLAVYEXGVRYAPL-QWRGUYRKSA-N 1 1 341.795 2.532 10 5 EFBEMO C[N@@H+](C[C@@H]1CC1(C)C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000853627862 1300199676 /nfs/dbraw/zinc/19/96/76/1300199676.db2.gz IBAJISBOHILWIS-HOCLYGCPSA-N 1 1 331.416 2.846 10 5 EFBEMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1ccc([N+](=O)[O-])[n-]1 ZINC000854513255 1300601702 /nfs/dbraw/zinc/60/17/02/1300601702.db2.gz JZMFIKHBMYMQFJ-CZUORRHYSA-N 1 1 340.383 2.679 10 5 EFBEMO Cc1ccc2c(c1)[C@H]1C[N@H+](C)CC[C@H]1N2C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000854513255 1300601709 /nfs/dbraw/zinc/60/17/09/1300601709.db2.gz JZMFIKHBMYMQFJ-CZUORRHYSA-N 1 1 340.383 2.679 10 5 EFBEMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000854513255 1300601721 /nfs/dbraw/zinc/60/17/21/1300601721.db2.gz JZMFIKHBMYMQFJ-CZUORRHYSA-N 1 1 340.383 2.679 10 5 EFBEMO O=C(NCC[NH+]1CCSCC1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000859337389 1301438618 /nfs/dbraw/zinc/43/86/18/1301438618.db2.gz KDSRHVKXQBGWLB-UHFFFAOYSA-N 1 1 345.424 2.527 10 5 EFBEMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc3ccccc32)C(C)(C)C1 ZINC000860511821 1301831118 /nfs/dbraw/zinc/83/11/18/1301831118.db2.gz VJJIFCHIAPLYOI-UHFFFAOYSA-N 1 1 327.384 2.914 10 5 EFBEMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860564417 1301847180 /nfs/dbraw/zinc/84/71/80/1301847180.db2.gz SDZUSHYZVDOWOP-QWHCGFSZSA-N 1 1 327.384 2.913 10 5 EFBEMO CC[N@@H+](CCNC(=O)Nc1ccc([N+](=O)[O-])c2ccncc12)C(C)C ZINC000861358656 1302103972 /nfs/dbraw/zinc/10/39/72/1302103972.db2.gz YPCDAQIBFYDABU-UHFFFAOYSA-N 1 1 345.403 2.995 10 5 EFBEMO C[N@H+]1C[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc4ccccc43)[C@H]2C1 ZINC000861807859 1302210528 /nfs/dbraw/zinc/21/05/28/1302210528.db2.gz GLRHYCHWXMGMRB-DYVFJYSZSA-N 1 1 325.368 2.524 10 5 EFBEMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc3ccccc32)C[C@H](C)[N@H+]1C ZINC000861838723 1302219181 /nfs/dbraw/zinc/21/91/81/1302219181.db2.gz PCPVXLCICLHVEF-BETUJISGSA-N 1 1 327.384 2.913 10 5 EFBEMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc3ccccc32)C[C@H](C)[N@@H+]1C ZINC000861838723 1302219187 /nfs/dbraw/zinc/21/91/87/1302219187.db2.gz PCPVXLCICLHVEF-BETUJISGSA-N 1 1 327.384 2.913 10 5 EFBEMO Cc1cc(Cl)c(C(=O)N2CC[NH+](CCCF)CC2)cc1[N+](=O)[O-] ZINC000862114317 1302288219 /nfs/dbraw/zinc/28/82/19/1302288219.db2.gz FWFRKTAZFGFNFP-UHFFFAOYSA-N 1 1 343.786 2.674 10 5 EFBEMO Cc1nn(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c2ncc([N+](=O)[O-])cc12 ZINC000863294460 1302578557 /nfs/dbraw/zinc/57/85/57/1302578557.db2.gz DCDLGPRIGLXQLB-OLZOCXBDSA-N 1 1 333.417 2.575 10 5 EFBEMO C[C@H]1CC[C@@]2(CC[N@H+](Cn3c(=O)oc4cccc([N+](=O)[O-])c43)C2)C1 ZINC000794639524 1302846099 /nfs/dbraw/zinc/84/60/99/1302846099.db2.gz MCAXZVKSJMZMAG-YVEFUNNKSA-N 1 1 331.372 2.972 10 5 EFBEMO C[C@H]1CC[C@@]2(CC[N@@H+](Cn3c(=O)oc4cccc([N+](=O)[O-])c43)C2)C1 ZINC000794639524 1302846106 /nfs/dbraw/zinc/84/61/06/1302846106.db2.gz MCAXZVKSJMZMAG-YVEFUNNKSA-N 1 1 331.372 2.972 10 5 EFBEMO C[C@@H]1CC[C@]2(CC[N@H+](Cn3c(=O)oc4cccc([N+](=O)[O-])c43)C2)C1 ZINC000794639510 1302847552 /nfs/dbraw/zinc/84/75/52/1302847552.db2.gz MCAXZVKSJMZMAG-PXAZEXFGSA-N 1 1 331.372 2.972 10 5 EFBEMO C[C@@H]1CC[C@]2(CC[N@@H+](Cn3c(=O)oc4cccc([N+](=O)[O-])c43)C2)C1 ZINC000794639510 1302847561 /nfs/dbraw/zinc/84/75/61/1302847561.db2.gz MCAXZVKSJMZMAG-PXAZEXFGSA-N 1 1 331.372 2.972 10 5 EFBEMO Cc1nn(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)c2ncc([N+](=O)[O-])cc12 ZINC000794653873 1302904940 /nfs/dbraw/zinc/90/49/40/1302904940.db2.gz BFAXOTMTNNPQQH-CABZTGNLSA-N 1 1 343.309 2.878 10 5 EFBEMO Cc1nn(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)c2ncc([N+](=O)[O-])cc12 ZINC000794653873 1302904950 /nfs/dbraw/zinc/90/49/50/1302904950.db2.gz BFAXOTMTNNPQQH-CABZTGNLSA-N 1 1 343.309 2.878 10 5 EFBEMO C[N@@H+]1Cc2ccccc2[C@@H]1CNc1cc(F)c([N+](=O)[O-])cc1CO ZINC000866192208 1303557236 /nfs/dbraw/zinc/55/72/36/1303557236.db2.gz FPLUNIWUVDUVKB-KRWDZBQOSA-N 1 1 331.347 2.825 10 5 EFBEMO C[N@H+]1Cc2ccccc2[C@@H]1CNc1cc(F)c([N+](=O)[O-])cc1CO ZINC000866192208 1303557241 /nfs/dbraw/zinc/55/72/41/1303557241.db2.gz FPLUNIWUVDUVKB-KRWDZBQOSA-N 1 1 331.347 2.825 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(c3ccc([N+](=O)[O-])cc3Br)CC[C@@H]21 ZINC000866207078 1303562432 /nfs/dbraw/zinc/56/24/32/1303562432.db2.gz UZKRXVWGBGYNRP-MFKMUULPSA-N 1 1 340.221 2.888 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)CC[C@H]21 ZINC000866205411 1303562525 /nfs/dbraw/zinc/56/25/25/1303562525.db2.gz LMVZAZPGNQUYMS-ZYHUDNBSSA-N 1 1 327.331 2.727 10 5 EFBEMO CCCN(C[C@@H]1CCCCO1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867955809 1304043736 /nfs/dbraw/zinc/04/37/36/1304043736.db2.gz HGRMMHUDWGAYJI-WMZOPIPTSA-N 1 1 349.431 2.576 10 5 EFBEMO Cc1ccc(CNC(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000869053903 1304592413 /nfs/dbraw/zinc/59/24/13/1304592413.db2.gz XNRJKDPRSPAQOE-MRXNPFEDSA-N 1 1 348.447 2.823 10 5 EFBEMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CCC1(C)C ZINC000871150038 1305836099 /nfs/dbraw/zinc/83/60/99/1305836099.db2.gz JHUZHPUGJUNKDJ-UHFFFAOYSA-N 1 1 325.796 2.805 10 5 EFBEMO CCc1c[nH]c2nc[nH+]c(NCCNc3ccc([N+](=O)[O-])cc3)c12 ZINC001162127301 1312051658 /nfs/dbraw/zinc/05/16/58/1312051658.db2.gz WLRKPVNKZIONNJ-UHFFFAOYSA-N 1 1 326.360 2.904 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](CC3CC3)C2)cc1C ZINC001162482836 1312111475 /nfs/dbraw/zinc/11/14/75/1312111475.db2.gz MQZQEOUACQRGAQ-AWEZNQCLSA-N 1 1 347.415 2.976 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1C ZINC001162658811 1312145298 /nfs/dbraw/zinc/14/52/98/1312145298.db2.gz AUNXIRGGNLZJCW-CHWSQXEVSA-N 1 1 335.404 2.975 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@@H](C(C)(C)C)C1 ZINC001163930255 1312409301 /nfs/dbraw/zinc/40/93/01/1312409301.db2.gz PZGGTJSTLJQKMJ-OAHLLOKOSA-N 1 1 337.395 2.845 10 5 EFBEMO Cc1cc(F)cc(C(=O)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC001163929331 1312409335 /nfs/dbraw/zinc/40/93/35/1312409335.db2.gz JLFWTAZKCXXGBD-CQSZACIVSA-N 1 1 337.395 2.845 10 5 EFBEMO Cc1cc(F)cc(C(=O)N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC001163929331 1312409337 /nfs/dbraw/zinc/40/93/37/1312409337.db2.gz JLFWTAZKCXXGBD-CQSZACIVSA-N 1 1 337.395 2.845 10 5 EFBEMO Cn1cc[nH+]c1CCNc1ncnc2c(Cl)cc([N+](=O)[O-])cc12 ZINC001164138078 1312455275 /nfs/dbraw/zinc/45/52/75/1312455275.db2.gz KBCITROCCUAFKA-UHFFFAOYSA-N 1 1 332.751 2.580 10 5 EFBEMO Cc1ccc(CNC(=O)NCCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC001254240341 1315686410 /nfs/dbraw/zinc/68/64/10/1315686410.db2.gz HDQFGWOUVIHWPG-HNNXBMFYSA-N 1 1 348.447 2.967 10 5 EFBEMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Nc3ccc([N+](=O)[O-])c(Cl)c3)[C@H]2C1 ZINC001263637770 1316552862 /nfs/dbraw/zinc/55/28/62/1316552862.db2.gz BFIJMRCNRWFIGY-GAFUQQFSSA-N 1 1 338.795 2.710 10 5 EFBEMO Cc1cccnc1C(=O)NCCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001264974814 1316676718 /nfs/dbraw/zinc/67/67/18/1316676718.db2.gz NICFLFHXNVTUNQ-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1ocnc1C)Cc1ccccc1[N+](=O)[O-] ZINC001265107946 1316722835 /nfs/dbraw/zinc/72/28/35/1316722835.db2.gz UJVIEKIWBIPSEX-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO CCC(CC)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21 ZINC001265710566 1316865078 /nfs/dbraw/zinc/86/50/78/1316865078.db2.gz FDNSDCGDEVSJFH-QLPKVWCKSA-N 1 1 331.416 2.577 10 5 EFBEMO CC/C(C)=C\C(=O)NCCC[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001265840580 1316888867 /nfs/dbraw/zinc/88/88/67/1316888867.db2.gz UPNZXKKXEGVTIU-WQLSENKSSA-N 1 1 325.434 2.951 10 5 EFBEMO CC/C(C)=C\C(=O)NCCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001265840580 1316888868 /nfs/dbraw/zinc/88/88/68/1316888868.db2.gz UPNZXKKXEGVTIU-WQLSENKSSA-N 1 1 325.434 2.951 10 5 EFBEMO CCC/C=C\CC[NH+]1CCC(C2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC001279353219 1317243322 /nfs/dbraw/zinc/24/33/22/1317243322.db2.gz VEMPXYRNIJAICN-OSNZYPHYSA-N 1 1 349.475 2.759 10 5 EFBEMO CC/C(C)=C\C(=O)N1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC001279363802 1317245854 /nfs/dbraw/zinc/24/58/54/1317245854.db2.gz WKROBSDBTIXNAK-YSLZGXTCSA-N 1 1 343.427 2.841 10 5 EFBEMO CN(CCC[N@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)c1cccnc1 ZINC001280781434 1317775433 /nfs/dbraw/zinc/77/54/33/1317775433.db2.gz MZFGPFWYHVVREP-UHFFFAOYSA-N 1 1 348.428 2.645 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)c1cccnc1 ZINC001280781434 1317775439 /nfs/dbraw/zinc/77/54/39/1317775439.db2.gz MZFGPFWYHVVREP-UHFFFAOYSA-N 1 1 348.428 2.645 10 5 EFBEMO CC(C)N(CC[N@@H+](C)CCC1CCCCC1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001284533300 1320408039 /nfs/dbraw/zinc/40/80/39/1320408039.db2.gz ILZLKMMQIKJNCU-IAGOWNOFSA-N 1 1 339.480 2.791 10 5 EFBEMO CC(C)N(CC[N@H+](C)CCC1CCCCC1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001284533300 1320408040 /nfs/dbraw/zinc/40/80/40/1320408040.db2.gz ILZLKMMQIKJNCU-IAGOWNOFSA-N 1 1 339.480 2.791 10 5 EFBEMO CC(C)N(CC[N@@H+](C)CCC1CCCCC1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001284533300 1320408044 /nfs/dbraw/zinc/40/80/44/1320408044.db2.gz ILZLKMMQIKJNCU-IAGOWNOFSA-N 1 1 339.480 2.791 10 5 EFBEMO CN(C)c1cc(NC(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)cc[nH+]1 ZINC001294345404 1322457280 /nfs/dbraw/zinc/45/72/80/1322457280.db2.gz ZZYSSZODIWNAED-UHFFFAOYSA-N 1 1 335.751 2.544 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+](CC(C)C)C1 ZINC001295041364 1322623595 /nfs/dbraw/zinc/62/35/95/1322623595.db2.gz INWWCZDBTQBSRD-CYBMUJFWSA-N 1 1 337.395 2.750 10 5 EFBEMO Cc1cc(C(=O)N(C)CC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)ccn1 ZINC001320061194 1329067542 /nfs/dbraw/zinc/06/75/42/1329067542.db2.gz GXIVDJYWDIUSLG-UHFFFAOYSA-N 1 1 342.399 2.502 10 5 EFBEMO Cc1cc(C(=O)N(C)CC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)ccn1 ZINC001320061194 1329067544 /nfs/dbraw/zinc/06/75/44/1329067544.db2.gz GXIVDJYWDIUSLG-UHFFFAOYSA-N 1 1 342.399 2.502 10 5 EFBEMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001297526718 1323256927 /nfs/dbraw/zinc/25/69/27/1323256927.db2.gz YKEKOQHTWJTRTC-LLVKDONJSA-N 1 1 327.812 2.636 10 5 EFBEMO C[N@@H+](CCNC(=O)CCC(C)(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC001492309232 1324410089 /nfs/dbraw/zinc/41/00/89/1324410089.db2.gz ORIZQELBMGMQFA-UHFFFAOYSA-N 1 1 329.347 2.578 10 5 EFBEMO CC[N@H+]1C[C@H](NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C(C)(C)C1 ZINC001304043840 1324633997 /nfs/dbraw/zinc/63/39/97/1324633997.db2.gz ZQYPBTCJARMAOE-NHYWBVRUSA-N 1 1 337.395 2.684 10 5 EFBEMO C[N@H+](CCNC(=O)C(C)(C)C(C)(F)F)Cc1ccccc1[N+](=O)[O-] ZINC001317469110 1324739171 /nfs/dbraw/zinc/73/91/71/1324739171.db2.gz MYFBTFRMYSSDOY-UHFFFAOYSA-N 1 1 343.374 2.824 10 5 EFBEMO C[N@@H+](CCNC(=O)C(C)(C)C(C)(F)F)Cc1ccccc1[N+](=O)[O-] ZINC001317469110 1324739178 /nfs/dbraw/zinc/73/91/78/1324739178.db2.gz MYFBTFRMYSSDOY-UHFFFAOYSA-N 1 1 343.374 2.824 10 5 EFBEMO COC(=O)/C=C/c1ccc(NCc2c[nH+]c3n2CCC3)c([N+](=O)[O-])c1 ZINC001307210703 1324750649 /nfs/dbraw/zinc/75/06/49/1324750649.db2.gz VYTYKGUUXLMTFO-FNORWQNLSA-N 1 1 342.355 2.536 10 5 EFBEMO 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ZINC001307970877 1324788056 /nfs/dbraw/zinc/78/80/56/1324788056.db2.gz WSPAPOJWQXAQSX-VIFPVBQESA-N 1 1 337.767 2.593 10 5 EFBEMO O=C(C[NH2+][C@@H]1CCCn2nccc21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001308026332 1324789793 /nfs/dbraw/zinc/78/97/93/1324789793.db2.gz JDRJNRRKSFXOBZ-LLVKDONJSA-N 1 1 349.778 2.508 10 5 EFBEMO COc1ccc2nc(C[NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)[nH]c2n1 ZINC001308071232 1324791278 /nfs/dbraw/zinc/79/12/78/1324791278.db2.gz XFQJJSAYGLDJIG-SNVBAGLBSA-N 1 1 327.344 2.726 10 5 EFBEMO NC(=O)c1ccc(C[N@H+]2C[C@@H](C3CC3)C[C@H]2C2CC2)c([N+](=O)[O-])c1 ZINC001308121485 1324794274 /nfs/dbraw/zinc/79/42/74/1324794274.db2.gz MOALRFWJCPNNOP-HOTGVXAUSA-N 1 1 329.400 2.704 10 5 EFBEMO Cc1cccnc1[C@H](C)[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC001308152468 1324796859 /nfs/dbraw/zinc/79/68/59/1324796859.db2.gz DJDBHQHWCRWWNH-ZDUSSCGKSA-N 1 1 328.372 2.612 10 5 EFBEMO Cc1ncccc1C(=O)NCCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001316847840 1325214704 /nfs/dbraw/zinc/21/47/04/1325214704.db2.gz DFMQSYRNPLOEPS-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO CC(C)(F)C(=O)NCCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001316911517 1325329903 /nfs/dbraw/zinc/32/99/03/1325329903.db2.gz GQNWFBUEDRIUAE-UHFFFAOYSA-N 1 1 337.395 2.814 10 5 EFBEMO Cc1occc1C(=O)NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001320967490 1329325894 /nfs/dbraw/zinc/32/58/94/1329325894.db2.gz ZCVTWOFPQXKUJS-IHWYPQMZSA-N 1 1 335.385 2.634 10 5 EFBEMO CCCC(C)(C)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21 ZINC001317213070 1327756464 /nfs/dbraw/zinc/75/64/64/1327756464.db2.gz XZMMYFQSSLXTFL-FVQHAEBGSA-N 1 1 345.443 2.968 10 5 EFBEMO C[N@H+](CCNC(=O)c1cc(F)ccc1F)Cc1cccc([N+](=O)[O-])c1 ZINC001317450511 1328039459 /nfs/dbraw/zinc/03/94/59/1328039459.db2.gz SRJMUIRHKNDTDI-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO C[N@@H+](CCNC(=O)c1cc(F)ccc1F)Cc1cccc([N+](=O)[O-])c1 ZINC001317450511 1328039466 /nfs/dbraw/zinc/03/94/66/1328039466.db2.gz SRJMUIRHKNDTDI-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO Cc1cocc1C(=O)NCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001317553889 1328140533 /nfs/dbraw/zinc/14/05/33/1328140533.db2.gz AGKNAMJPKUFILI-UHFFFAOYSA-N 1 1 343.383 2.891 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1cccn1C ZINC001327186559 1330438251 /nfs/dbraw/zinc/43/82/51/1330438251.db2.gz CNWLLERVXJPASB-UHFFFAOYSA-N 1 1 344.415 2.527 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001329630616 1330724917 /nfs/dbraw/zinc/72/49/17/1330724917.db2.gz JFJYIJPMKWICMR-UHFFFAOYSA-N 1 1 334.420 2.598 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CNC(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC001331553571 1330852615 /nfs/dbraw/zinc/85/26/15/1330852615.db2.gz FQYPYVPNQSJBNO-GFCCVEGCSA-N 1 1 343.387 2.749 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001332482912 1330976570 /nfs/dbraw/zinc/97/65/70/1330976570.db2.gz UMUAXGBYEDQHRJ-LBPRGKRZSA-N 1 1 328.372 2.847 10 5 EFBEMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001335959286 1331420651 /nfs/dbraw/zinc/42/06/51/1331420651.db2.gz OUWLRGKNBNDENI-LBPRGKRZSA-N 1 1 348.378 2.624 10 5 EFBEMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001335959279 1331420737 /nfs/dbraw/zinc/42/07/37/1331420737.db2.gz OUWLRGKNBNDENI-GFCCVEGCSA-N 1 1 348.378 2.624 10 5 EFBEMO CCc1ccc(C(=O)OC[C@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC001347391996 1332739905 /nfs/dbraw/zinc/73/99/05/1332739905.db2.gz PGSQHWOEOIYCHZ-MRXNPFEDSA-N 1 1 348.399 2.567 10 5 EFBEMO C[C@H](NC(=O)[C@@H]1CC[C@@H]2C[C@@H](C)C[N@H+]2C1)c1ccccc1[N+](=O)[O-] ZINC001347531136 1332753209 /nfs/dbraw/zinc/75/32/09/1332753209.db2.gz RCODYDOVASYDLR-LXTVHRRPSA-N 1 1 331.416 2.892 10 5 EFBEMO C[C@@H]1C[C@H]2CC[C@H](C(=O)N(C)CCc3ccccc3[N+](=O)[O-])C[N@H+]2C1 ZINC001352188955 1333419506 /nfs/dbraw/zinc/41/95/06/1333419506.db2.gz HSAPJTCNYNWJAI-HYVNUMGLSA-N 1 1 345.443 2.716 10 5 EFBEMO C[C@H]1CCC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000848476974 1334736471 /nfs/dbraw/zinc/73/64/71/1334736471.db2.gz JKZKGGUQJZKGLU-WMLDXEAASA-N 1 1 331.416 2.990 10 5 EFBEMO C[C@@H]1SCC[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)[C@H]1C ZINC000848478888 1334736804 /nfs/dbraw/zinc/73/68/04/1334736804.db2.gz OAVHZICNBWJGOT-HEHGZKQESA-N 1 1 349.456 2.694 10 5 EFBEMO C[C@@H]1SCC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)[C@H]1C ZINC000848478888 1334736807 /nfs/dbraw/zinc/73/68/07/1334736807.db2.gz OAVHZICNBWJGOT-HEHGZKQESA-N 1 1 349.456 2.694 10 5 EFBEMO CC[C@@H]1C[C@@H](C)C[N@H+]1CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848481262 1334737772 /nfs/dbraw/zinc/73/77/72/1334737772.db2.gz XLVJTKUVNPDCRU-UNEWFSDZSA-N 1 1 331.416 2.989 10 5 EFBEMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000848483028 1334739248 /nfs/dbraw/zinc/73/92/48/1334739248.db2.gz XNUREJIBKSVXLD-RDJZCZTQSA-N 1 1 329.400 2.600 10 5 EFBEMO C[N@H+](CCOC(C)(C)C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848481599 1334739658 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1 329.400 2.744 10 5 EFBEMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCCC2(CC2)C1 ZINC000848485339 1334741733 /nfs/dbraw/zinc/74/17/33/1334741733.db2.gz YGMHALXJDPTKAE-INIZCTEOSA-N 1 1 329.400 2.744 10 5 EFBEMO CSCCC[N@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848486255 1334742642 /nfs/dbraw/zinc/74/26/42/1334742642.db2.gz DKVKFYTZBIYFTQ-OAHLLOKOSA-N 1 1 337.445 2.553 10 5 EFBEMO CSCCC[N@@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848486255 1334742647 /nfs/dbraw/zinc/74/26/47/1334742647.db2.gz DKVKFYTZBIYFTQ-OAHLLOKOSA-N 1 1 337.445 2.553 10 5 EFBEMO CC[N@@H+](CC1CCC1)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848486630 1334743756 /nfs/dbraw/zinc/74/37/56/1334743756.db2.gz HVUINGXCEMHQGH-KRWDZBQOSA-N 1 1 331.416 2.990 10 5 EFBEMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H](C2CCC2)C1 ZINC000848489168 1334745456 /nfs/dbraw/zinc/74/54/56/1334745456.db2.gz QRLUPJNFBMQGMC-FUHWJXTLSA-N 1 1 343.427 2.990 10 5 EFBEMO C[C@@H]1CC(C)(C)C[N@H+]1CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848489494 1334746070 /nfs/dbraw/zinc/74/60/70/1334746070.db2.gz VNEFHGOTMQMLLZ-CJNGLKHVSA-N 1 1 331.416 2.989 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C[C@H]1C ZINC001358022171 1335355125 /nfs/dbraw/zinc/35/51/25/1335355125.db2.gz JFHZSADDUSZZLL-CABCVRRESA-N 1 1 345.443 2.958 10 5 EFBEMO COc1cc(N2CCc3cc[nH+]c(N)c3C2)c(Cl)cc1[N+](=O)[O-] ZINC001458705963 1395556054 /nfs/dbraw/zinc/55/60/54/1395556054.db2.gz UCSSRXMMTACSNO-UHFFFAOYSA-N 1 1 334.763 2.797 10 5 EFBEMO CC[N@@H+](C)[C@@H]1CCN(c2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C1 ZINC001458721537 1395563079 /nfs/dbraw/zinc/56/30/79/1395563079.db2.gz WPXXGRXMOXGOLN-GFCCVEGCSA-N 1 1 345.359 2.582 10 5 EFBEMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)n1 ZINC001458835427 1395614452 /nfs/dbraw/zinc/61/44/52/1395614452.db2.gz HLFOYFDAGACMNS-ZIAGYGMSSA-N 1 1 346.431 2.681 10 5 EFBEMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001459881016 1395988636 /nfs/dbraw/zinc/98/86/36/1395988636.db2.gz IINDVLWYAJJRLX-UHFFFAOYSA-N 1 1 345.359 2.673 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C[C@@H]1C ZINC001460326674 1396025451 /nfs/dbraw/zinc/02/54/51/1396025451.db2.gz CALPDXLEABXQAU-TXEJJXNPSA-N 1 1 325.384 2.657 10 5 EFBEMO CC(=O)Nc1cccc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c1 ZINC001460617109 1396239326 /nfs/dbraw/zinc/23/93/26/1396239326.db2.gz AAQZRLDSBORXEY-GOSISDBHSA-N 1 1 343.383 2.551 10 5 EFBEMO COC(=O)c1ccc2c(c1)CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC001460716924 1396245188 /nfs/dbraw/zinc/24/51/88/1396245188.db2.gz QJDRTVNSSGDVNL-UHFFFAOYSA-N 1 1 340.379 2.982 10 5 EFBEMO COC1(c2nccn2C)CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC001460755081 1396251664 /nfs/dbraw/zinc/25/16/64/1396251664.db2.gz VVMKVPSGAOARRF-UHFFFAOYSA-N 1 1 348.378 2.605 10 5 EFBEMO CC(C)[C@H]1CN(C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC001471241026 1397152510 /nfs/dbraw/zinc/15/25/10/1397152510.db2.gz YWMAONPQZMEVIJ-OAHLLOKOSA-N 1 1 339.823 2.589 10 5 EFBEMO Cc1ccc(NCCNC(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])[nH+]c1 ZINC001471238012 1397152979 /nfs/dbraw/zinc/15/29/79/1397152979.db2.gz WQXQBJMNQSNPTP-ZDUSSCGKSA-N 1 1 343.387 2.771 10 5 EFBEMO Cc1cccc(NCCNC(=O)c2cc([N+](=O)[O-])c(F)cc2C)[nH+]1 ZINC001472013086 1397234428 /nfs/dbraw/zinc/23/44/28/1397234428.db2.gz WHDYVBDKTNVWJC-UHFFFAOYSA-N 1 1 332.335 2.588 10 5 EFBEMO CC(C)[C@H](CNc1nc2c(cc1[N+](=O)[O-])CCCC2)[NH+]1CCOCC1 ZINC001472649603 1397265877 /nfs/dbraw/zinc/26/58/77/1397265877.db2.gz OOXIIRHYQRNBAE-KRWDZBQOSA-N 1 1 348.447 2.637 10 5 EFBEMO C[C@](CO)([NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 ZINC001473713652 1397324029 /nfs/dbraw/zinc/32/40/29/1397324029.db2.gz CVCWPXHPMLQGPL-MRXNPFEDSA-N 1 1 331.328 2.500 10 5 EFBEMO C[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cc2cnccc2o1 ZINC001473743071 1397327349 /nfs/dbraw/zinc/32/73/49/1397327349.db2.gz CSEWGARWMVGMBE-SNVBAGLBSA-N 1 1 340.339 2.686 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](C)c1ncccc1C ZINC001473880390 1397343810 /nfs/dbraw/zinc/34/38/10/1397343810.db2.gz YJAFFQOWFKINGG-LBPRGKRZSA-N 1 1 344.371 2.596 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@]2(CCOC2=O)C1 ZINC001473898873 1397347808 /nfs/dbraw/zinc/34/78/08/1397347808.db2.gz FWAHDCZCEVHMDD-KRWDZBQOSA-N 1 1 334.372 2.521 10 5 EFBEMO CCOc1cc(C[N@H+]2CCC[C@H]2Cc2ccnn2C)ccc1[N+](=O)[O-] ZINC001473899557 1397348121 /nfs/dbraw/zinc/34/81/21/1397348121.db2.gz PFOXZRIGTIJTHS-INIZCTEOSA-N 1 1 344.415 2.934 10 5 EFBEMO Cc1nscc1C(=O)NCCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001479767336 1397830029 /nfs/dbraw/zinc/83/00/29/1397830029.db2.gz NGGMBRWCSAXTRP-UHFFFAOYSA-N 1 1 348.428 2.612 10 5 EFBEMO CCC[N@H+](CCNC(=O)C1=COCCC1)Cc1ccccc1[N+](=O)[O-] ZINC001493282075 1398584517 /nfs/dbraw/zinc/58/45/17/1398584517.db2.gz VDOQUURBPSCRLG-UHFFFAOYSA-N 1 1 347.415 2.617 10 5 EFBEMO CCC[N@@H+](CCNC(=O)C1=COCCC1)Cc1ccccc1[N+](=O)[O-] ZINC001493282075 1398584520 /nfs/dbraw/zinc/58/45/20/1398584520.db2.gz VDOQUURBPSCRLG-UHFFFAOYSA-N 1 1 347.415 2.617 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1conc1C)Cc1cccc([N+](=O)[O-])c1 ZINC001493313171 1398606386 /nfs/dbraw/zinc/60/63/86/1398606386.db2.gz BJJXMBLFZJQNFV-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO O=C(NC1(C[NH2+]CCCC2CCCC2)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001495160840 1399706606 /nfs/dbraw/zinc/70/66/06/1399706606.db2.gz MGGRORORXLMLGB-HZPDHXFCSA-N 1 1 337.464 2.641 10 5 EFBEMO CCc1occc1C(=O)NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001497567150 1401462404 /nfs/dbraw/zinc/46/24/04/1401462404.db2.gz ASFRZCAGOOLDHB-ARJAWSKDSA-N 1 1 349.412 2.888 10 5 EFBEMO O=C(NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1)C1C=CC=CC=C1 ZINC001497589894 1401477289 /nfs/dbraw/zinc/47/72/89/1401477289.db2.gz CVYMEBOXYWPPAO-WAYWQWQTSA-N 1 1 345.424 2.717 10 5 EFBEMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H]2CCC[N@H+]2C2CCCCC2)n1 ZINC001556397269 1415067398 /nfs/dbraw/zinc/06/73/98/1415067398.db2.gz MKJLQXXEVLDJQQ-OAHLLOKOSA-N 1 1 346.431 2.825 10 5 EFBEMO CCC[N@@H+](CC)CCNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC001559123940 1415225633 /nfs/dbraw/zinc/22/56/33/1415225633.db2.gz BZTNXLFWIUHKAS-UHFFFAOYSA-N 1 1 334.420 2.631 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@H]3[C@@H](C2)C3(F)F)cccc1[N+](=O)[O-] ZINC001559665142 1415252475 /nfs/dbraw/zinc/25/24/75/1415252475.db2.gz DJACXMAUJBPZCE-NWDGAFQWSA-N 1 1 339.342 2.819 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+](CC[S@@](=O)C(F)(F)F)C2CC2)cc1 ZINC001559712960 1415253729 /nfs/dbraw/zinc/25/37/29/1415253729.db2.gz BOZCLJNYLCKMCL-JOCHJYFZSA-N 1 1 336.335 2.828 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+](CC[S@@](=O)C(F)(F)F)C2CC2)cc1 ZINC001559712960 1415253732 /nfs/dbraw/zinc/25/37/32/1415253732.db2.gz BOZCLJNYLCKMCL-JOCHJYFZSA-N 1 1 336.335 2.828 10 5 EFBEMO CCOC(=O)[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CCC1(F)F ZINC001560037261 1415261482 /nfs/dbraw/zinc/26/14/82/1415261482.db2.gz AMNBNZSECPGWMS-CQSZACIVSA-N 1 1 342.342 2.658 10 5 EFBEMO CCC[N@H+]1CCC[C@H]1CNC(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001564717686 1415381252 /nfs/dbraw/zinc/38/12/52/1415381252.db2.gz PUYGHXALHVUSMX-CABCVRRESA-N 1 1 348.447 2.872 10 5 EFBEMO C[C@H]1C[C@H](NC(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC001566167057 1415533385 /nfs/dbraw/zinc/53/33/85/1415533385.db2.gz UBPOVRKLGUPGTM-WCQYABFASA-N 1 1 342.399 2.543 10 5 EFBEMO O=C(NCCC[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CC1)c1ccc[nH]1 ZINC001566580118 1415663758 /nfs/dbraw/zinc/66/37/58/1415663758.db2.gz BGFPEXPNDKUBSI-UHFFFAOYSA-N 1 1 348.428 2.769 10 5 EFBEMO O=C(NCCC[N@H+](Cc1csc([N+](=O)[O-])c1)C1CC1)c1ccc[nH]1 ZINC001566580118 1415663765 /nfs/dbraw/zinc/66/37/65/1415663765.db2.gz BGFPEXPNDKUBSI-UHFFFAOYSA-N 1 1 348.428 2.769 10 5 EFBEMO C[N@H+](CCNC(=O)c1ccccc1F)Cc1cccc([N+](=O)[O-])c1 ZINC001567269908 1416048331 /nfs/dbraw/zinc/04/83/31/1416048331.db2.gz KJBAXKSDCUKPDO-UHFFFAOYSA-N 1 1 331.347 2.596 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccccc1F)Cc1cccc([N+](=O)[O-])c1 ZINC001567269908 1416048337 /nfs/dbraw/zinc/04/83/37/1416048337.db2.gz KJBAXKSDCUKPDO-UHFFFAOYSA-N 1 1 331.347 2.596 10 5 EFBEMO C[N@@H+](CCNC(=O)c1cccc(F)c1F)Cc1ccc([N+](=O)[O-])cc1 ZINC001567300351 1416063056 /nfs/dbraw/zinc/06/30/56/1416063056.db2.gz LGZMUUFRCYAQBJ-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO CC(C)c1ocnc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001567311244 1416066826 /nfs/dbraw/zinc/06/68/26/1416066826.db2.gz MHGRGWNJPYGTIP-UHFFFAOYSA-N 1 1 346.387 2.568 10 5 EFBEMO CC(C)c1ocnc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001567311244 1416066833 /nfs/dbraw/zinc/06/68/33/1416066833.db2.gz MHGRGWNJPYGTIP-UHFFFAOYSA-N 1 1 346.387 2.568 10 5 EFBEMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001568403525 1416516854 /nfs/dbraw/zinc/51/68/54/1416516854.db2.gz MXNGYSIAQIWAJZ-CYBMUJFWSA-N 1 1 339.823 2.733 10 5 EFBEMO Cc1ccc(NCCNC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)[nH+]c1 ZINC001646261181 1416639537 /nfs/dbraw/zinc/63/95/37/1416639537.db2.gz UJKZRSVGGAQVOS-UHFFFAOYSA-N 1 1 348.790 2.722 10 5 EFBEMO Cc1cccc(NCCNC(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])[nH+]1 ZINC001685075130 1416742512 /nfs/dbraw/zinc/74/25/12/1416742512.db2.gz LSKLOBNZSVAWHQ-CYBMUJFWSA-N 1 1 343.387 2.771 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC001685527311 1416766354 /nfs/dbraw/zinc/76/63/54/1416766354.db2.gz HBYREHAROADYKU-ILXRZTDVSA-N 1 1 348.447 2.822 10 5 EFBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccccc1O ZINC001698984643 1417360493 /nfs/dbraw/zinc/36/04/93/1417360493.db2.gz PPODGVNXBUPMNQ-UHFFFAOYSA-N 1 1 343.383 2.504 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccccc1O ZINC001698984643 1417360495 /nfs/dbraw/zinc/36/04/95/1417360495.db2.gz PPODGVNXBUPMNQ-UHFFFAOYSA-N 1 1 343.383 2.504 10 5 EFBEMO Cc1cocc1C(=O)N(C)CC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001698994301 1417362190 /nfs/dbraw/zinc/36/21/90/1417362190.db2.gz CVLXXZSFAPCBCN-UHFFFAOYSA-N 1 1 331.372 2.700 10 5 EFBEMO Cc1cocc1C(=O)N(C)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001698994301 1417362195 /nfs/dbraw/zinc/36/21/95/1417362195.db2.gz CVLXXZSFAPCBCN-UHFFFAOYSA-N 1 1 331.372 2.700 10 5 EFBEMO C[N@@H+](CCCNC(=O)CC(C)(F)F)Cc1ccccc1[N+](=O)[O-] ZINC001712969889 1418309690 /nfs/dbraw/zinc/30/96/90/1418309690.db2.gz PCYOAKVJKFHINX-UHFFFAOYSA-N 1 1 329.347 2.578 10 5 EFBEMO CC(C)(C(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCC1 ZINC001714973183 1418643481 /nfs/dbraw/zinc/64/34/81/1418643481.db2.gz ZJWFRCXJOMGLHI-UHFFFAOYSA-N 1 1 345.443 2.969 10 5 EFBEMO CC(C)CCCC(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001714972881 1418643712 /nfs/dbraw/zinc/64/37/12/1418643712.db2.gz HXPXPXDTFBIIFT-UHFFFAOYSA-N 1 1 333.432 2.969 10 5 EFBEMO CCc1[nH]ccc1C(=O)N(C)CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001715812863 1418684397 /nfs/dbraw/zinc/68/43/97/1418684397.db2.gz AKDGFILYAPDMQU-UHFFFAOYSA-N 1 1 344.415 2.689 10 5 EFBEMO Cc1cc(C(=O)NC/C=C\C[NH2+]Cc2csc([N+](=O)[O-])c2)co1 ZINC001716287124 1418752305 /nfs/dbraw/zinc/75/23/05/1418752305.db2.gz KZQWRLSISGMASQ-IHWYPQMZSA-N 1 1 335.385 2.634 10 5 EFBEMO CC/C(C)=C/C(=O)N1C[C@@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001717010187 1419146221 /nfs/dbraw/zinc/14/62/21/1419146221.db2.gz UOOABYHTBKSMNV-NKRZIZCBSA-N 1 1 343.427 2.841 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)C(C)(F)F ZINC001717203227 1419263941 /nfs/dbraw/zinc/26/39/41/1419263941.db2.gz NIUBUDGQLBKEOH-UHFFFAOYSA-N 1 1 329.347 2.530 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)CC(F)(F)F ZINC001717204502 1419265310 /nfs/dbraw/zinc/26/53/10/1419265310.db2.gz DOBIPURRLNGGNP-UHFFFAOYSA-N 1 1 347.337 2.828 10 5 EFBEMO Cc1ccc(C(=O)NCC2([NH2+]Cc3csc([N+](=O)[O-])c3)CC2)o1 ZINC001723492983 1424512799 /nfs/dbraw/zinc/51/27/99/1424512799.db2.gz UOUXTWIJRCRTLR-UHFFFAOYSA-N 1 1 335.385 2.610 10 5 EFBEMO CC1(CNC(=O)C2CC2)CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC001724270874 1424717434 /nfs/dbraw/zinc/71/74/34/1424717434.db2.gz CLXWUAHKBNIOQI-UHFFFAOYSA-N 1 1 337.445 2.785 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)Cc1ccco1 ZINC001724856442 1425073899 /nfs/dbraw/zinc/07/38/99/1425073899.db2.gz BLVJBFPPPMGNHW-UHFFFAOYSA-N 1 1 345.399 2.711 10 5 EFBEMO CC[C@H](NC(=O)NCC[N@H+]1CC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000893450941 715540906 /nfs/dbraw/zinc/54/09/06/715540906.db2.gz PFXZXXWALLREFZ-CJNGLKHVSA-N 1 1 334.420 2.687 10 5 EFBEMO CC[C@@H](NC(=O)NCC[N@H+]1CC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000893450942 715541570 /nfs/dbraw/zinc/54/15/70/715541570.db2.gz PFXZXXWALLREFZ-CZUORRHYSA-N 1 1 334.420 2.687 10 5 EFBEMO CC[C@H](NC(=O)N1CC[C@@H]2[C@H]1CCC[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000893452678 715560591 /nfs/dbraw/zinc/56/05/91/715560591.db2.gz WRZWCLKIFYDPOC-GVDBMIGSSA-N 1 1 346.431 2.924 10 5 EFBEMO [NH3+]C[C@H]1CCC[C@H]1NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000925764012 717436321 /nfs/dbraw/zinc/43/63/21/717436321.db2.gz VFJDHDZJLZUNEZ-BXKDBHETSA-N 1 1 328.210 2.574 10 5 EFBEMO COC(=O)[C@@H]1[C@H](C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)C1(F)F ZINC000893945689 720177386 /nfs/dbraw/zinc/17/73/86/720177386.db2.gz JJZRFPUQVJBLCA-JSGCOSHPSA-N 1 1 340.326 2.614 10 5 EFBEMO COC(=O)[C@@H]1[C@H](C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)C1(F)F ZINC000893945689 720177387 /nfs/dbraw/zinc/17/73/87/720177387.db2.gz JJZRFPUQVJBLCA-JSGCOSHPSA-N 1 1 340.326 2.614 10 5 EFBEMO COC(=O)[C@@H]1[C@H](C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)C1(F)F ZINC000893946353 720178485 /nfs/dbraw/zinc/17/84/85/720178485.db2.gz ZKZRIZACGDBQKM-KBPBESRZSA-N 1 1 340.326 2.614 10 5 EFBEMO COC(=O)[C@@H]1[C@H](C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)C1(F)F ZINC000893946353 720178487 /nfs/dbraw/zinc/17/84/87/720178487.db2.gz ZKZRIZACGDBQKM-KBPBESRZSA-N 1 1 340.326 2.614 10 5 EFBEMO Cc1n[nH]c(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1C ZINC000894054326 720253610 /nfs/dbraw/zinc/25/36/10/720253610.db2.gz LQBYVJVNGGXHGC-UHFFFAOYSA-N 1 1 330.388 2.978 10 5 EFBEMO C[C@H]1C[N@@H+](CCCOC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCO1 ZINC000893389455 721278040 /nfs/dbraw/zinc/27/80/40/721278040.db2.gz LSXXQRYSGSAROR-NSHDSACASA-N 1 1 342.779 2.516 10 5 EFBEMO COc1ccc([C@@H](CCO)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000182389369 721313180 /nfs/dbraw/zinc/31/31/80/721313180.db2.gz FXIQTFHVXBUFQD-MRXNPFEDSA-N 1 1 334.347 2.956 10 5 EFBEMO CC(C)(O)[C@@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000721820918 723448107 /nfs/dbraw/zinc/44/81/07/723448107.db2.gz FHWUXEQYXZEDQQ-LLVKDONJSA-N 1 1 343.221 2.950 10 5 EFBEMO CC(C)(O)[C@@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000721820918 723448108 /nfs/dbraw/zinc/44/81/08/723448108.db2.gz FHWUXEQYXZEDQQ-LLVKDONJSA-N 1 1 343.221 2.950 10 5 EFBEMO C[N@H+]1C[C@@H]2CN(c3c4cc(F)ccc4ncc3[N+](=O)[O-])C[C@]2(C)C1 ZINC000896911973 723863554 /nfs/dbraw/zinc/86/35/54/723863554.db2.gz KYQYJNJRQIZPJV-DIFFPNOSSA-N 1 1 330.363 2.670 10 5 EFBEMO CC(=O)c1c(N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)cccc1[N+](=O)[O-] ZINC000895563911 724197734 /nfs/dbraw/zinc/19/77/34/724197734.db2.gz FNQJMWGYWJJHGH-WFASDCNBSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1c(N[C@H]2CCC[N@H+]3CCSC[C@@H]23)cccc1[N+](=O)[O-] ZINC000895563911 724197736 /nfs/dbraw/zinc/19/77/36/724197736.db2.gz FNQJMWGYWJJHGH-WFASDCNBSA-N 1 1 335.429 2.789 10 5 EFBEMO C[N@H+]1CC[C@H](C(=O)NCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000895800104 724323030 /nfs/dbraw/zinc/32/30/30/724323030.db2.gz ZRKWRBGOEFVVEV-ROUUACIJSA-N 1 1 339.395 2.904 10 5 EFBEMO C[C@H]1C[C@@H](NC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000906797364 726800079 /nfs/dbraw/zinc/80/00/79/726800079.db2.gz HWDZEVCGZYXJPU-AAEUAGOBSA-N 1 1 339.823 2.780 10 5 EFBEMO C[N@@H+]1CC=C(CNC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000907226922 726893664 /nfs/dbraw/zinc/89/36/64/726893664.db2.gz MBDMHMAMOZSWLS-UHFFFAOYSA-N 1 1 337.807 2.559 10 5 EFBEMO CC(C)(C)c1ccc(NC(=O)C2C[NH+]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000908077514 727094669 /nfs/dbraw/zinc/09/46/69/727094669.db2.gz VNBJGKBBVVEYRN-CQSZACIVSA-N 1 1 347.415 2.552 10 5 EFBEMO C[NH+]1CCC2(CCC(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)CC1 ZINC000908497464 727196810 /nfs/dbraw/zinc/19/68/10/727196810.db2.gz CQIBJBRXUZFIME-UHFFFAOYSA-N 1 1 347.415 2.685 10 5 EFBEMO CCN(C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000912306052 727692987 /nfs/dbraw/zinc/69/29/87/727692987.db2.gz GEEMYMLKCHASRZ-SNVBAGLBSA-N 1 1 329.759 2.554 10 5 EFBEMO Cc1[nH+]ccn1CCOC(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000923966387 727752778 /nfs/dbraw/zinc/75/27/78/727752778.db2.gz GNDCQSSBNLJQGG-UHFFFAOYSA-N 1 1 337.763 2.929 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@]2(C)C[N@H+](C)C[C@]2(C)C1 ZINC000913274676 727812197 /nfs/dbraw/zinc/81/21/97/727812197.db2.gz OQOZUURXLARTSD-HDICACEKSA-N 1 1 331.416 2.625 10 5 EFBEMO O=C(NCc1cc(F)c(Cl)c([N+](=O)[O-])c1)[C@H]1CCC[N@H+]1C1CC1 ZINC000913385360 727830961 /nfs/dbraw/zinc/83/09/61/727830961.db2.gz YPLOJEIUQRSNHM-GFCCVEGCSA-N 1 1 341.770 2.630 10 5 EFBEMO CCCCC[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC001570485553 1086279025 /nfs/dbraw/zinc/27/90/25/1086279025.db2.gz LYSGJFRAHGNJLB-HZPDHXFCSA-N 1 1 337.464 2.546 10 5 EFBEMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CCN(C(=O)CCCF)CC1 ZINC001571333153 1086732730 /nfs/dbraw/zinc/73/27/30/1086732730.db2.gz HLMFDQQGKMRUDJ-UHFFFAOYSA-N 1 1 343.424 2.829 10 5 EFBEMO CC[N@H+]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C(C)(C)C1 ZINC001646586239 1087894074 /nfs/dbraw/zinc/89/40/74/1087894074.db2.gz IVTOXVTXKHPLHW-CQSZACIVSA-N 1 1 339.823 2.637 10 5 EFBEMO C[C@@H](CO)[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001647591425 1089586166 /nfs/dbraw/zinc/58/61/66/1089586166.db2.gz ZSPMTPSSSGPUHT-JSGCOSHPSA-N 1 1 346.387 2.628 10 5 EFBEMO CC(C)[C@@H]1C[C@@H](N2CCCC2)C[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC001648591952 1092236984 /nfs/dbraw/zinc/23/69/84/1092236984.db2.gz SWDJBOYQUCYZBC-CEXWTWQISA-N 1 1 347.459 2.823 10 5 EFBEMO CC(C)[C@@H]1C[C@@H](N2CCCC2)C[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC001648591952 1092237001 /nfs/dbraw/zinc/23/70/01/1092237001.db2.gz SWDJBOYQUCYZBC-CEXWTWQISA-N 1 1 347.459 2.823 10 5 EFBEMO CC[N@H+](CCCNC(=O)C=C(C)C)Cc1csc([N+](=O)[O-])c1 ZINC001649437295 1092460674 /nfs/dbraw/zinc/46/06/74/1092460674.db2.gz NTNRCNMKTDCZOR-UHFFFAOYSA-N 1 1 325.434 2.951 10 5 EFBEMO CC[N@@H+](CCCNC(=O)C=C(C)C)Cc1csc([N+](=O)[O-])c1 ZINC001649437295 1092460679 /nfs/dbraw/zinc/46/06/79/1092460679.db2.gz NTNRCNMKTDCZOR-UHFFFAOYSA-N 1 1 325.434 2.951 10 5 EFBEMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])cc(C)n2)C1 ZINC001585916291 1092620586 /nfs/dbraw/zinc/62/05/86/1092620586.db2.gz ACGAKCFXWFQMBB-CQSZACIVSA-N 1 1 348.447 2.929 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC001586631908 1092748909 /nfs/dbraw/zinc/74/89/09/1092748909.db2.gz WTGCCCYIGRHGNW-AAEUAGOBSA-N 1 1 339.823 2.732 10 5 EFBEMO C[NH+](C)Cc1ccc(C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)o1 ZINC001587707895 1092843336 /nfs/dbraw/zinc/84/33/36/1092843336.db2.gz JDKKPXFKNZGFCS-UHFFFAOYSA-N 1 1 331.372 2.915 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC001587990221 1092879507 /nfs/dbraw/zinc/87/95/07/1092879507.db2.gz KSVQTKBRFVZSBR-ZIAGYGMSSA-N 1 1 347.415 2.550 10 5 EFBEMO Cc1cscc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001267190981 1093140384 /nfs/dbraw/zinc/14/03/84/1093140384.db2.gz JYSJTQIXMSXVTI-UHFFFAOYSA-N 1 1 333.413 2.827 10 5 EFBEMO Cc1cscc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001267190981 1093140389 /nfs/dbraw/zinc/14/03/89/1093140389.db2.gz JYSJTQIXMSXVTI-UHFFFAOYSA-N 1 1 333.413 2.827 10 5 EFBEMO C[N@H+](CCNC(=O)CC1CC(F)(F)C1)Cc1ccccc1[N+](=O)[O-] ZINC001267202827 1093182330 /nfs/dbraw/zinc/18/23/30/1093182330.db2.gz IKPHSQOJKFZRGW-UHFFFAOYSA-N 1 1 341.358 2.578 10 5 EFBEMO C[N@@H+](CCNC(=O)CC1CC(F)(F)C1)Cc1ccccc1[N+](=O)[O-] ZINC001267202827 1093182334 /nfs/dbraw/zinc/18/23/34/1093182334.db2.gz IKPHSQOJKFZRGW-UHFFFAOYSA-N 1 1 341.358 2.578 10 5 EFBEMO Cc1cc(F)cc(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC001267218965 1093233569 /nfs/dbraw/zinc/23/35/69/1093233569.db2.gz IWYILYUZKVAORH-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO Cc1cc(F)cc(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC001267218965 1093233579 /nfs/dbraw/zinc/23/35/79/1093233579.db2.gz IWYILYUZKVAORH-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO C[C@H]1CC[C@H](C(=O)NCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001267226365 1093272657 /nfs/dbraw/zinc/27/26/57/1093272657.db2.gz GRRDKYNMSNDXRT-KOMQPUFPSA-N 1 1 333.432 2.969 10 5 EFBEMO CC[N@H+](CCNC(=O)C1C=CC=CC=C1)Cc1ccccc1[N+](=O)[O-] ZINC001267242212 1093343041 /nfs/dbraw/zinc/34/30/41/1093343041.db2.gz DUOADKPSBJCSKJ-UHFFFAOYSA-N 1 1 341.411 2.831 10 5 EFBEMO CC[N@@H+](CCNC(=O)C1C=CC=CC=C1)Cc1ccccc1[N+](=O)[O-] ZINC001267242212 1093343046 /nfs/dbraw/zinc/34/30/46/1093343046.db2.gz DUOADKPSBJCSKJ-UHFFFAOYSA-N 1 1 341.411 2.831 10 5 EFBEMO C[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC12CCCCC2 ZINC001651080079 1093524111 /nfs/dbraw/zinc/52/41/11/1093524111.db2.gz XVLYYGQSYRHQSF-UHFFFAOYSA-N 1 1 334.376 2.958 10 5 EFBEMO CC[N@@H+](Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])n[nH]2)cc1)C(C)C ZINC001595858765 1094499310 /nfs/dbraw/zinc/49/93/10/1094499310.db2.gz JBOHSXPXASVZPC-UHFFFAOYSA-N 1 1 331.376 2.801 10 5 EFBEMO CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])n[nH]2)cc1 ZINC001595859037 1094499489 /nfs/dbraw/zinc/49/94/89/1094499489.db2.gz UPTDLTLEVLCMAN-UHFFFAOYSA-N 1 1 331.376 2.802 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H]3COC[C@H]3C2)ccc1Br ZINC000690774832 1094571711 /nfs/dbraw/zinc/57/17/11/1094571711.db2.gz NQRPYXQYCUWBIN-NWDGAFQWSA-N 1 1 341.205 2.826 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H]3COC[C@H]3C2)ccc1Br ZINC000690774832 1094571717 /nfs/dbraw/zinc/57/17/17/1094571717.db2.gz NQRPYXQYCUWBIN-NWDGAFQWSA-N 1 1 341.205 2.826 10 5 EFBEMO C/C(=C\C(=O)NCCCn1cc[nH+]c1C)c1ccc([N+](=O)[O-])cc1 ZINC000785376305 1095556609 /nfs/dbraw/zinc/55/66/09/1095556609.db2.gz PYXNHFRLEBEEMY-OUKQBFOZSA-N 1 1 328.372 2.710 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ccsc1)Cc1cccc([N+](=O)[O-])c1 ZINC001480962011 1095579770 /nfs/dbraw/zinc/57/97/70/1095579770.db2.gz XBQCFFVVSYMXGI-UHFFFAOYSA-N 1 1 333.413 2.908 10 5 EFBEMO CC[N@@H+](CCNC(=O)Cc1ccc(C)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC001480970072 1095620649 /nfs/dbraw/zinc/62/06/49/1095620649.db2.gz QAPIMEGGDNKJSP-UHFFFAOYSA-N 1 1 345.399 2.677 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ccncc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001480973063 1095628931 /nfs/dbraw/zinc/62/89/31/1095628931.db2.gz BMYSZASCJIESPE-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1cc(C)co1)Cc1cccc([N+](=O)[O-])c1 ZINC001480994743 1095701690 /nfs/dbraw/zinc/70/16/90/1095701690.db2.gz SPBZXAOLTLLWIK-UHFFFAOYSA-N 1 1 331.372 2.748 10 5 EFBEMO CN(CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)CC(C)(F)F ZINC001268249129 1096175107 /nfs/dbraw/zinc/17/51/07/1096175107.db2.gz PZJQVISDBHLWOQ-UHFFFAOYSA-N 1 1 329.347 2.530 10 5 EFBEMO CN(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)CC(C)(F)F ZINC001268249129 1096175113 /nfs/dbraw/zinc/17/51/13/1096175113.db2.gz PZJQVISDBHLWOQ-UHFFFAOYSA-N 1 1 329.347 2.530 10 5 EFBEMO Cc1ccc(NC(=O)[C@@H]2CCC[N@H+]2C2CCCC2)c(N)c1[N+](=O)[O-] ZINC001603046759 1096424791 /nfs/dbraw/zinc/42/47/91/1096424791.db2.gz XMTWPAGUUPYWGU-AWEZNQCLSA-N 1 1 332.404 2.831 10 5 EFBEMO Nc1ccc(C(=O)NC[C@H]2CC[N@H+]2C2CCCCCC2)cc1[N+](=O)[O-] ZINC001648952646 1097665088 /nfs/dbraw/zinc/66/50/88/1097665088.db2.gz YXQLOKBVBOELGT-OAHLLOKOSA-N 1 1 346.431 2.704 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N[C@H]2CCc3[nH+]c[nH]c3C2)cc1C ZINC001612448882 1099057625 /nfs/dbraw/zinc/05/76/25/1099057625.db2.gz XYAUCWOHGPBMGB-NSHDSACASA-N 1 1 344.371 2.772 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N[C@H]2CCc3[nH]c[nH+]c3C2)cc1C ZINC001612448882 1099057640 /nfs/dbraw/zinc/05/76/40/1099057640.db2.gz XYAUCWOHGPBMGB-NSHDSACASA-N 1 1 344.371 2.772 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CCc3[nH+]c[nH]c3C2)cc1C ZINC001612448881 1099057978 /nfs/dbraw/zinc/05/79/78/1099057978.db2.gz XYAUCWOHGPBMGB-LLVKDONJSA-N 1 1 344.371 2.772 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CCc3[nH]c[nH+]c3C2)cc1C ZINC001612448881 1099057991 /nfs/dbraw/zinc/05/79/91/1099057991.db2.gz XYAUCWOHGPBMGB-LLVKDONJSA-N 1 1 344.371 2.772 10 5 EFBEMO C[N@H+]1CCN(c2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])CC1(C)C ZINC001612553688 1099066459 /nfs/dbraw/zinc/06/64/59/1099066459.db2.gz FMFHCMWKYIVKRH-UHFFFAOYSA-N 1 1 345.359 2.582 10 5 EFBEMO C/C(=C/C(=O)NCC[N@@H+]1CCCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000785267464 1099249405 /nfs/dbraw/zinc/24/94/05/1099249405.db2.gz RYMFTUYJZMVJQE-PLFFATQSSA-N 1 1 331.416 2.989 10 5 EFBEMO CC[C@H](CO)[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001618227458 1099286053 /nfs/dbraw/zinc/28/60/53/1099286053.db2.gz FFODMERHISPLHR-SNVBAGLBSA-N 1 1 340.767 2.501 10 5 EFBEMO CC[C@H](CO)[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001618227458 1099286059 /nfs/dbraw/zinc/28/60/59/1099286059.db2.gz FFODMERHISPLHR-SNVBAGLBSA-N 1 1 340.767 2.501 10 5 EFBEMO C[C@H]1CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C1CCCC1 ZINC001620583481 1099362398 /nfs/dbraw/zinc/36/23/98/1099362398.db2.gz MHLAQIOYBLVARL-KBXCAEBGSA-N 1 1 333.432 2.577 10 5 EFBEMO CSc1ccc(C(=O)NCC[N@H+]2CCC(C)(C)C2)cc1[N+](=O)[O-] ZINC001623332216 1099576511 /nfs/dbraw/zinc/57/65/11/1099576511.db2.gz QXPZIXPFHIFZSZ-UHFFFAOYSA-N 1 1 337.445 2.778 10 5 EFBEMO C[C@H](NC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1 ZINC001624970034 1099757052 /nfs/dbraw/zinc/75/70/52/1099757052.db2.gz NKLSDJDEZQCGIO-NSHDSACASA-N 1 1 337.807 2.557 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC001625594689 1099830448 /nfs/dbraw/zinc/83/04/48/1099830448.db2.gz PFKZDOXVMCCTHH-DGCLKSJQSA-N 1 1 337.395 2.893 10 5 EFBEMO CC[N@H+]1CCCC[C@H]1CNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001627765647 1100031531 /nfs/dbraw/zinc/03/15/31/1100031531.db2.gz YILRXYIXRXHNIJ-ZDUSSCGKSA-N 1 1 339.823 2.781 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC001627976431 1100046881 /nfs/dbraw/zinc/04/68/81/1100046881.db2.gz YTLUCTAVRNVWLC-PHIMTYICSA-N 1 1 325.796 2.803 10 5 EFBEMO CCC[N@@H+](CC)CCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC001629245295 1100186699 /nfs/dbraw/zinc/18/66/99/1100186699.db2.gz UACUQGHRXICVFD-UHFFFAOYSA-N 1 1 331.775 2.849 10 5 EFBEMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC001634687087 1100623966 /nfs/dbraw/zinc/62/39/66/1100623966.db2.gz QOIBBCMMULCIOQ-XJKSGUPXSA-N 1 1 342.399 2.563 10 5 EFBEMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC001634687083 1100623985 /nfs/dbraw/zinc/62/39/85/1100623985.db2.gz QOIBBCMMULCIOQ-CJNGLKHVSA-N 1 1 342.399 2.563 10 5 EFBEMO Nc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001635295067 1100653245 /nfs/dbraw/zinc/65/32/45/1100653245.db2.gz PJTVGUZYKFKEBL-OAHLLOKOSA-N 1 1 346.431 2.704 10 5 EFBEMO CC[N@@H+](C)[C@H]1CCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC001637912888 1100817156 /nfs/dbraw/zinc/81/71/56/1100817156.db2.gz POSZBRGXESOIFN-JTQLQIEISA-N 1 1 329.759 2.554 10 5 EFBEMO CC[N@H+]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C(C)(C)C1 ZINC001639267344 1100931580 /nfs/dbraw/zinc/93/15/80/1100931580.db2.gz WXKFQSIJVBSOEN-HNNXBMFYSA-N 1 1 342.399 2.603 10 5 EFBEMO CC[N@H+]1C[C@@H](NC(=O)c2cccc(Cl)c2[N+](=O)[O-])C(C)(C)C1 ZINC001639266954 1100931614 /nfs/dbraw/zinc/93/16/14/1100931614.db2.gz RCFMIRXHKBGWQR-GFCCVEGCSA-N 1 1 325.796 2.708 10 5 EFBEMO COCC[N@H+]1CC[C@@H](Nc2cccc(C(F)(F)F)c2[N+](=O)[O-])C1 ZINC001639488881 1100954984 /nfs/dbraw/zinc/95/49/84/1100954984.db2.gz GIZMRHVNCRYWJT-SNVBAGLBSA-N 1 1 333.310 2.746 10 5 EFBEMO C[N@@H+]1CC=C(CNc2c3cc(Cl)ccc3ncc2[N+](=O)[O-])CC1 ZINC001639696297 1100975142 /nfs/dbraw/zinc/97/51/42/1100975142.db2.gz WBCBDXXFVLWJBE-UHFFFAOYSA-N 1 1 332.791 2.892 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1Nc1ccc2[nH+]ccn2c1 ZINC001640189825 1101021407 /nfs/dbraw/zinc/02/14/07/1101021407.db2.gz OHLOHBXVTKOTDT-UHFFFAOYSA-N 1 1 326.238 2.738 10 5 EFBEMO CCOc1cc(N[C@H]2CCC[N@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-] ZINC001640396536 1101042558 /nfs/dbraw/zinc/04/25/58/1101042558.db2.gz NOVKITSFLKKNBC-DZGCQCFKSA-N 1 1 337.445 2.985 10 5 EFBEMO Cc1ncsc1CCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001642106062 1101190949 /nfs/dbraw/zinc/19/09/49/1101190949.db2.gz VLCZRSGOVSORTP-ZDUSSCGKSA-N 1 1 347.444 2.874 10 5 EFBEMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC001642843792 1101248090 /nfs/dbraw/zinc/24/80/90/1101248090.db2.gz XEWRBRAPQUKWAO-YFWYWMRJSA-N 1 1 337.379 2.781 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCCCC1)c1cc([O-])cc([N+](=O)[O-])c1 ZINC001642909064 1101254909 /nfs/dbraw/zinc/25/49/09/1101254909.db2.gz GPIRJMHFAIYJPS-HNNXBMFYSA-N 1 1 347.415 2.827 10 5 EFBEMO O=C(NC[C@@H]1CC[N@@H+]1C1CCCCCC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC001642909064 1101254913 /nfs/dbraw/zinc/25/49/13/1101254913.db2.gz GPIRJMHFAIYJPS-HNNXBMFYSA-N 1 1 347.415 2.827 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCCCC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC001642909064 1101254920 /nfs/dbraw/zinc/25/49/20/1101254920.db2.gz GPIRJMHFAIYJPS-HNNXBMFYSA-N 1 1 347.415 2.827 10 5 EFBEMO O=C(NC[C@H]1CC[N@H+]1C1CCCCCC1)c1cc([O-])cc([N+](=O)[O-])c1 ZINC001642909065 1101255051 /nfs/dbraw/zinc/25/50/51/1101255051.db2.gz GPIRJMHFAIYJPS-OAHLLOKOSA-N 1 1 347.415 2.827 10 5 EFBEMO O=C(NC[C@H]1CC[N@@H+]1C1CCCCCC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC001642909065 1101255057 /nfs/dbraw/zinc/25/50/57/1101255057.db2.gz GPIRJMHFAIYJPS-OAHLLOKOSA-N 1 1 347.415 2.827 10 5 EFBEMO O=C(NC[C@H]1CC[N@H+]1C1CCCCCC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC001642909065 1101255064 /nfs/dbraw/zinc/25/50/64/1101255064.db2.gz GPIRJMHFAIYJPS-OAHLLOKOSA-N 1 1 347.415 2.827 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N2CC[N@@H+](C)[C@@H](C(C)C)C2)cc1C ZINC001643074808 1101268445 /nfs/dbraw/zinc/26/84/45/1101268445.db2.gz IURSDBDWJONLGG-QGZVFWFLSA-N 1 1 349.431 2.856 10 5 EFBEMO NC(=O)c1cc(NC[C@H]2CC[N@H+]2C2CCCCCC2)ccc1[N+](=O)[O-] ZINC001643071686 1101268673 /nfs/dbraw/zinc/26/86/73/1101268673.db2.gz RTGFOTFRNCSFIB-OAHLLOKOSA-N 1 1 346.431 2.903 10 5 EFBEMO CC[C@@H]1COCC[N@@H+]1CCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC001643145101 1101274515 /nfs/dbraw/zinc/27/45/15/1101274515.db2.gz GUIDASGNNCYJRJ-CYBMUJFWSA-N 1 1 330.388 2.666 10 5 EFBEMO CC[C@@H]1COCC[N@H+]1CCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC001643145101 1101274521 /nfs/dbraw/zinc/27/45/21/1101274521.db2.gz GUIDASGNNCYJRJ-CYBMUJFWSA-N 1 1 330.388 2.666 10 5 EFBEMO O=[N+]([O-])c1cnc(NCc2c[nH+]c3n2CCC3)c(C(F)(F)F)c1 ZINC001643186470 1101278440 /nfs/dbraw/zinc/27/84/40/1101278440.db2.gz ARGZRGIYPZMKHD-UHFFFAOYSA-N 1 1 327.266 2.763 10 5 EFBEMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC001651384889 1101320720 /nfs/dbraw/zinc/32/07/20/1101320720.db2.gz RQERJUMFWJJVMH-HUUCEWRRSA-N 1 1 330.363 2.743 10 5 EFBEMO CCc1cc(N[C@@H]2CC[N@@H+](C)[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001651435123 1101329068 /nfs/dbraw/zinc/32/90/68/1101329068.db2.gz QOSUSOQUUWNPNP-BLLLJJGKSA-N 1 1 341.415 2.541 10 5 EFBEMO COc1cc(N2C[C@H]3C[N@@H+](C)C[C@@]3(C)C2)c(Cl)cc1[N+](=O)[O-] ZINC001651471064 1101334005 /nfs/dbraw/zinc/33/40/05/1101334005.db2.gz PVOVFGZSMSDGSG-BMIGLBTASA-N 1 1 325.796 2.645 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(NCC[N@@H+](CC)C2CC2)cc1C ZINC001651467916 1101334508 /nfs/dbraw/zinc/33/45/08/1101334508.db2.gz SNSBTBQYPQKBBX-UHFFFAOYSA-N 1 1 335.404 2.976 10 5 EFBEMO Cn1c2ccccc2c(NCC[N@H+]2CCCC2(C)C)c([N+](=O)[O-])c1=O ZINC001651936848 1101407223 /nfs/dbraw/zinc/40/72/23/1101407223.db2.gz ZYGOOCJQOFPGGT-UHFFFAOYSA-N 1 1 344.415 2.733 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CC[N@@H+]3C[C@@H](F)C[C@H]3C2)cc1C(F)(F)F ZINC001652300078 1101471285 /nfs/dbraw/zinc/47/12/85/1101471285.db2.gz LSPGYOXBEBUPFY-ONGXEEELSA-N 1 1 333.285 2.846 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CC[N@H+]3C[C@@H](F)C[C@H]3C2)cc1C(F)(F)F ZINC001652300078 1101471286 /nfs/dbraw/zinc/47/12/86/1101471286.db2.gz LSPGYOXBEBUPFY-ONGXEEELSA-N 1 1 333.285 2.846 10 5 EFBEMO COC(=O)[C@H](C)C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001652424222 1101487515 /nfs/dbraw/zinc/48/75/15/1101487515.db2.gz SFZLCZQVVHTQIB-CYBMUJFWSA-N 1 1 336.388 2.637 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1C[N@@H+](C)CC1(C)C ZINC001652491554 1101501018 /nfs/dbraw/zinc/50/10/18/1101501018.db2.gz LJNVOVJUBVARBK-ZBFHGGJFSA-N 1 1 333.432 2.620 10 5 EFBEMO O=C(CC[N@H+]1CC[C@@H]2[C@H](C1)C2(F)F)Nc1ccccc1[N+](=O)[O-] ZINC001653830287 1101653157 /nfs/dbraw/zinc/65/31/57/1101653157.db2.gz LRRMMRJBEQGHPB-MNOVXSKESA-N 1 1 325.315 2.510 10 5 EFBEMO C[C@@H](CN1CCOCC1)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001654011911 1101669633 /nfs/dbraw/zinc/66/96/33/1101669633.db2.gz YHNPYIXAYSVZDZ-HNNXBMFYSA-N 1 1 333.432 2.528 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccc(CF)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001266365295 1101738279 /nfs/dbraw/zinc/73/82/79/1101738279.db2.gz VIKHTTMFJOLCSY-UHFFFAOYSA-N 1 1 345.374 2.926 10 5 EFBEMO C[C@@H]1CN(c2ccc(C(F)(F)F)cc2)C[C@H](C)[N@H+]1CC[N+](=O)[O-] ZINC001654614275 1101738961 /nfs/dbraw/zinc/73/89/61/1101738961.db2.gz BUMIAUDESDQBGU-TXEJJXNPSA-N 1 1 331.338 2.881 10 5 EFBEMO C[C@@H]1CN(c2ccc(C(F)(F)F)cc2)C[C@H](C)[N@@H+]1CC[N+](=O)[O-] ZINC001654614275 1101738971 /nfs/dbraw/zinc/73/89/71/1101738971.db2.gz BUMIAUDESDQBGU-TXEJJXNPSA-N 1 1 331.338 2.881 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCC[N@H+]1CCC[C@@H](C)C1 ZINC001654973281 1101774010 /nfs/dbraw/zinc/77/40/10/1101774010.db2.gz SNXJVWQUCJQORB-GFCCVEGCSA-N 1 1 335.404 2.834 10 5 EFBEMO CN(C)CC[N@@H+](C)CCCN(C)c1ccc([N+](=O)[O-])cc1C(F)F ZINC001655542513 1101843433 /nfs/dbraw/zinc/84/34/33/1101843433.db2.gz GPDATUSAVIETIN-UHFFFAOYSA-N 1 1 344.406 2.852 10 5 EFBEMO CN(CCCN(C)c1ccc([N+](=O)[O-])cc1C(F)F)CC[NH+](C)C ZINC001655542513 1101843451 /nfs/dbraw/zinc/84/34/51/1101843451.db2.gz GPDATUSAVIETIN-UHFFFAOYSA-N 1 1 344.406 2.852 10 5 EFBEMO CN(C)CC[N@@H+](C)CCCNc1cccc(C(F)(F)F)c1[N+](=O)[O-] ZINC001655540013 1101843667 /nfs/dbraw/zinc/84/36/67/1101843667.db2.gz MMVLJDLCOYJEJC-UHFFFAOYSA-N 1 1 348.369 2.909 10 5 EFBEMO CN(CCCNc1cccc(C(F)(F)F)c1[N+](=O)[O-])CC[NH+](C)C ZINC001655540013 1101843687 /nfs/dbraw/zinc/84/36/87/1101843687.db2.gz MMVLJDLCOYJEJC-UHFFFAOYSA-N 1 1 348.369 2.909 10 5 EFBEMO COc1ccc2ncc([N+](=O)[O-])c(NCC[C@@H]3CCC[N@@H+](C)C3)c2c1 ZINC001655553870 1101846949 /nfs/dbraw/zinc/84/69/49/1101846949.db2.gz XSKZZIUXINWFLQ-ZDUSSCGKSA-N 1 1 344.415 2.717 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+]2C[C@@H](F)C[C@H]2C1 ZINC001655799473 1101891709 /nfs/dbraw/zinc/89/17/09/1101891709.db2.gz BUYVLPFCYUSRDX-HOCLYGCPSA-N 1 1 337.395 2.610 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@H+]2C[C@@H](F)C[C@H]2C1 ZINC001655799473 1101891725 /nfs/dbraw/zinc/89/17/25/1101891725.db2.gz BUYVLPFCYUSRDX-HOCLYGCPSA-N 1 1 337.395 2.610 10 5 EFBEMO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@H]2Cc2ccc(O)cc2)n1 ZINC001655853706 1101900819 /nfs/dbraw/zinc/90/08/19/1101900819.db2.gz VAZCIBOLVYHLJX-HNNXBMFYSA-N 1 1 330.388 2.594 10 5 EFBEMO CC1(C)CC[N@@H+](CCNc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC001655941156 1101913705 /nfs/dbraw/zinc/91/37/05/1101913705.db2.gz ZLUNORUDGDHMHY-UHFFFAOYSA-N 1 1 346.431 2.631 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1cc(C)[nH]c1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001266420797 1101972905 /nfs/dbraw/zinc/97/29/05/1101972905.db2.gz OBDQWTPOIOIWSA-UHFFFAOYSA-N 1 1 344.415 2.792 10 5 EFBEMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCC[C@@H]1Cc1ccc(O)cc1 ZINC001656470460 1102102257 /nfs/dbraw/zinc/10/22/57/1102102257.db2.gz ZNPQLEAXHKNCCD-MRXNPFEDSA-N 1 1 344.415 2.903 10 5 EFBEMO C[C@@H]1CC[C@](CO)([NH2+]Cc2cccnc2[N+](=O)[O-])c2ccccc21 ZINC001656512456 1102111566 /nfs/dbraw/zinc/11/15/66/1102111566.db2.gz XFIRACAGPWWCTL-FZKQIMNGSA-N 1 1 327.384 2.865 10 5 EFBEMO O=[N+]([O-])c1cccc(N2CC[NH+](CCCOC(F)(F)F)CC2)c1 ZINC001656976673 1102277147 /nfs/dbraw/zinc/27/71/47/1102277147.db2.gz JKOHGXHRAQHVRP-UHFFFAOYSA-N 1 1 333.310 2.643 10 5 EFBEMO CCC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc([N+](=O)[O-])cc1 ZINC001271720868 1102313990 /nfs/dbraw/zinc/31/39/90/1102313990.db2.gz GREPEDNQWSNFCP-ACHSLPGTSA-N 1 1 331.416 2.864 10 5 EFBEMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](c2ccccc2)[C@H](C(N)=O)C1 ZINC001659013366 1102507228 /nfs/dbraw/zinc/50/72/28/1102507228.db2.gz YLSZCMZBHDJCKW-RRQGHBQHSA-N 1 1 339.395 2.857 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](c2nnc(N)o2)C1 ZINC001659612851 1102553305 /nfs/dbraw/zinc/55/33/05/1102553305.db2.gz RCBGFVWFGYVBLD-NWDGAFQWSA-N 1 1 331.376 2.809 10 5 EFBEMO C[N@@H+](CCCNC(=O)/C=C\c1ccc[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC001660113677 1102604162 /nfs/dbraw/zinc/60/41/62/1102604162.db2.gz ULUFPXYOEJQJPR-KTKRTIGZSA-N 1 1 342.399 2.574 10 5 EFBEMO C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cc2ccccc2s1 ZINC001660138691 1102612902 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Cc1ccc(C)c([C@H]2C[N@@H+](CCn3cc([N+](=O)[O-])cn3)[C@H](C)CO2)c1 ZINC000174876764 207067333 /nfs/dbraw/zinc/06/73/33/207067333.db2.gz NORMMGUEFCEZPS-CRAIPNDOSA-N 1 1 344.415 2.870 10 5 EFBEMO O=[N+]([O-])c1cccc(C[N@@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c1 ZINC000449420659 251022608 /nfs/dbraw/zinc/02/26/08/251022608.db2.gz JZARQFDWADVHIQ-MSOLQXFVSA-N 1 1 330.359 2.895 10 5 EFBEMO O=[N+]([O-])c1cccc(C[N@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c1 ZINC000449420659 251022610 /nfs/dbraw/zinc/02/26/10/251022610.db2.gz JZARQFDWADVHIQ-MSOLQXFVSA-N 1 1 330.359 2.895 10 5 EFBEMO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000449430734 251024902 /nfs/dbraw/zinc/02/49/02/251024902.db2.gz WNMYGEJNYMIETO-YOEHRIQHSA-N 1 1 344.415 2.588 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1 ZINC000174981363 207078450 /nfs/dbraw/zinc/07/84/50/207078450.db2.gz DZSGQXSWLHAIIJ-CABCVRRESA-N 1 1 331.416 2.991 10 5 EFBEMO CCc1ncc(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)o1 ZINC000449609337 251082014 /nfs/dbraw/zinc/08/20/14/251082014.db2.gz MXDSXCVELDLGRF-UHFFFAOYSA-N 1 1 341.371 2.836 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@H]([C@H](O)C(F)(F)F)C1 ZINC000449664800 251105706 /nfs/dbraw/zinc/10/57/06/251105706.db2.gz BURDROUXXOPMPM-FLBZCCBISA-N 1 1 330.306 2.853 10 5 EFBEMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2)c1 ZINC000267629991 251207396 /nfs/dbraw/zinc/20/73/96/251207396.db2.gz GKUVEFSAVSOEPJ-DLBZAZTESA-N 1 1 348.378 2.519 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000176244950 207206362 /nfs/dbraw/zinc/20/63/62/207206362.db2.gz GJJFHBLQEIKTKQ-CYBMUJFWSA-N 1 1 336.392 2.551 10 5 EFBEMO C[N@@H+](CC1CC1)C[C@H]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000450363090 251359903 /nfs/dbraw/zinc/35/99/03/251359903.db2.gz HXIJLUQAPFMOOD-CYBMUJFWSA-N 1 1 329.404 2.639 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N2CC[N@H+]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000176726264 207254640 /nfs/dbraw/zinc/25/46/40/207254640.db2.gz HMQQBLBIRRUDHL-GOEBONIOSA-N 1 1 346.431 2.844 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000177026441 207286446 /nfs/dbraw/zinc/28/64/46/207286446.db2.gz MXZMOLXGHQMAPE-AWEZNQCLSA-N 1 1 337.445 2.630 10 5 EFBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000177138079 207298837 /nfs/dbraw/zinc/29/88/37/207298837.db2.gz KWCDCNKUUDHFJU-ZDUSSCGKSA-N 1 1 332.335 2.544 10 5 EFBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000177216580 207308558 /nfs/dbraw/zinc/30/85/58/207308558.db2.gz CAVDHKHYTBASBZ-HNNXBMFYSA-N 1 1 328.372 2.713 10 5 EFBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000177162353 207300486 /nfs/dbraw/zinc/30/04/86/207300486.db2.gz HWVWRNZXUPVXRJ-RCMYXZNBSA-N 1 1 340.383 2.804 10 5 EFBEMO Cc1sc(C(=O)N2CCC[C@@H]2Cn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000177195373 207304405 /nfs/dbraw/zinc/30/44/05/207304405.db2.gz KLZFHMOJNKAOAY-GFCCVEGCSA-N 1 1 334.401 2.774 10 5 EFBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000177196810 207305410 /nfs/dbraw/zinc/30/54/10/207305410.db2.gz BUJLBMMSBQUHBZ-HNNXBMFYSA-N 1 1 328.372 2.713 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177496985 207343654 /nfs/dbraw/zinc/34/36/54/207343654.db2.gz MNBZOCTXUZDPQX-UKRRQHHQSA-N 1 1 332.404 2.994 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN(Cc2cnn(C)c2)CC1 ZINC000105869499 141355565 /nfs/dbraw/zinc/35/55/65/141355565.db2.gz VLJITANVFOHIJG-HNNXBMFYSA-N 1 1 343.431 2.597 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[N@H+](Cc2cnn(C)c2)CC1 ZINC000105869499 141355567 /nfs/dbraw/zinc/35/55/67/141355567.db2.gz VLJITANVFOHIJG-HNNXBMFYSA-N 1 1 343.431 2.597 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[N@@H+](Cc2cnn(C)c2)CC1 ZINC000105869499 141355569 /nfs/dbraw/zinc/35/55/69/141355569.db2.gz VLJITANVFOHIJG-HNNXBMFYSA-N 1 1 343.431 2.597 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)C[C@H]1CCCO1 ZINC000245382702 141383257 /nfs/dbraw/zinc/38/32/57/141383257.db2.gz KSLIWDLEPLTNIL-ZYHUDNBSSA-N 1 1 341.795 2.686 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@H]1CCCO1 ZINC000245382702 141383259 /nfs/dbraw/zinc/38/32/59/141383259.db2.gz KSLIWDLEPLTNIL-ZYHUDNBSSA-N 1 1 341.795 2.686 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCCN1CCOCC1 ZINC000344843219 142086800 /nfs/dbraw/zinc/08/68/00/142086800.db2.gz FMXVGRWEPPYELM-DTQAZKPQSA-N 1 1 333.432 2.700 10 5 EFBEMO C[N@@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1ccc(Cl)cc1 ZINC000341173506 145005992 /nfs/dbraw/zinc/00/59/92/145005992.db2.gz VDBCZEYTGSJXOB-SWLSCSKDSA-N 1 1 348.790 2.752 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1ccc(Cl)cc1 ZINC000341173506 145005994 /nfs/dbraw/zinc/00/59/94/145005994.db2.gz VDBCZEYTGSJXOB-SWLSCSKDSA-N 1 1 348.790 2.752 10 5 EFBEMO COc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000342281068 145092783 /nfs/dbraw/zinc/09/27/83/145092783.db2.gz MGHZFNHWVHFXSX-LBPRGKRZSA-N 1 1 329.356 2.893 10 5 EFBEMO Cc1ccc2nc(C[NH2+][C@@H](C)c3ccccc3[N+](=O)[O-])cc(=O)n2c1 ZINC000342288660 145093972 /nfs/dbraw/zinc/09/39/72/145093972.db2.gz ZKFBXZNCILVOJC-ZDUSSCGKSA-N 1 1 338.367 2.762 10 5 EFBEMO COc1cccc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000342310111 145097992 /nfs/dbraw/zinc/09/79/92/145097992.db2.gz VLLIRHSANMZOCA-LBPRGKRZSA-N 1 1 329.356 2.893 10 5 EFBEMO COC[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000342320649 145100411 /nfs/dbraw/zinc/10/04/11/145100411.db2.gz OCWFAPLSQHLUQT-OAHLLOKOSA-N 1 1 347.346 2.650 10 5 EFBEMO COCC[C@@H]1CCCC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000342705812 145176358 /nfs/dbraw/zinc/17/63/58/145176358.db2.gz UXMACBNTRSVQCX-HNNXBMFYSA-N 1 1 349.431 2.980 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)[C@H](C)C1 ZINC000342936588 145225065 /nfs/dbraw/zinc/22/50/65/145225065.db2.gz XTFWKUAYHYQFAE-IUODEOHRSA-N 1 1 344.415 2.878 10 5 EFBEMO CN(C)c1cc(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc[nH+]1 ZINC000343691363 145272358 /nfs/dbraw/zinc/27/23/58/145272358.db2.gz UCLMLIHKSYDDFO-UHFFFAOYSA-N 1 1 336.298 2.515 10 5 EFBEMO C[N@@H+](C[C@@H]1CC=CCC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000344033869 145350911 /nfs/dbraw/zinc/35/09/11/145350911.db2.gz FZGXFZZNIHYTAW-RHSMWYFYSA-N 1 1 329.400 2.988 10 5 EFBEMO CCOc1ccc(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000347293089 145833283 /nfs/dbraw/zinc/83/32/83/145833283.db2.gz SMEHMILVDYTVJY-OAHLLOKOSA-N 1 1 347.415 2.740 10 5 EFBEMO COc1cc(CN2CCC(C[NH+]3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000351970857 146251877 /nfs/dbraw/zinc/25/18/77/146251877.db2.gz KRMHPRVMLIYPPV-UHFFFAOYSA-N 1 1 333.432 2.911 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[NH2+][C@@H](CO)c2ccsc2)cccc1[N+](=O)[O-] ZINC000352033092 146271784 /nfs/dbraw/zinc/27/17/84/146271784.db2.gz QJUZJBSSIJWMAK-RISCZKNCSA-N 1 1 349.412 2.615 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@H](C)[C@H]1C ZINC000355780552 147060748 /nfs/dbraw/zinc/06/07/48/147060748.db2.gz ANHUHAJMJYKTFG-FRRDWIJNSA-N 1 1 335.404 2.908 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)Cc1cnc(N(C)C)nc1 ZINC000356197022 147173297 /nfs/dbraw/zinc/17/32/97/147173297.db2.gz CNFCPDDKOFIWRI-ZDUSSCGKSA-N 1 1 329.404 2.952 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1cnc(N(C)C)nc1 ZINC000356197022 147173298 /nfs/dbraw/zinc/17/32/98/147173298.db2.gz CNFCPDDKOFIWRI-ZDUSSCGKSA-N 1 1 329.404 2.952 10 5 EFBEMO CCNc1ccc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000356282258 147199441 /nfs/dbraw/zinc/19/94/41/147199441.db2.gz PPGODZIZBPHTOG-JSGCOSHPSA-N 1 1 334.420 2.581 10 5 EFBEMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000356809305 147341786 /nfs/dbraw/zinc/34/17/86/147341786.db2.gz OLPUAWHOORHIPX-JTQLQIEISA-N 1 1 345.346 2.655 10 5 EFBEMO O=[N+]([O-])c1cnc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)nc1 ZINC000363910176 149030168 /nfs/dbraw/zinc/03/01/68/149030168.db2.gz PWLQHWMRLYEEKV-HYVNUMGLSA-N 1 1 339.399 2.707 10 5 EFBEMO O=[N+]([O-])c1cnc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)nc1 ZINC000363910177 149030481 /nfs/dbraw/zinc/03/04/81/149030481.db2.gz PWLQHWMRLYEEKV-USXIJHARSA-N 1 1 339.399 2.707 10 5 EFBEMO COc1ccc(C[N@H+]2CCC[C@@H](c3ccncn3)C2)cc1[N+](=O)[O-] ZINC000364358175 149134686 /nfs/dbraw/zinc/13/46/86/149134686.db2.gz JFGDZFPAEUCKPR-CQSZACIVSA-N 1 1 328.372 2.773 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H]2CCCC[C@H]21 ZINC000367987862 150003243 /nfs/dbraw/zinc/00/32/43/150003243.db2.gz PRHHIFXGXGHUMO-IUODEOHRSA-N 1 1 333.388 2.806 10 5 EFBEMO CCOc1ccc([C@H](C)[NH2+][C@H]2CCc3[nH]cnc3C2)cc1[N+](=O)[O-] ZINC000368102909 150038487 /nfs/dbraw/zinc/03/84/87/150038487.db2.gz QRDHMUAJKIXCGT-AAEUAGOBSA-N 1 1 330.388 2.925 10 5 EFBEMO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCc3[nH]cnc3C2)cc1[N+](=O)[O-] ZINC000368102912 150039094 /nfs/dbraw/zinc/03/90/94/150039094.db2.gz QRDHMUAJKIXCGT-YPMHNXCESA-N 1 1 330.388 2.925 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000372482909 151014981 /nfs/dbraw/zinc/01/49/81/151014981.db2.gz QYHVLVVEGRCJJV-UHFFFAOYSA-N 1 1 328.372 2.885 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000373475761 151176752 /nfs/dbraw/zinc/17/67/52/151176752.db2.gz NFKFXULZTKRCMA-UHFFFAOYSA-N 1 1 328.372 2.506 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)CC1 ZINC000373593834 151195705 /nfs/dbraw/zinc/19/57/05/151195705.db2.gz OEZJOIKUQGVXKI-UHFFFAOYSA-N 1 1 328.372 2.885 10 5 EFBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(c2c[nH]cn2)CC1 ZINC000374213796 151302519 /nfs/dbraw/zinc/30/25/19/151302519.db2.gz WCDDHKDQZVIPQR-LBPRGKRZSA-N 1 1 343.387 2.525 10 5 EFBEMO C[C@@H]1[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CC(=O)N1Cc1ccccc1 ZINC000374279951 151313820 /nfs/dbraw/zinc/31/38/20/151313820.db2.gz MLKFWKAZLZCHQR-IUODEOHRSA-N 1 1 345.424 2.936 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21 ZINC000185024815 265032739 /nfs/dbraw/zinc/03/27/39/265032739.db2.gz XZQYDSGGFOGGMU-UZICZHQRSA-N 1 1 343.427 2.941 10 5 EFBEMO C[C@H]1C(=O)NCCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000189076349 265171307 /nfs/dbraw/zinc/17/13/07/265171307.db2.gz UJQAFSMWXJAJQN-LBPRGKRZSA-N 1 1 329.356 2.565 10 5 EFBEMO C[C@H]1C(=O)NCCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000189076349 265171308 /nfs/dbraw/zinc/17/13/08/265171308.db2.gz UJQAFSMWXJAJQN-LBPRGKRZSA-N 1 1 329.356 2.565 10 5 EFBEMO C[C@@H]1C[C@H](N(C)C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000272158161 266171366 /nfs/dbraw/zinc/17/13/66/266171366.db2.gz DQWIPVKBHMVYGZ-BXUZGUMPSA-N 1 1 341.358 2.628 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000272324134 266229581 /nfs/dbraw/zinc/22/95/81/266229581.db2.gz LPPKSHIEMZCTFT-ZBFHGGJFSA-N 1 1 349.431 2.571 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000272324134 266229584 /nfs/dbraw/zinc/22/95/84/266229584.db2.gz LPPKSHIEMZCTFT-ZBFHGGJFSA-N 1 1 349.431 2.571 10 5 EFBEMO C[C@@H]1C[N@H+](CCCCNc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H](C)O1 ZINC000277356413 267162562 /nfs/dbraw/zinc/16/25/62/267162562.db2.gz ARIDUMMIOIBQMH-BETUJISGSA-N 1 1 347.419 2.772 10 5 EFBEMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000277556837 267197259 /nfs/dbraw/zinc/19/72/59/267197259.db2.gz OWJVCGKKGQOBKK-AWEZNQCLSA-N 1 1 342.399 2.823 10 5 EFBEMO COc1cc(NCCC[N@H+]2CCCO[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000277745949 267251568 /nfs/dbraw/zinc/25/15/68/267251568.db2.gz UQJTYIIDMDDZRB-LBPRGKRZSA-N 1 1 341.383 2.655 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[NH+](C2CCC2)CC1 ZINC000277855547 267281232 /nfs/dbraw/zinc/28/12/32/267281232.db2.gz AOQVLYRKDBLUJH-UHFFFAOYSA-N 1 1 337.807 2.867 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000277988744 267315346 /nfs/dbraw/zinc/31/53/46/267315346.db2.gz NARCOAAHMMKYMW-LBPRGKRZSA-N 1 1 339.823 2.970 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H](c3nccs3)C2)c1 ZINC000137016082 273019255 /nfs/dbraw/zinc/01/92/55/273019255.db2.gz NWEOYSZXZJXPEG-DZGCQCFKSA-N 1 1 333.413 2.964 10 5 EFBEMO COc1cc(C[N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1 ZINC000269662342 273087541 /nfs/dbraw/zinc/08/75/41/273087541.db2.gz KGZLLXIPUPIIHE-GOSISDBHSA-N 1 1 346.383 2.777 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)NCCc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000269738837 273089837 /nfs/dbraw/zinc/08/98/37/273089837.db2.gz YDCSEDLIEWFXJL-HOCLYGCPSA-N 1 1 348.447 2.509 10 5 EFBEMO O=C1C[C@]2(CC[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)CN1 ZINC000279467431 273218509 /nfs/dbraw/zinc/21/85/09/273218509.db2.gz RVFUWMXFNNISCY-GOSISDBHSA-N 1 1 341.367 2.567 10 5 EFBEMO CC1(C)C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C[C@]2(CCOC2)O1 ZINC000280310752 273314179 /nfs/dbraw/zinc/31/41/79/273314179.db2.gz PNMHPIAKPDWCGP-FZMUQLTDSA-N 1 1 332.400 2.878 10 5 EFBEMO CC1(C)C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C[C@]2(CCOC2)O1 ZINC000280310752 273314181 /nfs/dbraw/zinc/31/41/81/273314181.db2.gz PNMHPIAKPDWCGP-FZMUQLTDSA-N 1 1 332.400 2.878 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@]1(CO)CCOc2ccccc21 ZINC000282391935 273555585 /nfs/dbraw/zinc/55/55/85/273555585.db2.gz PBOWFFUSYSWQRL-SFHVURJKSA-N 1 1 328.368 2.663 10 5 EFBEMO COC(=O)c1cc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc(C)c1[N+](=O)[O-] ZINC000268841193 274000136 /nfs/dbraw/zinc/00/01/36/274000136.db2.gz OPJMSHJGPLBHFJ-XJKSGUPXSA-N 1 1 347.415 2.610 10 5 EFBEMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000355789560 274399385 /nfs/dbraw/zinc/39/93/85/274399385.db2.gz XIEGERBGVNEKTO-RDBSUJKOSA-N 1 1 331.416 2.850 10 5 EFBEMO CC[N@@H+]1CCO[C@H](C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000356729782 276393115 /nfs/dbraw/zinc/39/31/15/276393115.db2.gz GNUPJBKUBFCURJ-HNNXBMFYSA-N 1 1 335.404 2.552 10 5 EFBEMO CC[N@H+]1CCO[C@H](C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000356729782 276393116 /nfs/dbraw/zinc/39/31/16/276393116.db2.gz GNUPJBKUBFCURJ-HNNXBMFYSA-N 1 1 335.404 2.552 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@@]3(CCOC3)C2)c([N+](=O)[O-])cc1OC ZINC000449688200 277376797 /nfs/dbraw/zinc/37/67/97/277376797.db2.gz SZJQNNNITCDYLU-QGZVFWFLSA-N 1 1 336.388 2.615 10 5 EFBEMO C[C@@H]([NH2+]CC(=O)Nc1nc2c(s1)CCC2)c1cccc([N+](=O)[O-])c1 ZINC000341569669 278338766 /nfs/dbraw/zinc/33/87/66/278338766.db2.gz CTZTWJHCDNCMQT-SNVBAGLBSA-N 1 1 346.412 2.829 10 5 EFBEMO O=C([C@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1)N1CCCC1 ZINC000353564679 280130974 /nfs/dbraw/zinc/13/09/74/280130974.db2.gz DJUBUSYGYQFYKA-JZLODUJNSA-N 1 1 343.427 2.942 10 5 EFBEMO C[C@@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000408026539 288297669 /nfs/dbraw/zinc/29/76/69/288297669.db2.gz YRRLMNGKEVYHGE-OLZOCXBDSA-N 1 1 342.399 2.775 10 5 EFBEMO CN(CC1CC1)c1ccc([N+](=O)[O-])c(NC(=O)C[N@@H+](C)CC2CC2)c1 ZINC000128238357 293096234 /nfs/dbraw/zinc/09/62/34/293096234.db2.gz KZOWIELCNFBBMG-UHFFFAOYSA-N 1 1 346.431 2.721 10 5 EFBEMO CNC(=O)c1ccc(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000153274706 293368546 /nfs/dbraw/zinc/36/85/46/293368546.db2.gz AUZBJTBODCHLOE-UHFFFAOYSA-N 1 1 325.368 2.513 10 5 EFBEMO CNC(=O)c1ccc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000153274706 293368549 /nfs/dbraw/zinc/36/85/49/293368549.db2.gz AUZBJTBODCHLOE-UHFFFAOYSA-N 1 1 325.368 2.513 10 5 EFBEMO O=c1c([N+](=O)[O-])cc(Cl)cn1Cc1[nH+]ccn1Cc1ccccc1 ZINC000158688575 293581736 /nfs/dbraw/zinc/58/17/36/293581736.db2.gz GZKIOSMEHPKXAK-UHFFFAOYSA-N 1 1 344.758 2.703 10 5 EFBEMO Cc1sc(C(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000293773344 295046441 /nfs/dbraw/zinc/04/64/41/295046441.db2.gz VKMDLJAJZXGQLS-LLVKDONJSA-N 1 1 337.445 2.911 10 5 EFBEMO CN(C(=O)CCC(C)(C)[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000294788411 295227737 /nfs/dbraw/zinc/22/77/37/295227737.db2.gz APJUNOPPOAYOKY-INIZCTEOSA-N 1 1 333.432 2.555 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000298754235 311020926 /nfs/dbraw/zinc/02/09/26/311020926.db2.gz PJNUVPRXQFRVPG-LBPRGKRZSA-N 1 1 331.372 2.945 10 5 EFBEMO COC(=O)c1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)nc1 ZINC000299105737 311051370 /nfs/dbraw/zinc/05/13/70/311051370.db2.gz VBYWGNUTZOKPNY-GFCCVEGCSA-N 1 1 329.356 2.936 10 5 EFBEMO C[N@@H+](CCO)C1(CNc2ccc([N+](=O)[O-])cc2F)CCCCC1 ZINC000301261351 311127854 /nfs/dbraw/zinc/12/78/54/311127854.db2.gz GXVCYJUHQZSUFS-UHFFFAOYSA-N 1 1 325.384 2.773 10 5 EFBEMO C[N@@H+](CCO)C1(CNc2ncc([N+](=O)[O-])cc2Cl)CCCCC1 ZINC000301281903 311128840 /nfs/dbraw/zinc/12/88/40/311128840.db2.gz OONOKKDRXYLZGE-UHFFFAOYSA-N 1 1 342.827 2.682 10 5 EFBEMO COCc1cc([N+](=O)[O-])ccc1N1C[C@@H]2C[N@H+]3CCCC[C@@H]3[C@H]2C1 ZINC000301472611 311139066 /nfs/dbraw/zinc/13/90/66/311139066.db2.gz LCHVRYNNILLLKV-QILLFSRXSA-N 1 1 331.416 2.662 10 5 EFBEMO CC[C@@H]1CCCC[N@H+]1CCNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000301630850 311148667 /nfs/dbraw/zinc/14/86/67/311148667.db2.gz BKJWQXULLLFYJL-GFCCVEGCSA-N 1 1 348.403 2.602 10 5 EFBEMO CC[N@H+]1CCCC[C@H]1CNc1cc(C)c([N+](=O)[O-])c(C(=O)OC)c1 ZINC000301703426 311153699 /nfs/dbraw/zinc/15/36/99/311153699.db2.gz UPNFTAIGQNVCBK-AWEZNQCLSA-N 1 1 335.404 2.976 10 5 EFBEMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC000301868840 311163852 /nfs/dbraw/zinc/16/38/52/311163852.db2.gz CFAIYXQFBUDYQK-OKILXGFUSA-N 1 1 346.435 2.808 10 5 EFBEMO Cc1cc(NC[C@@H](C)[N@@H+]2CCOC[C@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000302003726 311171397 /nfs/dbraw/zinc/17/13/97/311171397.db2.gz JZRZCMUTBQAINZ-ZIAGYGMSSA-N 1 1 344.415 2.973 10 5 EFBEMO Cc1cc(NC[C@@H](C)[N@H+]2CCOC[C@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000302003726 311171399 /nfs/dbraw/zinc/17/13/99/311171399.db2.gz JZRZCMUTBQAINZ-ZIAGYGMSSA-N 1 1 344.415 2.973 10 5 EFBEMO Cc1cc(NC[C@@H](C)[NH+]2CCOCC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302015223 311172159 /nfs/dbraw/zinc/17/21/59/311172159.db2.gz LLZXJXAJRHTLEU-CYBMUJFWSA-N 1 1 330.388 2.584 10 5 EFBEMO C[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cn2)[C@@H]1c1ccc(Cl)cc1 ZINC000302245530 311187043 /nfs/dbraw/zinc/18/70/43/311187043.db2.gz ZZNCJZSZTCMFCA-KBPBESRZSA-N 1 1 333.779 2.896 10 5 EFBEMO C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cn2)[C@@H]1c1ccc(Cl)cc1 ZINC000302245530 311187045 /nfs/dbraw/zinc/18/70/45/311187045.db2.gz ZZNCJZSZTCMFCA-KBPBESRZSA-N 1 1 333.779 2.896 10 5 EFBEMO O=[N+]([O-])c1cnc(NCC[N@@H+]2CCc3c(Cl)cccc3C2)nc1 ZINC000302668956 311195730 /nfs/dbraw/zinc/19/57/30/311195730.db2.gz NIMGPUBYNZNQTM-UHFFFAOYSA-N 1 1 333.779 2.508 10 5 EFBEMO O=[N+]([O-])c1cnc(NCC[N@H+]2CCc3c(Cl)cccc3C2)nc1 ZINC000302668956 311195731 /nfs/dbraw/zinc/19/57/31/311195731.db2.gz NIMGPUBYNZNQTM-UHFFFAOYSA-N 1 1 333.779 2.508 10 5 EFBEMO CC[C@@H]1CN(c2c(C)cc([N+](=O)[O-])cc2Cl)CC[N@@H+]1C[C@@H](C)O ZINC000302688713 311196625 /nfs/dbraw/zinc/19/66/25/311196625.db2.gz RCGGTLPKMPCNKY-CHWSQXEVSA-N 1 1 341.839 2.838 10 5 EFBEMO CC[C@@H]1CN(c2c(C)cc([N+](=O)[O-])cc2Cl)CC[N@H+]1C[C@@H](C)O ZINC000302688713 311196627 /nfs/dbraw/zinc/19/66/27/311196627.db2.gz RCGGTLPKMPCNKY-CHWSQXEVSA-N 1 1 341.839 2.838 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H](O)COc1ccc(F)cc1)C2 ZINC000305473287 311223364 /nfs/dbraw/zinc/22/33/64/311223364.db2.gz YSKKWFOYBUSADP-HNNXBMFYSA-N 1 1 346.358 2.532 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)COc1ccc(F)cc1)C2 ZINC000305473287 311223366 /nfs/dbraw/zinc/22/33/66/311223366.db2.gz YSKKWFOYBUSADP-HNNXBMFYSA-N 1 1 346.358 2.532 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000330718606 311330958 /nfs/dbraw/zinc/33/09/58/311330958.db2.gz WBBCKNPSMXDVLS-DAXOMENPSA-N 1 1 349.431 2.651 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000330718606 311330959 /nfs/dbraw/zinc/33/09/59/311330959.db2.gz WBBCKNPSMXDVLS-DAXOMENPSA-N 1 1 349.431 2.651 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000330836432 311337693 /nfs/dbraw/zinc/33/76/93/311337693.db2.gz IFEWZNMBJYFZJL-ZBFHGGJFSA-N 1 1 349.431 2.571 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000330836432 311337696 /nfs/dbraw/zinc/33/76/96/311337696.db2.gz IFEWZNMBJYFZJL-ZBFHGGJFSA-N 1 1 349.431 2.571 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)C[C@H]1C(C)C ZINC000331258189 311363314 /nfs/dbraw/zinc/36/33/14/311363314.db2.gz FHOJJIQHWGVHPU-AWEZNQCLSA-N 1 1 339.823 2.969 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C)C[C@H]1C(C)C ZINC000331258189 311363316 /nfs/dbraw/zinc/36/33/16/311363316.db2.gz FHOJJIQHWGVHPU-AWEZNQCLSA-N 1 1 339.823 2.969 10 5 EFBEMO CC[C@H]([NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(=O)NC ZINC000453421328 312902288 /nfs/dbraw/zinc/90/22/88/312902288.db2.gz WMWPHNKLQMXGGX-IRXDYDNUSA-N 1 1 327.384 2.798 10 5 EFBEMO Cc1ccc([C@@H](C)NC(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000493253043 314292798 /nfs/dbraw/zinc/29/27/98/314292798.db2.gz JGDWRGKDYAHDEK-CZUORRHYSA-N 1 1 346.431 2.842 10 5 EFBEMO COc1ccc(C[NH2+][C@@H](c2ccccc2F)[C@@H](C)O)cc1[N+](=O)[O-] ZINC000518989586 315838868 /nfs/dbraw/zinc/83/88/68/315838868.db2.gz VDWZLKSXMIUNNQ-PIGZYNQJSA-N 1 1 334.347 2.954 10 5 EFBEMO CCOC(=O)c1c[nH+]ccc1N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000530475561 317133798 /nfs/dbraw/zinc/13/37/98/317133798.db2.gz OWQQPPUXZLHPSC-UHFFFAOYSA-N 1 1 327.340 2.729 10 5 EFBEMO O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)c1ccc([N+](=O)[O-])cn1 ZINC000531633608 317294244 /nfs/dbraw/zinc/29/42/44/317294244.db2.gz IRZNMKBDNRGSSA-HNNXBMFYSA-N 1 1 344.371 2.540 10 5 EFBEMO C[NH+](C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)c1ccccc1Cl ZINC000531886478 317328385 /nfs/dbraw/zinc/32/83/85/317328385.db2.gz GKSCYOZZHHQHOO-OAHLLOKOSA-N 1 1 348.790 2.676 10 5 EFBEMO O=C(NC[C@H]1CCC[N@H+]1CC1CCCCC1)c1ccc([N+](=O)[O-])cn1 ZINC000531889304 317328935 /nfs/dbraw/zinc/32/89/35/317328935.db2.gz HJUHBYMGFOTHJD-OAHLLOKOSA-N 1 1 346.431 2.764 10 5 EFBEMO Cc1ccc(OC[C@@H](O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000554849369 318337983 /nfs/dbraw/zinc/33/79/83/318337983.db2.gz YIYPGMSSHRDWNL-SFHVURJKSA-N 1 1 344.411 2.817 10 5 EFBEMO C[C@@H](C(=O)N1CC[NH2+][C@@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000562958536 318719659 /nfs/dbraw/zinc/71/96/59/318719659.db2.gz IBYBOZCZUGODDB-RDTXWAMCSA-N 1 1 339.395 2.871 10 5 EFBEMO O=C(NCc1c[nH+]c2n1CCCC2)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000565849776 319009004 /nfs/dbraw/zinc/00/90/04/319009004.db2.gz KKILUZZKQNBSPP-UHFFFAOYSA-N 1 1 339.355 2.539 10 5 EFBEMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC3(C2)Oc2ccccc2O3)cc1 ZINC000566032972 319024921 /nfs/dbraw/zinc/02/49/21/319024921.db2.gz BCIZXVBUJDZPQA-UHFFFAOYSA-N 1 1 342.351 2.847 10 5 EFBEMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC3(C2)Oc2ccccc2O3)cc1 ZINC000566032972 319024922 /nfs/dbraw/zinc/02/49/22/319024922.db2.gz BCIZXVBUJDZPQA-UHFFFAOYSA-N 1 1 342.351 2.847 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC[C@@H]1C1(O)CC1 ZINC000567448111 319171915 /nfs/dbraw/zinc/17/19/15/319171915.db2.gz AERGUODBQJEFSX-MRXNPFEDSA-N 1 1 347.415 2.611 10 5 EFBEMO COc1cncc(/C=C\CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)c1 ZINC000567780517 319210702 /nfs/dbraw/zinc/21/07/02/319210702.db2.gz VRPQFZRACAXQAL-RQOWECAXSA-N 1 1 340.383 2.855 10 5 EFBEMO COc1cncc(/C=C/CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)c1 ZINC000567780516 319210977 /nfs/dbraw/zinc/21/09/77/319210977.db2.gz VRPQFZRACAXQAL-DUXPYHPUSA-N 1 1 340.383 2.855 10 5 EFBEMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+]1C ZINC000181352654 323233096 /nfs/dbraw/zinc/23/30/96/323233096.db2.gz ZWRBTZKXKYPBSP-ZDUSSCGKSA-N 1 1 337.445 2.919 10 5 EFBEMO COC[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000181657548 323243016 /nfs/dbraw/zinc/24/30/16/323243016.db2.gz QYOAHAJQZMHGIN-OAHLLOKOSA-N 1 1 329.356 2.511 10 5 EFBEMO CCOc1cccc(N2CC[N@@H+](CCOC)[C@@H](CC)C2)c1[N+](=O)[O-] 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WZTMMTSTDOLNEV-KCQAQPDRSA-N 1 1 334.420 2.780 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000174122760 473989994 /nfs/dbraw/zinc/98/99/94/473989994.db2.gz UVYSJHDEOMVZKN-RYUDHWBXSA-N 1 1 336.392 2.550 10 5 EFBEMO Cc1cc(N2CCN(C[C@@H]3CCCC[N@@H+]3C)CC2)ccc1[N+](=O)[O-] ZINC000264564649 474039966 /nfs/dbraw/zinc/03/99/66/474039966.db2.gz VPJBEGLOVUSGDL-KRWDZBQOSA-N 1 1 332.448 2.510 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)cc1[N+](=O)[O-] ZINC000247181407 474081704 /nfs/dbraw/zinc/08/17/04/474081704.db2.gz VXWUQHHVZUKSJB-IJEWVQPXSA-N 1 1 346.431 2.842 10 5 EFBEMO CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccccc1 ZINC000288964497 474105818 /nfs/dbraw/zinc/10/58/18/474105818.db2.gz UBCXBHTWYIUNNW-HUUCEWRRSA-N 1 1 329.404 2.977 10 5 EFBEMO CCn1c(C)nc([N+](=O)[O-])c1N[C@H]1CC[N@@H+](C)[C@@H]1c1ccccc1 ZINC000288964515 474105909 /nfs/dbraw/zinc/10/59/09/474105909.db2.gz UBCXBHTWYIUNNW-LSDHHAIUSA-N 1 1 329.404 2.977 10 5 EFBEMO CC1CCC([N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@H]2CCCO2)CC1 ZINC000174876643 474110403 /nfs/dbraw/zinc/11/04/03/474110403.db2.gz PKAVUGKHCNZGFK-DQPZFDDXSA-N 1 1 336.436 2.851 10 5 EFBEMO COc1cc(C[NH2+][C@@H](C)c2cn[nH]c2)c([N+](=O)[O-])cc1OC(F)F ZINC000275241684 474116196 /nfs/dbraw/zinc/11/61/96/474116196.db2.gz XFWMYCRZYBIUKR-QMMMGPOBSA-N 1 1 342.302 2.779 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000175048944 474137270 /nfs/dbraw/zinc/13/72/70/474137270.db2.gz HVQLIONIBKLLMG-DGCLKSJQSA-N 1 1 337.807 2.947 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000247398554 474137980 /nfs/dbraw/zinc/13/79/80/474137980.db2.gz MLWSSFKLCKHDCB-GJZGRUSLSA-N 1 1 349.431 2.552 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000247398562 474138313 /nfs/dbraw/zinc/13/83/13/474138313.db2.gz MLWSSFKLCKHDCB-LSDHHAIUSA-N 1 1 349.431 2.552 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)c1 ZINC000247467239 474152841 /nfs/dbraw/zinc/15/28/41/474152841.db2.gz RIYRGDKRQRKRFH-RYUDHWBXSA-N 1 1 335.429 2.625 10 5 EFBEMO COc1ccc(OCC[N@@H+]2CCO[C@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000247514113 474169764 /nfs/dbraw/zinc/16/97/64/474169764.db2.gz MTPBMZNTMJQUOB-ZBFHGGJFSA-N 1 1 336.388 2.626 10 5 EFBEMO COc1ccc(OCC[N@H+]2CCO[C@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000247514113 474169769 /nfs/dbraw/zinc/16/97/69/474169769.db2.gz MTPBMZNTMJQUOB-ZBFHGGJFSA-N 1 1 336.388 2.626 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000175543900 474246591 /nfs/dbraw/zinc/24/65/91/474246591.db2.gz BJYAVGBABLALSB-NSHDSACASA-N 1 1 325.796 2.805 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCN(c2cccnn2)CC1 ZINC000182748920 474247551 /nfs/dbraw/zinc/24/75/51/474247551.db2.gz KFWRKHBSKSLSJK-HNNXBMFYSA-N 1 1 341.415 2.967 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H]2CCCC[C@H]21 ZINC000248375621 474299975 /nfs/dbraw/zinc/29/99/75/474299975.db2.gz XJXFRFMSKHJETK-BZUAXINKSA-N 1 1 334.416 2.989 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265739057 474316388 /nfs/dbraw/zinc/31/63/88/474316388.db2.gz BNDIDJCPTMYDRF-AWEZNQCLSA-N 1 1 333.432 2.863 10 5 EFBEMO CO[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC[C@@H]1C ZINC000189276803 474344255 /nfs/dbraw/zinc/34/42/55/474344255.db2.gz LMVOSVWAAZUQKY-XJKSGUPXSA-N 1 1 335.404 2.589 10 5 EFBEMO CC[C@H](NC(=O)N[C@H]1CCC[N@@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000175953904 474347584 /nfs/dbraw/zinc/34/75/84/474347584.db2.gz YNPYAAKUFJMRNH-HOCLYGCPSA-N 1 1 334.420 2.829 10 5 EFBEMO CC[NH+]1CC[C@H]([N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000283283605 474359527 /nfs/dbraw/zinc/35/95/27/474359527.db2.gz MFEQPODKVNFTGS-HOCLYGCPSA-N 1 1 348.447 2.586 10 5 EFBEMO CC[NH+]1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000283283605 474359533 /nfs/dbraw/zinc/35/95/33/474359533.db2.gz MFEQPODKVNFTGS-HOCLYGCPSA-N 1 1 348.447 2.586 10 5 EFBEMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000283283605 474359535 /nfs/dbraw/zinc/35/95/35/474359535.db2.gz MFEQPODKVNFTGS-HOCLYGCPSA-N 1 1 348.447 2.586 10 5 EFBEMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000283283605 474359542 /nfs/dbraw/zinc/35/95/42/474359542.db2.gz MFEQPODKVNFTGS-HOCLYGCPSA-N 1 1 348.447 2.586 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000183298674 474369859 /nfs/dbraw/zinc/36/98/59/474369859.db2.gz CQVFMCFVLQUZOI-UZICZHQRSA-N 1 1 343.427 2.941 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000183304183 474372430 /nfs/dbraw/zinc/37/24/30/474372430.db2.gz SNCYKESZHDPLQL-ABDJAZHISA-N 1 1 329.400 2.695 10 5 EFBEMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3nn(C)cc3[N+](=O)[O-])c2C1 ZINC000271153442 474407668 /nfs/dbraw/zinc/40/76/68/474407668.db2.gz VAGUNFJTMZOGID-UHFFFAOYSA-N 1 1 343.387 2.552 10 5 EFBEMO COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000248798832 474439998 /nfs/dbraw/zinc/43/99/98/474439998.db2.gz FTFJJRGOYCFMHV-XKQJLSEDSA-N 1 1 348.399 2.637 10 5 EFBEMO C[C@H]([NH2+]CCS(=O)(=O)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000266907851 474525518 /nfs/dbraw/zinc/52/55/18/474525518.db2.gz VPUJMLZJERURKC-ZDUSSCGKSA-N 1 1 334.397 2.719 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000249380245 474563684 /nfs/dbraw/zinc/56/36/84/474563684.db2.gz PZSBVLPFZJYBEC-VXGBXAGGSA-N 1 1 348.321 2.609 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[N@H+](C2CC2)CC1 ZINC000184716028 474593548 /nfs/dbraw/zinc/59/35/48/474593548.db2.gz XVNRSVLJHWIRSC-MRXNPFEDSA-N 1 1 345.443 2.860 10 5 EFBEMO C[N@H+]1CCC[C@H]1CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277955822 474599775 /nfs/dbraw/zinc/59/97/75/474599775.db2.gz TUWAXQNWIAHDMV-ZDUSSCGKSA-N 1 1 335.407 2.918 10 5 EFBEMO CC[N@H+]1CCC[C@@H](NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000249614846 474600556 /nfs/dbraw/zinc/60/05/56/474600556.db2.gz ZTQDWMYAAHPSBU-QWHCGFSZSA-N 1 1 337.445 2.676 10 5 EFBEMO CO[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC[C@@H]1C ZINC000251783696 474646132 /nfs/dbraw/zinc/64/61/32/474646132.db2.gz LMVOSVWAAZUQKY-BBRMVZONSA-N 1 1 335.404 2.589 10 5 EFBEMO COc1cc(N[C@@H]2CC[N@@H+](C[C@@H]3CCCO3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000252477370 474663033 /nfs/dbraw/zinc/66/30/33/474663033.db2.gz MQMACDRHCXUVHG-VNQPRFMTSA-N 1 1 349.431 2.905 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@@H]4COC[C@H](C3)O4)s2)cc1 ZINC000338967785 474786395 /nfs/dbraw/zinc/78/63/95/474786395.db2.gz VGMSETQXSDZZPD-GASCZTMLSA-N 1 1 346.408 2.923 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H]4COC[C@H](C3)O4)s2)cc1 ZINC000338967785 474786404 /nfs/dbraw/zinc/78/64/04/474786404.db2.gz VGMSETQXSDZZPD-GASCZTMLSA-N 1 1 346.408 2.923 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278732942 474802162 /nfs/dbraw/zinc/80/21/62/474802162.db2.gz LDWCRXYYWJRJOY-VXGBXAGGSA-N 1 1 348.321 2.609 10 5 EFBEMO CC[C@@H]1CN(C/C=C\c2ccccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000255234073 474824534 /nfs/dbraw/zinc/82/45/34/474824534.db2.gz XAUFESRYYZCGFX-BQLWYNFJSA-N 1 1 333.432 2.651 10 5 EFBEMO CO[C@@H]1CC[C@@H]2OCC[N@H+](C/C=C\c3ccccc3[N+](=O)[O-])[C@@H]2C1 ZINC000255335966 474837417 /nfs/dbraw/zinc/83/74/17/474837417.db2.gz HJLCFGJDDBMYIK-ZMSYEMKQSA-N 1 1 332.400 2.876 10 5 EFBEMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])[C@@H]2C1 ZINC000255335966 474837422 /nfs/dbraw/zinc/83/74/22/474837422.db2.gz HJLCFGJDDBMYIK-ZMSYEMKQSA-N 1 1 332.400 2.876 10 5 EFBEMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H](n3ccnc3)C2)cc1 ZINC000609257831 480131942 /nfs/dbraw/zinc/13/19/42/480131942.db2.gz GURNBSWIJKARLX-MRXNPFEDSA-N 1 1 330.388 2.897 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000292255288 474925219 /nfs/dbraw/zinc/92/52/19/474925219.db2.gz FANVLLZBKGPTQB-CYBMUJFWSA-N 1 1 331.416 2.850 10 5 EFBEMO CNC(=O)c1ccc(NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000341126224 475003133 /nfs/dbraw/zinc/00/31/33/475003133.db2.gz NNKSBCGJYMOQMU-BETUJISGSA-N 1 1 334.420 2.629 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1ccc(Cl)cc1 ZINC000341173502 475023372 /nfs/dbraw/zinc/02/33/72/475023372.db2.gz VDBCZEYTGSJXOB-IUODEOHRSA-N 1 1 348.790 2.752 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1ccc(Cl)cc1 ZINC000341173502 475023375 /nfs/dbraw/zinc/02/33/75/475023375.db2.gz VDBCZEYTGSJXOB-IUODEOHRSA-N 1 1 348.790 2.752 10 5 EFBEMO CN(C)C(=O)C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000341509791 475101396 /nfs/dbraw/zinc/10/13/96/475101396.db2.gz WGHPZDDZVNCCJY-CQSZACIVSA-N 1 1 333.413 2.966 10 5 EFBEMO C[C@H](NC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc([N+](=O)[O-])cc1 ZINC000296509473 475348587 /nfs/dbraw/zinc/34/85/87/475348587.db2.gz OLSARCIXNXRJOC-IICXIOTHSA-N 1 1 346.431 2.970 10 5 EFBEMO COc1cc(C[N@@H+](CCCO)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000352526059 475381043 /nfs/dbraw/zinc/38/10/43/475381043.db2.gz JUJASTANFKHBFF-UHFFFAOYSA-N 1 1 330.384 2.988 10 5 EFBEMO COc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1O ZINC000352546385 475401371 /nfs/dbraw/zinc/40/13/71/475401371.db2.gz UKLDXZGDDURFDZ-UHFFFAOYSA-N 1 1 332.356 2.950 10 5 EFBEMO COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1O ZINC000352546385 475401376 /nfs/dbraw/zinc/40/13/76/475401376.db2.gz UKLDXZGDDURFDZ-UHFFFAOYSA-N 1 1 332.356 2.950 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@H](O)C2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000361420447 475434531 /nfs/dbraw/zinc/43/45/31/475434531.db2.gz NLDAPYLENQNSRR-ZDUSSCGKSA-N 1 1 346.330 2.550 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@H](O)C2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000361420447 475434536 /nfs/dbraw/zinc/43/45/36/475434536.db2.gz NLDAPYLENQNSRR-ZDUSSCGKSA-N 1 1 346.330 2.550 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)NCC[N@@H+]2CC=C(C)CC2)cc1[N+](=O)[O-] ZINC000358188714 475471718 /nfs/dbraw/zinc/47/17/18/475471718.db2.gz LNEUYSPETFGNQO-HNNXBMFYSA-N 1 1 346.431 2.915 10 5 EFBEMO COc1ccc(OCC[N@H+]2CCCCC[C@@H]2CCO)c([N+](=O)[O-])c1 ZINC000342014370 475504171 /nfs/dbraw/zinc/50/41/71/475504171.db2.gz HEWGPIPZJCUXDD-CQSZACIVSA-N 1 1 338.404 2.609 10 5 EFBEMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000348247508 475522029 /nfs/dbraw/zinc/52/20/29/475522029.db2.gz SSAAYWSYBCUTBW-IJLUTSLNSA-N 1 1 348.321 2.607 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2CCCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000354923742 475524826 /nfs/dbraw/zinc/52/48/26/475524826.db2.gz NOBIXDGSSPPSFO-CYBMUJFWSA-N 1 1 336.388 2.911 10 5 EFBEMO O=C(CC[N@@H+]1CCCCC[C@@H]1CCO)Nc1ccccc1[N+](=O)[O-] ZINC000342058425 475540240 /nfs/dbraw/zinc/54/02/40/475540240.db2.gz JNQOOTLIUOTHHJ-CQSZACIVSA-N 1 1 335.404 2.550 10 5 EFBEMO CC[C@H](NC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000297019322 475577361 /nfs/dbraw/zinc/57/73/61/475577361.db2.gz LHHBTVSWLFUFNV-BTFYYFJDSA-N 1 1 346.431 2.970 10 5 EFBEMO COC(=O)COc1ccc(C[N@@H+](C)C[C@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000355042635 475621156 /nfs/dbraw/zinc/62/11/56/475621156.db2.gz SZNHUEBTZAZNLE-AWEZNQCLSA-N 1 1 348.399 2.935 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCO[C@]2(CCCOC2)C1 ZINC000348669642 475810073 /nfs/dbraw/zinc/81/00/73/475810073.db2.gz HASAPRWOOWJPML-SPQRHKFCSA-N 1 1 332.400 2.880 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCO[C@]2(CCCOC2)C1 ZINC000348669642 475810081 /nfs/dbraw/zinc/81/00/81/475810081.db2.gz HASAPRWOOWJPML-SPQRHKFCSA-N 1 1 332.400 2.880 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1OC[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000340166507 475817930 /nfs/dbraw/zinc/81/79/30/475817930.db2.gz FUJDOSZAWCCCDN-QGZVFWFLSA-N 1 1 342.395 2.701 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000340375659 475991346 /nfs/dbraw/zinc/99/13/46/475991346.db2.gz SZFKNBXNEYRSBI-IRXDYDNUSA-N 1 1 343.358 2.909 10 5 EFBEMO O=[N+]([O-])c1ccccc1Cc1noc(Cn2c[nH+]c3c2CCCC3)n1 ZINC000349886679 476014173 /nfs/dbraw/zinc/01/41/73/476014173.db2.gz BUAZLEFKERVSRO-UHFFFAOYSA-N 1 1 339.355 2.692 10 5 EFBEMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000347017498 476036626 /nfs/dbraw/zinc/03/66/26/476036626.db2.gz OXNAELRBVNAQRE-WFASDCNBSA-N 1 1 349.456 2.771 10 5 EFBEMO CSc1ccc(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000347017570 476037287 /nfs/dbraw/zinc/03/72/87/476037287.db2.gz POMPVULPZIPSQV-CYBMUJFWSA-N 1 1 335.429 2.625 10 5 EFBEMO COC1CC[NH+](C(C)(C)CNCc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000350117183 476055164 /nfs/dbraw/zinc/05/51/64/476055164.db2.gz XWZODFDCJQLQLL-UHFFFAOYSA-N 1 1 335.448 2.882 10 5 EFBEMO CC(C)[N@@H+](C)CCCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000359037225 476134939 /nfs/dbraw/zinc/13/49/39/476134939.db2.gz DCJAGGWUDIMZQR-UHFFFAOYSA-N 1 1 345.346 2.656 10 5 EFBEMO C[N@@H+](C[C@H]1CC=CCC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000344033870 476148589 /nfs/dbraw/zinc/14/85/89/476148589.db2.gz FZGXFZZNIHYTAW-WMLDXEAASA-N 1 1 329.400 2.988 10 5 EFBEMO CO[C@@H]1CC[C@@H]([NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000353674941 476178584 /nfs/dbraw/zinc/17/85/84/476178584.db2.gz VFKHPCYSTCRRCO-FVQBIDKESA-N 1 1 330.388 2.575 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(NCCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)n1 ZINC000359099891 476187881 /nfs/dbraw/zinc/18/78/81/476187881.db2.gz OXXUMOYAQMEJID-GASCZTMLSA-N 1 1 336.436 2.908 10 5 EFBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000357105108 476235812 /nfs/dbraw/zinc/23/58/12/476235812.db2.gz XDXVDOAQHSMZLU-KSSFIOAISA-N 1 1 347.415 2.814 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000357105110 476235864 /nfs/dbraw/zinc/23/58/64/476235864.db2.gz XDXVDOAQHSMZLU-RDTXWAMCSA-N 1 1 347.415 2.814 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H]4COCC[C@@H]43)n2)cc1 ZINC000362450315 476260914 /nfs/dbraw/zinc/26/09/14/476260914.db2.gz JPDXXEFDGLSBED-ZFWWWQNUSA-N 1 1 344.371 2.646 10 5 EFBEMO O=c1c(Cl)cc([N+](=O)[O-])cn1Cc1[nH+]ccn1Cc1ccccc1 ZINC000353770616 476261952 /nfs/dbraw/zinc/26/19/52/476261952.db2.gz AFZFPOMJZQLXRM-UHFFFAOYSA-N 1 1 344.758 2.703 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]2COCC[C@H]21 ZINC000362454429 476263253 /nfs/dbraw/zinc/26/32/53/476263253.db2.gz QIGNRNFCYLTCTG-RHSMWYFYSA-N 1 1 347.415 2.733 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]2COCC[C@H]21 ZINC000362455716 476264575 /nfs/dbraw/zinc/26/45/75/476264575.db2.gz SWRFIHNZZOXZSK-RHSMWYFYSA-N 1 1 347.415 2.733 10 5 EFBEMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@@H+]1CC=C(C)CC1 ZINC000353920926 476324877 /nfs/dbraw/zinc/32/48/77/476324877.db2.gz GKBNSRATWANBNJ-UHFFFAOYSA-N 1 1 332.404 2.931 10 5 EFBEMO COc1ccc([N+](=O)[O-])c(Cc2noc([C@H]3CC[N@@H+](C)[C@@H](C)C3)n2)c1 ZINC000351224991 476370244 /nfs/dbraw/zinc/37/02/44/476370244.db2.gz NXTZJVAHXSMQFA-RYUDHWBXSA-N 1 1 346.387 2.775 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000369167734 476395330 /nfs/dbraw/zinc/39/53/30/476395330.db2.gz WCJKGFNVKGEOCU-UHFFFAOYSA-N 1 1 332.335 2.716 10 5 EFBEMO O=C(C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)NCC(F)F ZINC000360922084 476477791 /nfs/dbraw/zinc/47/77/91/476477791.db2.gz YZNVTKRATDYUAC-QGZVFWFLSA-N 1 1 349.337 2.655 10 5 EFBEMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCN(c2cnccn2)CC1 ZINC000370039947 476644057 /nfs/dbraw/zinc/64/40/57/476644057.db2.gz FUKUVBYTPDNRPO-UHFFFAOYSA-N 1 1 341.415 2.528 10 5 EFBEMO CO[C@H](C)C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)C ZINC000354450266 476669577 /nfs/dbraw/zinc/66/95/77/476669577.db2.gz KBJMGPQPFLGKAM-GFCCVEGCSA-N 1 1 334.376 2.890 10 5 EFBEMO Cc1ccccc1[C@]1(F)CC[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000370150255 476680059 /nfs/dbraw/zinc/68/00/59/476680059.db2.gz QYJSUENHUUTCDN-SFHVURJKSA-N 1 1 345.374 2.636 10 5 EFBEMO Cc1ccccc1[C@]1(F)CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000370150255 476680064 /nfs/dbraw/zinc/68/00/64/476680064.db2.gz QYJSUENHUUTCDN-SFHVURJKSA-N 1 1 345.374 2.636 10 5 EFBEMO CCOc1cc(C[N@@H+]2CC[C@@H]([C@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000451883876 476699318 /nfs/dbraw/zinc/69/93/18/476699318.db2.gz FRMJFKZSZPJUMG-RISCZKNCSA-N 1 1 348.321 2.739 10 5 EFBEMO CCOc1cc(C[N@H+]2CC[C@@H]([C@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000451883876 476699328 /nfs/dbraw/zinc/69/93/28/476699328.db2.gz FRMJFKZSZPJUMG-RISCZKNCSA-N 1 1 348.321 2.739 10 5 EFBEMO CCOc1cc(C[N@@H+]2CC[C@@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000451883872 476699555 /nfs/dbraw/zinc/69/95/55/476699555.db2.gz FRMJFKZSZPJUMG-BXUZGUMPSA-N 1 1 348.321 2.739 10 5 EFBEMO CCOc1cc(C[N@H+]2CC[C@@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000451883872 476699563 /nfs/dbraw/zinc/69/95/63/476699563.db2.gz FRMJFKZSZPJUMG-BXUZGUMPSA-N 1 1 348.321 2.739 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451899566 476707613 /nfs/dbraw/zinc/70/76/13/476707613.db2.gz KSHLJVJNKOHDJT-GOSISDBHSA-N 1 1 347.415 2.734 10 5 EFBEMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000446070545 476820270 /nfs/dbraw/zinc/82/02/70/476820270.db2.gz HKKUIKXMLXEOHZ-UBHSHLNASA-N 1 1 335.404 2.730 10 5 EFBEMO Cc1c(NC(=O)CCNC(C)(C)C[NH+]2CCCC2)cccc1[N+](=O)[O-] ZINC000452095706 476820660 /nfs/dbraw/zinc/82/06/60/476820660.db2.gz LWYRALZYDMTUHH-UHFFFAOYSA-N 1 1 348.447 2.696 10 5 EFBEMO COC[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000452096654 476821329 /nfs/dbraw/zinc/82/13/29/476821329.db2.gz YKJCEHPMASAFJB-KBPBESRZSA-N 1 1 335.404 2.670 10 5 EFBEMO COC[C@H]1CCC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000452098816 476822989 /nfs/dbraw/zinc/82/29/89/476822989.db2.gz GAESCQAGWFRVTC-LBPRGKRZSA-N 1 1 326.368 2.991 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)O[C@@H](C)[C@H]1C ZINC000446075456 476823287 /nfs/dbraw/zinc/82/32/87/476823287.db2.gz YQQXGEDGTIAKQH-MJBXVCDLSA-N 1 1 335.404 2.730 10 5 EFBEMO COC[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000452101635 476825186 /nfs/dbraw/zinc/82/51/86/476825186.db2.gz JPYPMDYIOAABAQ-OAHLLOKOSA-N 1 1 349.431 2.980 10 5 EFBEMO COC[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000452109697 476830451 /nfs/dbraw/zinc/83/04/51/476830451.db2.gz WXSOBGDJSUAZNP-OAHLLOKOSA-N 1 1 349.431 2.980 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cn2)C1 ZINC000366127251 476873286 /nfs/dbraw/zinc/87/32/86/476873286.db2.gz PAZRNAQHVBFFJN-HUUCEWRRSA-N 1 1 346.431 2.716 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000366617656 477099539 /nfs/dbraw/zinc/09/95/39/477099539.db2.gz LEWCYZYIIWAWNA-CYBMUJFWSA-N 1 1 328.372 2.773 10 5 EFBEMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3nnc4n3CCC4)CC2)cc1F ZINC000366881469 477239038 /nfs/dbraw/zinc/23/90/38/477239038.db2.gz KCKYLPCGYAGJDE-UHFFFAOYSA-N 1 1 345.378 2.651 10 5 EFBEMO O=C(CC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)Nc1cccc(F)c1 ZINC000411475516 477250064 /nfs/dbraw/zinc/25/00/64/477250064.db2.gz DQHSPIQGBASATD-UHFFFAOYSA-N 1 1 344.346 2.516 10 5 EFBEMO CC[C@H]([NH2+]Cc1ccc(S(C)(=O)=O)o1)c1cccc([N+](=O)[O-])c1 ZINC000411481112 477251520 /nfs/dbraw/zinc/25/15/20/477251520.db2.gz ZFLSCYQZWIVKFR-AWEZNQCLSA-N 1 1 338.385 2.832 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@@]3(C2)CCCOC3)cccc1[N+](=O)[O-] ZINC000367067471 477325891 /nfs/dbraw/zinc/32/58/91/477325891.db2.gz NFOAQBGTKCINGG-GOSISDBHSA-N 1 1 347.415 2.734 10 5 EFBEMO O=C(CC[N@H+]1CCOCC12CCCCC2)Nc1ccc([N+](=O)[O-])cc1 ZINC000411790918 477369050 /nfs/dbraw/zinc/36/90/50/477369050.db2.gz KKYQKJITSMOFID-UHFFFAOYSA-N 1 1 347.415 2.959 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C(N)=O)[C@@H](c2ccccc2)C1 ZINC000411966981 477400483 /nfs/dbraw/zinc/40/04/83/477400483.db2.gz CMTYDXSXVSHTCE-XWIAVFTESA-N 1 1 339.395 2.857 10 5 EFBEMO COC(=O)[C@H]1CSCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000412087484 477409865 /nfs/dbraw/zinc/40/98/65/477409865.db2.gz VWUSIFLJQFBISI-LLVKDONJSA-N 1 1 344.820 2.586 10 5 EFBEMO COC(=O)[C@H]1CSCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000412087484 477409873 /nfs/dbraw/zinc/40/98/73/477409873.db2.gz VWUSIFLJQFBISI-LLVKDONJSA-N 1 1 344.820 2.586 10 5 EFBEMO CC(C)[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CCC(=O)N1 ZINC000412095498 477410210 /nfs/dbraw/zinc/41/02/10/477410210.db2.gz XTAIXDPHDGIAGK-CYBMUJFWSA-N 1 1 325.796 2.737 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@@]3(C2)CCCOC3)c([N+](=O)[O-])cc1OC ZINC000367438528 477509303 /nfs/dbraw/zinc/50/93/03/477509303.db2.gz NNBLQFFTJXZMOT-QGZVFWFLSA-N 1 1 336.388 2.615 10 5 EFBEMO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@@H+]2CCO)cc1C(F)(F)F ZINC000450617503 477656887 /nfs/dbraw/zinc/65/68/87/477656887.db2.gz RDAXMOPTWRNHMY-LBPRGKRZSA-N 1 1 347.337 2.872 10 5 EFBEMO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@@H+]2CCO)cc1C(F)(F)F ZINC000450617502 477656958 /nfs/dbraw/zinc/65/69/58/477656958.db2.gz RDAXMOPTWRNHMY-GFCCVEGCSA-N 1 1 347.337 2.872 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000372247115 477711640 /nfs/dbraw/zinc/71/16/40/477711640.db2.gz KENZZFKTDIMGDQ-UHFFFAOYSA-N 1 1 342.399 2.896 10 5 EFBEMO CC[N@@H+](C)Cc1cccc(CNc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000427994815 477801495 /nfs/dbraw/zinc/80/14/95/477801495.db2.gz UFKQYUJDPDENJU-UHFFFAOYSA-N 1 1 339.399 2.957 10 5 EFBEMO CCOc1ccc(NC(=O)C[N@H+]2CC[C@@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000438479757 477849384 /nfs/dbraw/zinc/84/93/84/477849384.db2.gz CRXHJVRRSBNKMC-CYBMUJFWSA-N 1 1 335.404 2.910 10 5 EFBEMO CC[C@@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000493870228 477866656 /nfs/dbraw/zinc/86/66/56/477866656.db2.gz DGYIZBPGFHLHPB-CYBMUJFWSA-N 1 1 341.839 2.791 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](O)CC23CCC3)cccc1[N+](=O)[O-] ZINC000420990451 477882576 /nfs/dbraw/zinc/88/25/76/477882576.db2.gz FSHXNELPJMMMHT-CQSZACIVSA-N 1 1 347.415 2.611 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](O)CC12CCC2 ZINC000420991232 477883505 /nfs/dbraw/zinc/88/35/05/477883505.db2.gz 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CPWMDKNIFHNDFW-YGRLFVJLSA-N 1 1 345.321 2.656 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCC[C@H]1C1CCC1 ZINC000592200470 478822580 /nfs/dbraw/zinc/82/25/80/478822580.db2.gz YZESVNCEVMKTJF-HOTGVXAUSA-N 1 1 334.416 2.989 10 5 EFBEMO CO[C@H](C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)[C@@H]1CCOC1 ZINC000595520778 478832215 /nfs/dbraw/zinc/83/22/15/478832215.db2.gz DQLQUPGNRYSMLW-JFIYKMOQSA-N 1 1 334.416 2.826 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)CCc1ccccc1)C2 ZINC000544402448 478832748 /nfs/dbraw/zinc/83/27/48/478832748.db2.gz MPWQGWMVSDOQFZ-KRWDZBQOSA-N 1 1 326.396 2.947 10 5 EFBEMO CN(c1nc2c(cc1[N+](=O)[O-])CCCC2)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000564891510 478849473 /nfs/dbraw/zinc/84/94/73/478849473.db2.gz UKLZZBCAIXNFBE-YIONKMFJSA-N 1 1 330.432 2.930 10 5 EFBEMO Cc1noc(C[N@H+]2CCC[C@H](O)[C@H]2CCc2ccccc2)c1[N+](=O)[O-] ZINC000595556754 478852698 /nfs/dbraw/zinc/85/26/98/478852698.db2.gz FTWBWUDLNNOANX-CVEARBPZSA-N 1 1 345.399 2.849 10 5 EFBEMO CC1(C)C[C@H]([N@@H+](CCn2ccc([N+](=O)[O-])n2)Cc2ccccc2)CO1 ZINC000595634616 478904804 /nfs/dbraw/zinc/90/48/04/478904804.db2.gz DDHBWLSSROMZMH-INIZCTEOSA-N 1 1 344.415 2.861 10 5 EFBEMO C[C@H]1COC2(CCC2)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000595681331 478931477 /nfs/dbraw/zinc/93/14/77/478931477.db2.gz KNDLALOJUFLAIE-ZDUSSCGKSA-N 1 1 333.388 2.567 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@H+]2C[C@]3(C)COC[C@]3(C)C2)cccc1[N+](=O)[O-] ZINC000595688919 478936905 /nfs/dbraw/zinc/93/69/05/478936905.db2.gz KNUBHJRXSHPDMF-XWIAVFTESA-N 1 1 347.415 2.589 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2C[C@]3(C)COC[C@]3(C)C2)cccc1[N+](=O)[O-] ZINC000595688919 478936910 /nfs/dbraw/zinc/93/69/10/478936910.db2.gz KNUBHJRXSHPDMF-XWIAVFTESA-N 1 1 347.415 2.589 10 5 EFBEMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000565281340 478966886 /nfs/dbraw/zinc/96/68/86/478966886.db2.gz MQXWGUAWTWYVQD-BETUJISGSA-N 1 1 344.415 2.608 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@@](O)(C4CC4)C3)co2)cc1 ZINC000595749343 478973968 /nfs/dbraw/zinc/97/39/68/478973968.db2.gz FHQFADXBWABNLH-SFHVURJKSA-N 1 1 343.383 2.987 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](CCF)C1 ZINC000595756636 478977699 /nfs/dbraw/zinc/97/76/99/478977699.db2.gz VESCRHGTWIVILV-GFCCVEGCSA-N 1 1 339.367 2.614 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](CCF)C1 ZINC000595756636 478977709 /nfs/dbraw/zinc/97/77/09/478977709.db2.gz VESCRHGTWIVILV-GFCCVEGCSA-N 1 1 339.367 2.614 10 5 EFBEMO O=C1[C@@H]([N@H+]2CCC[C@@H](CCF)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595756298 478978876 /nfs/dbraw/zinc/97/88/76/478978876.db2.gz SMROFWORNSVOSY-BBRMVZONSA-N 1 1 335.379 2.772 10 5 EFBEMO CCC1([NH+]2CCCC2)CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 ZINC000601745798 478982107 /nfs/dbraw/zinc/98/21/07/478982107.db2.gz YAFLSQVIHMFABO-UHFFFAOYSA-N 1 1 347.415 2.781 10 5 EFBEMO C[C@H]([NH2+][C@H]1C[C@H](O)C12CCC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000595783067 478995626 /nfs/dbraw/zinc/99/56/26/478995626.db2.gz QAZDPUQRETZVPD-BPNCWPANSA-N 1 1 344.371 2.599 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000592751387 479025910 /nfs/dbraw/zinc/02/59/10/479025910.db2.gz ROSSWIDFTMAHKM-GFCCVEGCSA-N 1 1 346.387 2.630 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000592765536 479033476 /nfs/dbraw/zinc/03/34/76/479033476.db2.gz KDTRRHICCUOZOI-GFCCVEGCSA-N 1 1 328.372 2.894 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000595873626 479044822 /nfs/dbraw/zinc/04/48/22/479044822.db2.gz OEQDLWQEKIBNOW-UHFFFAOYSA-N 1 1 336.436 2.552 10 5 EFBEMO C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@H]1CCc2ccccc21 ZINC000595876135 479046569 /nfs/dbraw/zinc/04/65/69/479046569.db2.gz DPCAPYNDLZDNHR-OAHLLOKOSA-N 1 1 339.395 2.856 10 5 EFBEMO CCNc1ccc(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000598856179 479057292 /nfs/dbraw/zinc/05/72/92/479057292.db2.gz VHLFRCOOUCDZQT-CYBMUJFWSA-N 1 1 334.420 2.629 10 5 EFBEMO O=[N+]([O-])c1ccc(OCC[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)cc1 ZINC000595908259 479064820 /nfs/dbraw/zinc/06/48/20/479064820.db2.gz HAPIIPOYVQDHHK-HDICACEKSA-N 1 1 332.400 2.866 10 5 EFBEMO C[C@@H](CCN1CC[NH+](C)CC1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000546732247 479066690 /nfs/dbraw/zinc/06/66/90/479066690.db2.gz KFDVRXVNRYLMDB-AWEZNQCLSA-N 1 1 343.431 2.581 10 5 EFBEMO C[C@H]1C(=O)Nc2ccccc2C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000598949649 479097916 /nfs/dbraw/zinc/09/79/16/479097916.db2.gz LFPSNKZINBJAHV-ZDUSSCGKSA-N 1 1 325.368 2.980 10 5 EFBEMO C[C@H]1C(=O)Nc2ccccc2C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000598949649 479097923 /nfs/dbraw/zinc/09/79/23/479097923.db2.gz LFPSNKZINBJAHV-ZDUSSCGKSA-N 1 1 325.368 2.980 10 5 EFBEMO O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000598966933 479106238 /nfs/dbraw/zinc/10/62/38/479106238.db2.gz MAECKWPCWWWCTR-QGZVFWFLSA-N 1 1 346.431 2.801 10 5 EFBEMO C[C@H](NC(=O)NC[C@@H]1CC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000598971948 479107456 /nfs/dbraw/zinc/10/74/56/479107456.db2.gz JREVHGJBXUCKJW-GUYCJALGSA-N 1 1 346.431 2.972 10 5 EFBEMO O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000598979127 479112575 /nfs/dbraw/zinc/11/25/75/479112575.db2.gz JVHWSOXEOBSPQR-KRWDZBQOSA-N 1 1 346.431 2.801 10 5 EFBEMO O=[N+]([O-])c1c2ccncc2ccc1N1CC[NH+](Cc2ccncc2)CC1 ZINC000599014703 479126297 /nfs/dbraw/zinc/12/62/97/479126297.db2.gz PVRGIPUVJONSNX-UHFFFAOYSA-N 1 1 349.394 2.860 10 5 EFBEMO COc1ccc(C[NH2+]C2(c3cc(C)no3)CCOCC2)cc1[N+](=O)[O-] ZINC000599019113 479128618 /nfs/dbraw/zinc/12/86/18/479128618.db2.gz CRRQTEIOBOTNRR-UHFFFAOYSA-N 1 1 347.371 2.695 10 5 EFBEMO CC(C)[C@H](CNc1ccc2cnccc2c1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000599021660 479129772 /nfs/dbraw/zinc/12/97/72/479129772.db2.gz DBNQNIFJFQHNGN-KRWDZBQOSA-N 1 1 344.415 2.912 10 5 EFBEMO CCC[C@]1(CO)CCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000593027641 479132044 /nfs/dbraw/zinc/13/20/44/479132044.db2.gz UWARWIGQPXFPGI-QGZVFWFLSA-N 1 1 336.388 2.508 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c1 ZINC000593030030 479133691 /nfs/dbraw/zinc/13/36/91/479133691.db2.gz HVERUNFCONXGAQ-OIISXLGYSA-N 1 1 348.399 2.507 10 5 EFBEMO C[C@H](CNc1ccc2cnccc2c1[N+](=O)[O-])C[NH+]1CCOCC1 ZINC000599047308 479138328 /nfs/dbraw/zinc/13/83/28/479138328.db2.gz SXDZVRMOWZAXHM-CYBMUJFWSA-N 1 1 330.388 2.523 10 5 EFBEMO C[C@@]1(c2cccc(F)c2)CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000593041605 479138459 /nfs/dbraw/zinc/13/84/59/479138459.db2.gz YHIAJVXWVPJKDV-GOSISDBHSA-N 1 1 345.374 2.559 10 5 EFBEMO Cn1ccnc1[C@H]([NH2+]CC[C@H]1CCCOC1)c1ccc([N+](=O)[O-])cc1 ZINC000599054459 479141247 /nfs/dbraw/zinc/14/12/47/479141247.db2.gz ABLFOFIASMNOAJ-RHSMWYFYSA-N 1 1 344.415 2.824 10 5 EFBEMO CN(CC[N@@H+]1CCOC(C)(C)C1)c1ccc2cnccc2c1[N+](=O)[O-] ZINC000599081825 479153903 /nfs/dbraw/zinc/15/39/03/479153903.db2.gz VJPTZSBORWFXDJ-UHFFFAOYSA-N 1 1 344.415 2.690 10 5 EFBEMO CN(CC[N@H+]1CCOC(C)(C)C1)c1ccc2cnccc2c1[N+](=O)[O-] ZINC000599081825 479153910 /nfs/dbraw/zinc/15/39/10/479153910.db2.gz VJPTZSBORWFXDJ-UHFFFAOYSA-N 1 1 344.415 2.690 10 5 EFBEMO C[N@H+]1CCC[C@@]2(CCN(c3nc4c(cc3[N+](=O)[O-])CCCC4)C2)C1 ZINC000569689656 479157245 /nfs/dbraw/zinc/15/72/45/479157245.db2.gz RTOSVQGYLJVBBF-GOSISDBHSA-N 1 1 330.432 2.791 10 5 EFBEMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC1CC([NH+]2CCOCC2)C1 ZINC000599094247 479159511 /nfs/dbraw/zinc/15/95/11/479159511.db2.gz FGEKKIZZOJPQEN-UHFFFAOYSA-N 1 1 345.321 2.889 10 5 EFBEMO Cc1cn2c([nH+]1)C[C@@H](c1nc(Cc3ccccc3[N+](=O)[O-])no1)CC2 ZINC000599114076 479164908 /nfs/dbraw/zinc/16/49/08/479164908.db2.gz UKEZVZHTHSWRRU-ZDUSSCGKSA-N 1 1 339.355 2.804 10 5 EFBEMO Cc1c(NC(=O)CC[N@@H+]2C[C@@H](C)OCC23CCC3)cccc1[N+](=O)[O-] ZINC000593092040 479168640 /nfs/dbraw/zinc/16/86/40/479168640.db2.gz MEAOCXYSAZZPDO-CYBMUJFWSA-N 1 1 347.415 2.875 10 5 EFBEMO COC(=O)c1ccnc(NC[C@H]2CC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000599125674 479170114 /nfs/dbraw/zinc/17/01/14/479170114.db2.gz ABLQAQWVCZFRET-CYBMUJFWSA-N 1 1 348.403 2.595 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@H+]2C2CCCCC2)n1 ZINC000599127087 479171050 /nfs/dbraw/zinc/17/10/50/479171050.db2.gz NQCLVQVJGAOFSW-CYBMUJFWSA-N 1 1 348.403 2.595 10 5 EFBEMO COc1ccc(OCC[N@@H+]2C[C@H](C)OCC23CCC3)c([N+](=O)[O-])c1 ZINC000593093497 479171466 /nfs/dbraw/zinc/17/14/66/479171466.db2.gz UHSLJOOEJPGEKQ-ZDUSSCGKSA-N 1 1 336.388 2.626 10 5 EFBEMO COc1ccc(OCC[N@H+]2C[C@H](C)OCC23CCC3)c([N+](=O)[O-])c1 ZINC000593093497 479171471 /nfs/dbraw/zinc/17/14/71/479171471.db2.gz UHSLJOOEJPGEKQ-ZDUSSCGKSA-N 1 1 336.388 2.626 10 5 EFBEMO CCN(C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1 ZINC000596167396 479175631 /nfs/dbraw/zinc/17/56/31/479175631.db2.gz GNZCWGJLDZNATR-BBRMVZONSA-N 1 1 334.420 2.782 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593115217 479181773 /nfs/dbraw/zinc/18/17/73/479181773.db2.gz AMUDVZIJJFZSLB-YGRLFVJLSA-N 1 1 325.315 2.653 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593115217 479181777 /nfs/dbraw/zinc/18/17/77/479181777.db2.gz AMUDVZIJJFZSLB-YGRLFVJLSA-N 1 1 325.315 2.653 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593116869 479184132 /nfs/dbraw/zinc/18/41/32/479184132.db2.gz JKDNGBQWCVJCKB-YGRLFVJLSA-N 1 1 325.315 2.653 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593116869 479184141 /nfs/dbraw/zinc/18/41/41/479184141.db2.gz JKDNGBQWCVJCKB-YGRLFVJLSA-N 1 1 325.315 2.653 10 5 EFBEMO COC(=O)c1c(Cl)c(N2CC[N@H+](C)[C@H](C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000596181934 479186248 /nfs/dbraw/zinc/18/62/48/479186248.db2.gz HWTQKALXKODYDV-NXEZZACHSA-N 1 1 341.795 2.564 10 5 EFBEMO COC(=O)c1c(Cl)c(N2CC[N@@H+](C)[C@H](C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000596181934 479186251 /nfs/dbraw/zinc/18/62/51/479186251.db2.gz HWTQKALXKODYDV-NXEZZACHSA-N 1 1 341.795 2.564 10 5 EFBEMO COC(=O)Cc1ccc(NC[C@@H]2CC[N@H+]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000599165701 479191801 /nfs/dbraw/zinc/19/18/01/479191801.db2.gz QRJLJJPGWBOCPR-HNNXBMFYSA-N 1 1 347.415 2.739 10 5 EFBEMO CC[N@@H+]1CCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)[C@@H](C)C1 ZINC000596229734 479213400 /nfs/dbraw/zinc/21/34/00/479213400.db2.gz FDFQBYMLTVHNPX-JTQLQIEISA-N 1 1 341.795 2.565 10 5 EFBEMO CC[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)[C@@H](C)C1 ZINC000596229734 479213410 /nfs/dbraw/zinc/21/34/10/479213410.db2.gz FDFQBYMLTVHNPX-JTQLQIEISA-N 1 1 341.795 2.565 10 5 EFBEMO COc1cc(NC[C@@H]2CCC[N@H+]2CCCO)c(Cl)cc1[N+](=O)[O-] ZINC000596256193 479226948 /nfs/dbraw/zinc/22/69/48/479226948.db2.gz BNCZUPZOHXOMFV-NSHDSACASA-N 1 1 343.811 2.516 10 5 EFBEMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000593188849 479230392 /nfs/dbraw/zinc/23/03/92/479230392.db2.gz CYXYWDNJDXPAAN-JHJVBQTASA-N 1 1 344.415 2.558 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000593203237 479238009 /nfs/dbraw/zinc/23/80/09/479238009.db2.gz IRUCAEBVZHRVSB-ZDUSSCGKSA-N 1 1 339.411 2.932 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000593202965 479238333 /nfs/dbraw/zinc/23/83/33/479238333.db2.gz ALKUVLOOHZYCPI-UHFFFAOYSA-N 1 1 346.431 2.713 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000593204138 479239223 /nfs/dbraw/zinc/23/92/23/479239223.db2.gz VSVZMINGISCLAA-UHFFFAOYSA-N 1 1 339.461 2.781 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000593204926 479239589 /nfs/dbraw/zinc/23/95/89/479239589.db2.gz CTHJSOSBYJNDFF-DLBZAZTESA-N 1 1 333.432 2.792 10 5 EFBEMO CC(C)[N@H+]1CCCC[C@@H]1Cn1c(=O)c([N+](=O)[O-])cc2c1CCCC2 ZINC000596303811 479246751 /nfs/dbraw/zinc/24/67/51/479246751.db2.gz CZNLWHNFYJQQEO-OAHLLOKOSA-N 1 1 333.432 2.898 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000593238477 479254454 /nfs/dbraw/zinc/25/44/54/479254454.db2.gz IYPJFQWXEULCAB-UHFFFAOYSA-N 1 1 326.372 2.833 10 5 EFBEMO C[N@H+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@H]1C(C)(C)C ZINC000603144071 479273297 /nfs/dbraw/zinc/27/32/97/479273297.db2.gz VQXKEHREMIAGMZ-INIZCTEOSA-N 1 1 333.432 2.716 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000596416391 479287037 /nfs/dbraw/zinc/28/70/37/479287037.db2.gz AVHIDSVYUMQSGQ-UHFFFAOYSA-N 1 1 336.436 2.557 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](C(F)F)C1 ZINC000611179354 479304007 /nfs/dbraw/zinc/30/40/07/479304007.db2.gz BMDQIHFGQQYGDG-JTQLQIEISA-N 1 1 343.330 2.519 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](C(F)F)C1 ZINC000611179355 479304533 /nfs/dbraw/zinc/30/45/33/479304533.db2.gz BMDQIHFGQQYGDG-SNVBAGLBSA-N 1 1 343.330 2.519 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](N2CCOCC2)CC1 ZINC000585717004 479316019 /nfs/dbraw/zinc/31/60/19/479316019.db2.gz SQMMAJGOJAUPRW-RDJZCZTQSA-N 1 1 333.432 2.843 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000596513676 479323471 /nfs/dbraw/zinc/32/34/71/479323471.db2.gz BZOFJCQNAYHEJU-HZPDHXFCSA-N 1 1 331.416 2.959 10 5 EFBEMO O=[N+]([O-])c1cccc(F)c1N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000596514861 479324475 /nfs/dbraw/zinc/32/44/75/479324475.db2.gz NOHXJQXMOYXPSZ-HUUCEWRRSA-N 1 1 335.379 2.789 10 5 EFBEMO C[N@@H+](CCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])C1CCCCC1 ZINC000593421386 479332562 /nfs/dbraw/zinc/33/25/62/479332562.db2.gz UXYKVJVVNDELKV-UHFFFAOYSA-N 1 1 337.395 2.657 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)[C@@H](C)C1 ZINC000611273856 479334670 /nfs/dbraw/zinc/33/46/70/479334670.db2.gz PRMZZFGRDIJYMV-ZFWWWQNUSA-N 1 1 349.431 2.528 10 5 EFBEMO C[NH+](C)CCN1CCC(Nc2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593454797 479348334 /nfs/dbraw/zinc/34/83/34/479348334.db2.gz LESNWLPGEPUZTP-UHFFFAOYSA-N 1 1 343.431 2.581 10 5 EFBEMO Cc1c(CN2CCC(C)([NH+]3CCOCC3)CC2)cccc1[N+](=O)[O-] ZINC000599618531 479355281 /nfs/dbraw/zinc/35/52/81/479355281.db2.gz PRYJNEJJXLRDFB-UHFFFAOYSA-N 1 1 333.432 2.590 10 5 EFBEMO C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000599625902 479358952 /nfs/dbraw/zinc/35/89/52/479358952.db2.gz QTQDDZPJXZANQX-ZVXAKGHKSA-N 1 1 332.360 2.546 10 5 EFBEMO O=[N+]([O-])c1ccn(CC[N@H+]2CCc3cc(C(F)(F)F)ccc3C2)n1 ZINC000599635177 479361596 /nfs/dbraw/zinc/36/15/96/479361596.db2.gz NTCBEXSKNLVDSD-UHFFFAOYSA-N 1 1 340.305 2.868 10 5 EFBEMO CCN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC)[C@H]1CC[N@@H+](CC)C1 ZINC000596624135 479362771 /nfs/dbraw/zinc/36/27/71/479362771.db2.gz FJDZRTAUGCVCRS-ZDUSSCGKSA-N 1 1 336.392 2.551 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000599644492 479366263 /nfs/dbraw/zinc/36/62/63/479366263.db2.gz BFXZBXOGQLSCKH-ZNMIVQPWSA-N 1 1 336.363 2.898 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000599644492 479366268 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10 5 EFBEMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21 ZINC000599682638 479388589 /nfs/dbraw/zinc/38/85/89/479388589.db2.gz GETIDUDLENHNHC-CUOATXAZSA-N 1 1 341.205 2.703 10 5 EFBEMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21 ZINC000599682638 479388597 /nfs/dbraw/zinc/38/85/97/479388597.db2.gz GETIDUDLENHNHC-CUOATXAZSA-N 1 1 341.205 2.703 10 5 EFBEMO COc1cc(C[N@H+](C)[C@@H]2CCCc3c2cnn3C)ccc1[N+](=O)[O-] ZINC000611516755 479403111 /nfs/dbraw/zinc/40/31/11/479403111.db2.gz RHWPERNSUYYFKB-CQSZACIVSA-N 1 1 330.388 2.846 10 5 EFBEMO COc1cc(C[N@@H+](C)[C@@H]2CCCc3c2cnn3C)ccc1[N+](=O)[O-] ZINC000611516755 479403115 /nfs/dbraw/zinc/40/31/15/479403115.db2.gz RHWPERNSUYYFKB-CQSZACIVSA-N 1 1 330.388 2.846 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3C[C@@H]4C[C@H]3C[S@@]4=O)o2)c1 ZINC000593686440 479422677 /nfs/dbraw/zinc/42/26/77/479422677.db2.gz DNRHKWFEWBAAGG-HMFCALDFSA-N 1 1 332.381 2.560 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3C[C@@H]4C[C@H]3C[S@@]4=O)o2)c1 ZINC000593686440 479422682 /nfs/dbraw/zinc/42/26/82/479422682.db2.gz DNRHKWFEWBAAGG-HMFCALDFSA-N 1 1 332.381 2.560 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@@H]3C[C@H]2C[S@@]3=O)o1 ZINC000593689880 479424402 /nfs/dbraw/zinc/42/44/02/479424402.db2.gz YHTXCWYVTSVAFW-HNDXJFMUSA-N 1 1 332.381 2.560 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@@H]3C[C@H]2C[S@@]3=O)o1 ZINC000593689880 479424406 /nfs/dbraw/zinc/42/44/06/479424406.db2.gz YHTXCWYVTSVAFW-HNDXJFMUSA-N 1 1 332.381 2.560 10 5 EFBEMO CC[C@H](C)[N@@H+](C)CCNC(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599830654 479443179 /nfs/dbraw/zinc/44/31/79/479443179.db2.gz WFBSMGJOTDPSCL-LBPRGKRZSA-N 1 1 345.403 2.995 10 5 EFBEMO O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000588816154 479444224 /nfs/dbraw/zinc/44/42/24/479444224.db2.gz LYBOGPZRDDLPGW-ZIAGYGMSSA-N 1 1 341.770 2.507 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000596828512 479444998 /nfs/dbraw/zinc/44/49/98/479444998.db2.gz LKMLQNIZOODBLO-UHFFFAOYSA-N 1 1 338.408 2.845 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](OCC(C)C)C2)c1 ZINC000589505312 479535573 /nfs/dbraw/zinc/53/55/73/479535573.db2.gz FLOYPBZZJVBGRS-HNNXBMFYSA-N 1 1 336.388 2.628 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](OCC(C)C)C2)c1 ZINC000589505312 479535577 /nfs/dbraw/zinc/53/55/77/479535577.db2.gz FLOYPBZZJVBGRS-HNNXBMFYSA-N 1 1 336.388 2.628 10 5 EFBEMO Cn1ncc(C2CCC2)c1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000597118613 479581764 /nfs/dbraw/zinc/58/17/64/479581764.db2.gz YRTPVHDGJYVMRV-UHFFFAOYSA-N 1 1 340.387 2.762 10 5 EFBEMO C[N@H+]1C[C@H]2CCN(C(=O)c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)[C@@H]2C1 ZINC000590044641 479595287 /nfs/dbraw/zinc/59/52/87/479595287.db2.gz KALJCNQOMFSRFG-CZUORRHYSA-N 1 1 331.416 2.668 10 5 EFBEMO C[N@@H+]1C[C@H]2[C@@H](CCN2Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000590052575 479596514 /nfs/dbraw/zinc/59/65/14/479596514.db2.gz DZTNHPSAXPJWKI-YOEHRIQHSA-N 1 1 327.384 2.991 10 5 EFBEMO CN1C[C@H]2[C@@H](CC[N@@H+]2Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000590052575 479596520 /nfs/dbraw/zinc/59/65/20/479596520.db2.gz DZTNHPSAXPJWKI-YOEHRIQHSA-N 1 1 327.384 2.991 10 5 EFBEMO CN1C[C@H]2[C@@H](CC[N@H+]2Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000590052575 479596525 /nfs/dbraw/zinc/59/65/25/479596525.db2.gz DZTNHPSAXPJWKI-YOEHRIQHSA-N 1 1 327.384 2.991 10 5 EFBEMO CO[C@@]1(CO)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000597186084 479611404 /nfs/dbraw/zinc/61/14/04/479611404.db2.gz BFIUHGSSGNZODE-SFHVURJKSA-N 1 1 346.383 2.828 10 5 EFBEMO C[N@H+]1C[C@@H]2CCN(Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)[C@@H]2C1 ZINC000590183923 479614534 /nfs/dbraw/zinc/61/45/34/479614534.db2.gz DWIPWEVYHVRPCK-IINYFYTJSA-N 1 1 329.322 2.750 10 5 EFBEMO CC[C@H](NC(=O)[C@@H]1CCc2c[nH+]c(C)n2C1)c1cccc([N+](=O)[O-])c1 ZINC000590443486 479648378 /nfs/dbraw/zinc/64/83/78/479648378.db2.gz VVBZKJWWQQATIJ-PBHICJAKSA-N 1 1 342.399 2.930 10 5 EFBEMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2C[N@@H+](C)C[C@H]21 ZINC000590445866 479648843 /nfs/dbraw/zinc/64/88/43/479648843.db2.gz TXOBBBMJRXDKIV-SWLSCSKDSA-N 1 1 349.456 2.873 10 5 EFBEMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C2CC(N3CCCCC3)C2)n1 ZINC000619466098 479801747 /nfs/dbraw/zinc/80/17/47/479801747.db2.gz MBMZHZFWBZQCQB-BHUNQDJPSA-N 1 1 347.463 2.882 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000610002475 480226721 /nfs/dbraw/zinc/22/67/21/480226721.db2.gz MQTYGCDJWDZRQL-CRAIPNDOSA-N 1 1 333.432 2.843 10 5 EFBEMO COc1ccc(OCC[N@H+]2CCC[C@H](n3ccnc3)C2)c([N+](=O)[O-])c1 ZINC000610368696 480291655 /nfs/dbraw/zinc/29/16/55/480291655.db2.gz CUNJIWSMJHWERY-AWEZNQCLSA-N 1 1 346.387 2.516 10 5 EFBEMO CCOc1ccc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)cc1[N+](=O)[O-] ZINC000119103026 520898770 /nfs/dbraw/zinc/89/87/70/520898770.db2.gz DZURBCUNOFRJTL-LSDHHAIUSA-N 1 1 347.415 2.550 10 5 EFBEMO C[NH+](C)[C@@H](CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccco1 ZINC000120292180 522022577 /nfs/dbraw/zinc/02/25/77/522022577.db2.gz YHVHXYYYWIOKAU-HNNXBMFYSA-N 1 1 342.355 2.702 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)NCC[N@H+]1CCCC[C@@H]1C ZINC000156104878 522979636 /nfs/dbraw/zinc/97/96/36/522979636.db2.gz VZBYORIEMIIKJT-LBPRGKRZSA-N 1 1 336.392 2.599 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000183327097 525563225 /nfs/dbraw/zinc/56/32/25/525563225.db2.gz JWQQFLUHZQHGRI-GOSISDBHSA-N 1 1 333.432 2.590 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000183327132 525563410 /nfs/dbraw/zinc/56/34/10/525563410.db2.gz JWQQFLUHZQHGRI-SFHVURJKSA-N 1 1 333.432 2.590 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(c2cc[nH]n2)CC1 ZINC000195506367 526168844 /nfs/dbraw/zinc/16/88/44/526168844.db2.gz GHNVKPRYSGIVTR-GFCCVEGCSA-N 1 1 343.387 2.525 10 5 EFBEMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000245619144 526524773 /nfs/dbraw/zinc/52/47/73/526524773.db2.gz WFBOAUCKXGNQFW-HZPDHXFCSA-N 1 1 330.388 2.805 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1ccc(Cl)cc1 ZINC000341173499 536458007 /nfs/dbraw/zinc/45/80/07/536458007.db2.gz VDBCZEYTGSJXOB-DOMZBBRYSA-N 1 1 348.790 2.752 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1ccc(Cl)cc1 ZINC000341173499 536458011 /nfs/dbraw/zinc/45/80/11/536458011.db2.gz VDBCZEYTGSJXOB-DOMZBBRYSA-N 1 1 348.790 2.752 10 5 EFBEMO O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000195222218 527261716 /nfs/dbraw/zinc/26/17/16/527261716.db2.gz KOJYBUADRJTCKA-GFCCVEGCSA-N 1 1 338.795 2.950 10 5 EFBEMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3cc[nH]n3)CC2)c2c(c1)COCO2 ZINC000195506575 527328887 /nfs/dbraw/zinc/32/88/87/527328887.db2.gz FERYVILHXALCIH-UHFFFAOYSA-N 1 1 344.371 2.564 10 5 EFBEMO O=[N+]([O-])c1ccc(OCCC[NH+]2CCC(c3ccn[nH]3)CC2)cc1 ZINC000195507152 527370666 /nfs/dbraw/zinc/37/06/66/527370666.db2.gz PRYPTZSCAPOMDB-UHFFFAOYSA-N 1 1 330.388 2.966 10 5 EFBEMO CC(C)Oc1cc(C(=O)N2[C@@H](C)C[NH+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000412216491 534945739 /nfs/dbraw/zinc/94/57/39/534945739.db2.gz ODSKDFXRVMLEAX-STQMWFEESA-N 1 1 335.404 2.547 10 5 EFBEMO C[N@@H+]1CCC[C@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000683541629 549915141 /nfs/dbraw/zinc/91/51/41/549915141.db2.gz LRTAWIIXOPCIGF-ZDUSSCGKSA-N 1 1 335.407 2.505 10 5 EFBEMO C[N@H+]1CCC[C@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000683541629 549915143 /nfs/dbraw/zinc/91/51/43/549915143.db2.gz LRTAWIIXOPCIGF-ZDUSSCGKSA-N 1 1 335.407 2.505 10 5 EFBEMO Cc1cnc(CC[N@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)s1 ZINC000754796274 575492569 /nfs/dbraw/zinc/49/25/69/575492569.db2.gz YMGNNHSCRMMAQO-UHFFFAOYSA-N 1 1 346.416 2.545 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000755298003 575571564 /nfs/dbraw/zinc/57/15/64/575571564.db2.gz WFYQNQWECGJMHE-IVOILVROSA-N 1 1 329.400 2.599 10 5 EFBEMO Cc1cn(C[N@H+]2CC[C@H](C(C)C)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000755924563 575657767 /nfs/dbraw/zinc/65/77/67/575657767.db2.gz OBDFKFAPGQQGJW-HNNXBMFYSA-N 1 1 344.415 2.791 10 5 EFBEMO Cc1cn(C[N@@H+]2CC[C@H](C(C)C)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000755924563 575657772 /nfs/dbraw/zinc/65/77/72/575657772.db2.gz OBDFKFAPGQQGJW-HNNXBMFYSA-N 1 1 344.415 2.791 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H]1COc3ccccc3O1)C2 ZINC000757163586 575830410 /nfs/dbraw/zinc/83/04/10/575830410.db2.gz NWIWGERQTOOPEO-CQSZACIVSA-N 1 1 326.352 2.793 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1COc3ccccc3O1)C2 ZINC000757163586 575830411 /nfs/dbraw/zinc/83/04/11/575830411.db2.gz NWIWGERQTOOPEO-CQSZACIVSA-N 1 1 326.352 2.793 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)OCC[NH+]2CCSCC2)c1 ZINC000757928139 575856009 /nfs/dbraw/zinc/85/60/09/575856009.db2.gz VNZXIRKMUFQGCL-UHFFFAOYSA-N 1 1 342.442 2.522 10 5 EFBEMO CCCCCC[C@H](O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000759391480 575890728 /nfs/dbraw/zinc/89/07/28/575890728.db2.gz YIXKJOJXAOCLAO-HOCLYGCPSA-N 1 1 336.436 2.807 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761291817 576141053 /nfs/dbraw/zinc/14/10/53/576141053.db2.gz KBUAOJGIWCPLOO-HUUCEWRRSA-N 1 1 344.415 2.959 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@H]3COCC[C@@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000761294598 576141386 /nfs/dbraw/zinc/14/13/86/576141386.db2.gz YFVNJAZXWGRXRH-BBRMVZONSA-N 1 1 330.388 2.711 10 5 EFBEMO CC(=O)c1c(NCCC[NH+]2C[C@@H](C)O[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000763206418 576366992 /nfs/dbraw/zinc/36/69/92/576366992.db2.gz IASLLUUMPWYCKO-CHWSQXEVSA-N 1 1 335.404 2.709 10 5 EFBEMO O=C1C[C@@H]([C@@H]2CCCC[N@@H+]2Cc2cc(Cl)ccc2[N+](=O)[O-])CN1 ZINC000764466768 576461141 /nfs/dbraw/zinc/46/11/41/576461141.db2.gz QTAZDZDUAPMSCM-RISCZKNCSA-N 1 1 337.807 2.739 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H](Cc3ccncc3)C2)cc1 ZINC000765006841 576535598 /nfs/dbraw/zinc/53/55/98/576535598.db2.gz YYXAGZCMNZMRML-CRAIPNDOSA-N 1 1 327.384 2.588 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CNC(=S)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000774579682 581494540 /nfs/dbraw/zinc/49/45/40/581494540.db2.gz HKYPCINFYQQZEA-STQMWFEESA-N 1 1 336.461 2.604 10 5 EFBEMO COC(OC)[C@H](C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000922312025 1265458741 /nfs/dbraw/zinc/45/87/41/1265458741.db2.gz PWNGCUJGGKVYSN-JTQLQIEISA-N 1 1 337.401 2.815 10 5 EFBEMO CC[N@H+]1C[C@@H](C)N(C(=O)NCc2ccc(C)c([N+](=O)[O-])c2)C[C@H]1C ZINC001687333884 1248260400 /nfs/dbraw/zinc/26/04/00/1248260400.db2.gz NNENIKSJKDYKMW-ZIAGYGMSSA-N 1 1 334.420 2.527 10 5 EFBEMO COc1cc(C[NH2+][C@H]2C[C@H](O)c3ccccc32)c([N+](=O)[O-])cc1O ZINC000850371459 1250451859 /nfs/dbraw/zinc/45/18/59/1250451859.db2.gz JVNZALLKDDDPES-ZFWWWQNUSA-N 1 1 330.340 2.577 10 5 EFBEMO CO[C@@H]1CC[C@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000851035538 1250765471 /nfs/dbraw/zinc/76/54/71/1250765471.db2.gz QDESCTGNJYSJOM-UAGQMJEPSA-N 1 1 348.399 2.527 10 5 EFBEMO CO[C@@H]1CC[C@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000851035538 1250765480 /nfs/dbraw/zinc/76/54/80/1250765480.db2.gz QDESCTGNJYSJOM-UAGQMJEPSA-N 1 1 348.399 2.527 10 5 EFBEMO C[C@H]1[C@@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[N@H+]1C ZINC000922557331 1266253325 /nfs/dbraw/zinc/25/33/25/1266253325.db2.gz OEHUDWNIUGSRKS-NHYWBVRUSA-N 1 1 332.429 2.901 10 5 EFBEMO C[C@H]1[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCN1C ZINC000922557331 1266253336 /nfs/dbraw/zinc/25/33/36/1266253336.db2.gz OEHUDWNIUGSRKS-NHYWBVRUSA-N 1 1 332.429 2.901 10 5 EFBEMO C[C@@H]1CN(Cc2cc([N+](=O)[O-])ccc2Br)CC[C@@H]1C[NH3+] ZINC000923494412 1261780078 /nfs/dbraw/zinc/78/00/78/1261780078.db2.gz WYRJFBOKXSIWFZ-GHMZBOCLSA-N 1 1 342.237 2.774 10 5 EFBEMO CCOc1cc(NC(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000823366335 1265316648 /nfs/dbraw/zinc/31/66/48/1265316648.db2.gz HMIYBPCQLKBHDC-NEPJUHHUSA-N 1 1 336.392 2.550 10 5 EFBEMO CCOc1cc(NC(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000823366338 1265317160 /nfs/dbraw/zinc/31/71/60/1265317160.db2.gz HMIYBPCQLKBHDC-VXGBXAGGSA-N 1 1 336.392 2.550 10 5 EFBEMO COC(=O)/C=C\c1ccc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000742412364 1270040071 /nfs/dbraw/zinc/04/00/71/1270040071.db2.gz PUNJFXNVONRXBM-DOFRETIQSA-N 1 1 333.388 2.676 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NCc1c[nH+]c2n1CCCC2 ZINC001128873750 1271284744 /nfs/dbraw/zinc/28/47/44/1271284744.db2.gz LTIGYDNUNCEYRN-UHFFFAOYSA-N 1 1 332.335 2.505 10 5 EFBEMO O=[N+]([O-])CC[NH2+][C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1 ZINC001169187881 1272729418 /nfs/dbraw/zinc/72/94/18/1272729418.db2.gz MXFPUPWXDUOUOW-INIZCTEOSA-N 1 1 328.347 2.783 10 5 EFBEMO C[C@H](CO)[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)CC1CCC1 ZINC001169703871 1273107936 /nfs/dbraw/zinc/10/79/36/1273107936.db2.gz DBJRIMMORSUDDJ-GFCCVEGCSA-N 1 1 346.387 2.628 10 5 EFBEMO O=C1O[C@@H](C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CN1C1CC1 ZINC000844338541 1278895808 /nfs/dbraw/zinc/89/58/08/1278895808.db2.gz QLUVDNPREBYHNY-YOEHRIQHSA-N 1 1 345.399 2.757 10 5 EFBEMO CC(C)[N@@H+](CCCNC(=O)C1CC1)Cc1csc([N+](=O)[O-])c1 ZINC001691695632 1275497080 /nfs/dbraw/zinc/49/70/80/1275497080.db2.gz FFXGOWYXYHQFQW-UHFFFAOYSA-N 1 1 325.434 2.783 10 5 EFBEMO CN(C(=O)C[N@@H+]1CCC[C@@]2(CC2(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000844441425 1279010791 /nfs/dbraw/zinc/01/07/91/1279010791.db2.gz YVMNVESKCPUCQD-OAHLLOKOSA-N 1 1 339.342 2.679 10 5 EFBEMO CN(C(=O)C[N@H+]1CCC[C@@]2(CC2(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000844441425 1279010802 /nfs/dbraw/zinc/01/08/02/1279010802.db2.gz YVMNVESKCPUCQD-OAHLLOKOSA-N 1 1 339.342 2.679 10 5 EFBEMO C/C(=C\C(=O)N1CC[C@]2(C1)CCC[N@H+](C)C2)c1ccc([N+](=O)[O-])cc1 ZINC000818178949 1276479332 /nfs/dbraw/zinc/47/93/32/1276479332.db2.gz VSMWYYPOLAQPSI-LBKOFNPBSA-N 1 1 343.427 2.942 10 5 EFBEMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N)CC1 ZINC000789923108 1277072591 /nfs/dbraw/zinc/07/25/91/1277072591.db2.gz FXWVMCXNDUQPTG-UHFFFAOYSA-N 1 1 346.431 2.585 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC000923271822 1277441435 /nfs/dbraw/zinc/44/14/35/1277441435.db2.gz WBQXTPMEGNOWRG-FONJURLJSA-N 1 1 329.400 2.693 10 5 EFBEMO Cc1c(CON=C(N)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cccc1[N+](=O)[O-] ZINC000871786143 1287288073 /nfs/dbraw/zinc/28/80/73/1287288073.db2.gz RURJDAKFQBKLSB-GOOCMWNKSA-N 1 1 332.404 2.774 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](Cc1ccnc(Br)c1)CC2 ZINC000815084260 1287307390 /nfs/dbraw/zinc/30/73/90/1287307390.db2.gz ZAOUUYRKWYQPIC-UHFFFAOYSA-N 1 1 349.188 2.706 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](Cc1ccnc(Br)c1)CC2 ZINC000815084260 1287307394 /nfs/dbraw/zinc/30/73/94/1287307394.db2.gz ZAOUUYRKWYQPIC-UHFFFAOYSA-N 1 1 349.188 2.706 10 5 EFBEMO C/C(=C\C(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000844642731 1279163526 /nfs/dbraw/zinc/16/35/26/1279163526.db2.gz KNLSWDBDEPQKED-DDQKFYEASA-N 1 1 331.416 2.938 10 5 EFBEMO C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001175301179 1287370803 /nfs/dbraw/zinc/37/08/03/1287370803.db2.gz OAHLIGBHKFXACP-RSQPEXBXSA-N 1 1 332.360 2.546 10 5 EFBEMO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCCN2Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000846227185 1280077725 /nfs/dbraw/zinc/07/77/25/1280077725.db2.gz IQKFRPONQJJMAO-PVAVHDDUSA-N 1 1 337.395 2.595 10 5 EFBEMO CC(C)C[N@H+]1CCO[C@H](CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872017818 1287400751 /nfs/dbraw/zinc/40/07/51/1287400751.db2.gz FHYSWOTYYNFRBZ-ZIAGYGMSSA-N 1 1 339.411 2.741 10 5 EFBEMO CCO[C@H](CC[NH+](C)C)CN[C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872041666 1287409454 /nfs/dbraw/zinc/40/94/54/1287409454.db2.gz JRBJBPQIXUEEPF-CHWSQXEVSA-N 1 1 327.400 2.741 10 5 EFBEMO C[C@H]([NH2+][C@@H](CO)C[C@@H](O)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872070645 1287419764 /nfs/dbraw/zinc/41/97/64/1287419764.db2.gz VTSVRWBOJWAOBX-MISXGVKJSA-N 1 1 328.384 2.543 10 5 EFBEMO C[C@@H]([NH2+]CCC(C)(C)S(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-] ZINC000872079708 1287422585 /nfs/dbraw/zinc/42/25/85/1287422585.db2.gz ONPTXCIZXVEJQJ-SNVBAGLBSA-N 1 1 332.397 2.598 10 5 EFBEMO C[C@@H]([NH2+]CC[S@](=O)CC(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872085877 1287424111 /nfs/dbraw/zinc/42/41/11/1287424111.db2.gz RNSRSYPCMFDDOO-PJLCYMMNSA-N 1 1 342.314 2.696 10 5 EFBEMO C[C@H]([NH2+]CCOCC(=O)OC(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872090683 1287426457 /nfs/dbraw/zinc/42/64/57/1287426457.db2.gz DTDKZITVSBREIF-NSHDSACASA-N 1 1 342.367 2.743 10 5 EFBEMO CCN1C[C@@H](C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)OC1=O ZINC000846957475 1280659212 /nfs/dbraw/zinc/65/92/12/1280659212.db2.gz LIUZGKAEUGTHTH-GDBMZVCRSA-N 1 1 333.388 2.615 10 5 EFBEMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000846989780 1280676028 /nfs/dbraw/zinc/67/60/28/1280676028.db2.gz USAIIKVCWPXZFW-OBEJXRGXSA-N 1 1 331.416 2.941 10 5 EFBEMO CC[N@H+]1C[C@@H](C)N(C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC001137931384 1280980339 /nfs/dbraw/zinc/98/03/39/1280980339.db2.gz PBWHLCOIMJWNJL-VXGBXAGGSA-N 1 1 339.823 2.732 10 5 EFBEMO O=C(C[NH2+][C@@H]1CCCn2nccc21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC001175643117 1287499885 /nfs/dbraw/zinc/49/98/85/1287499885.db2.gz LVMYMSCRKGEHHM-LLVKDONJSA-N 1 1 349.778 2.508 10 5 EFBEMO CN1CCCC[C@H]([N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1=O ZINC000872265260 1287509871 /nfs/dbraw/zinc/50/98/71/1287509871.db2.gz MTKKFWTXCGSHLF-ZDUSSCGKSA-N 1 1 325.796 2.691 10 5 EFBEMO CN1CCCC[C@H]([N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1=O ZINC000872265260 1287509874 /nfs/dbraw/zinc/50/98/74/1287509874.db2.gz MTKKFWTXCGSHLF-ZDUSSCGKSA-N 1 1 325.796 2.691 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C1CN(C(=O)OC(C)(C)C)C1 ZINC000811515199 1284392187 /nfs/dbraw/zinc/39/21/87/1284392187.db2.gz OLYFSFWDYLMZNK-UHFFFAOYSA-N 1 1 335.404 2.954 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C1CN(C(=O)OC(C)(C)C)C1 ZINC000811515199 1284392194 /nfs/dbraw/zinc/39/21/94/1284392194.db2.gz OLYFSFWDYLMZNK-UHFFFAOYSA-N 1 1 335.404 2.954 10 5 EFBEMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@H]([C@@H]4CCOC4)C3)c2c1 ZINC000747828707 1285553282 /nfs/dbraw/zinc/55/32/82/1285553282.db2.gz HPGFWKCZLQXIGS-LSDHHAIUSA-N 1 1 330.388 2.651 10 5 EFBEMO CCOCC1(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000813174602 1285704894 /nfs/dbraw/zinc/70/48/94/1285704894.db2.gz ZIWCMJUCNZNEAV-INIZCTEOSA-N 1 1 348.399 2.529 10 5 EFBEMO CCOCC1(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000813174602 1285704901 /nfs/dbraw/zinc/70/49/01/1285704901.db2.gz ZIWCMJUCNZNEAV-INIZCTEOSA-N 1 1 348.399 2.529 10 5 EFBEMO C[C@H](C(=O)O[C@@H](C)C[N+](=O)[O-])[NH+]1CCC(Cc2ccccc2)CC1 ZINC000814049543 1286278108 /nfs/dbraw/zinc/27/81/08/1286278108.db2.gz SICLYUGTCYCDQB-LSDHHAIUSA-N 1 1 334.416 2.538 10 5 EFBEMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](c3ncccn3)C2)cc1 ZINC001176525135 1288018309 /nfs/dbraw/zinc/01/83/09/1288018309.db2.gz WEBMJWBXLUHFNH-CQSZACIVSA-N 1 1 328.372 2.643 10 5 EFBEMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H](c3ncccn3)C2)cc1 ZINC001176525134 1288018854 /nfs/dbraw/zinc/01/88/54/1288018854.db2.gz WEBMJWBXLUHFNH-AWEZNQCLSA-N 1 1 328.372 2.643 10 5 EFBEMO CC(C)[C@@H]1C[C@H](N2CCCC2)C[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001176887186 1288162453 /nfs/dbraw/zinc/16/24/53/1288162453.db2.gz PGFOPJIELKVBKW-FHWLQOOXSA-N 1 1 347.459 2.823 10 5 EFBEMO CC(C)[C@@H]1C[C@H](N2CCCC2)C[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001176887186 1288162458 /nfs/dbraw/zinc/16/24/58/1288162458.db2.gz PGFOPJIELKVBKW-FHWLQOOXSA-N 1 1 347.459 2.823 10 5 EFBEMO C[N@H+]1C[C@@H]2CCN(C(=O)c3cc(Cl)cc(Cl)c3[N+](=O)[O-])[C@@H]2C1 ZINC000816952713 1288336748 /nfs/dbraw/zinc/33/67/48/1288336748.db2.gz QKJOPOTYGPERTI-QPUJVOFHSA-N 1 1 344.198 2.678 10 5 EFBEMO CCN(C(=O)Nc1cccc([N+](=O)[O-])c1Cl)[C@@H]1CC[N@@H+](C)C1 ZINC000823254567 1289250115 /nfs/dbraw/zinc/25/01/15/1289250115.db2.gz YLQNWBMUIFCVBI-SNVBAGLBSA-N 1 1 326.784 2.806 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000823993972 1289510069 /nfs/dbraw/zinc/51/00/69/1289510069.db2.gz MKLAAERPTUJVOE-TXEJJXNPSA-N 1 1 335.408 2.561 10 5 EFBEMO Cc1cc(C)c(Cn2c(=O)onc2-c2cccc([N+](=O)[O-])c2)c(C)[nH+]1 ZINC001166038340 1312721859 /nfs/dbraw/zinc/72/18/59/1312721859.db2.gz GQPHQYHNMHMMPH-UHFFFAOYSA-N 1 1 340.339 2.780 10 5 EFBEMO CC[N@@H+](C)[C@H]1CCN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC001181841018 1289971933 /nfs/dbraw/zinc/97/19/33/1289971933.db2.gz VDRGZFLQXZGZJB-INIZCTEOSA-N 1 1 331.416 2.569 10 5 EFBEMO CCC[C@H]1CN(c2cc(C)sc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC001185848637 1290778516 /nfs/dbraw/zinc/77/85/16/1290778516.db2.gz PHNPIGSEBOWOOX-ZDUSSCGKSA-N 1 1 327.450 2.902 10 5 EFBEMO CCOC(=O)[C@@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])C[C@H]1C(F)(F)F ZINC000877839146 1291401504 /nfs/dbraw/zinc/40/15/04/1291401504.db2.gz AGJDEMMGCPEMBV-VXGBXAGGSA-N 1 1 346.305 2.768 10 5 EFBEMO CCOC(=O)[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])C[C@H]1C(F)(F)F ZINC000877839146 1291401509 /nfs/dbraw/zinc/40/15/09/1291401509.db2.gz AGJDEMMGCPEMBV-VXGBXAGGSA-N 1 1 346.305 2.768 10 5 EFBEMO CCc1ccc(C[NH+]2CCN(Cc3cccnc3[N+](=O)[O-])CC2)cc1 ZINC001197347651 1294506953 /nfs/dbraw/zinc/50/69/53/1294506953.db2.gz AMGNCRDRMGGHHC-UHFFFAOYSA-N 1 1 340.427 2.870 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](c2cn(C)nn2)C1 ZINC001198612298 1295147511 /nfs/dbraw/zinc/14/75/11/1295147511.db2.gz NDSJLMJFIAANLV-KBPBESRZSA-N 1 1 329.404 2.972 10 5 EFBEMO COc1ccc(COC(=O)CC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000803856211 1313259128 /nfs/dbraw/zinc/25/91/28/1313259128.db2.gz MVAJZZUNXMWWOX-CQSZACIVSA-N 1 1 336.388 2.911 10 5 EFBEMO C[N@H+]1CCCC[C@@H]1CCC(=O)OCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000803857500 1313261068 /nfs/dbraw/zinc/26/10/68/1313261068.db2.gz XFLHSRYTNSYZTF-CQSZACIVSA-N 1 1 334.372 2.585 10 5 EFBEMO C[N@H+]1C[C@@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])c(Cl)c3)C[C@]2(C)C1 ZINC000930160681 1297241366 /nfs/dbraw/zinc/24/13/66/1297241366.db2.gz VHWGUIDIGBZTBV-BMIGLBTASA-N 1 1 338.795 2.664 10 5 EFBEMO O=[N+]([O-])c1cccnc1N1CC[NH+](C[C@@H]2CCCC3(CCC3)O2)CC1 ZINC000930680899 1297281259 /nfs/dbraw/zinc/28/12/59/1297281259.db2.gz PHAZRZHUZXODRW-HNNXBMFYSA-N 1 1 346.431 2.604 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCc2nc[nH]c2C12CCC2 ZINC000931678751 1297361791 /nfs/dbraw/zinc/36/17/91/1297361791.db2.gz DPIHNJXFCFIIEX-UHFFFAOYSA-N 1 1 328.372 2.634 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCc2nc[nH]c2C12CCC2 ZINC000931678751 1297361796 /nfs/dbraw/zinc/36/17/96/1297361796.db2.gz DPIHNJXFCFIIEX-UHFFFAOYSA-N 1 1 328.372 2.634 10 5 EFBEMO O=C(NCCC[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CC1)C1CCC1 ZINC001490361542 1298851446 /nfs/dbraw/zinc/85/14/46/1298851446.db2.gz MWNSVBFYQVQOQO-UHFFFAOYSA-N 1 1 337.445 2.927 10 5 EFBEMO O=C(NCCC[N@H+](Cc1csc([N+](=O)[O-])c1)C1CC1)C1CCC1 ZINC001490361542 1298851454 /nfs/dbraw/zinc/85/14/54/1298851454.db2.gz MWNSVBFYQVQOQO-UHFFFAOYSA-N 1 1 337.445 2.927 10 5 EFBEMO Cc1cc(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])n(C)n1 ZINC000688915531 1298973738 /nfs/dbraw/zinc/97/37/38/1298973738.db2.gz UKSXGXPDUODXCW-UHFFFAOYSA-N 1 1 339.193 2.689 10 5 EFBEMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585843 1299653001 /nfs/dbraw/zinc/65/30/01/1299653001.db2.gz ANCNKVZUMVKQRG-FZKQIMNGSA-N 1 1 330.384 2.897 10 5 EFBEMO C[C@@]12COC[C@H]1C[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C2 ZINC000852535020 1299743202 /nfs/dbraw/zinc/74/32/02/1299743202.db2.gz TYMITXXQHDNSRC-BXUZGUMPSA-N 1 1 341.205 2.826 10 5 EFBEMO C[C@@]12COC[C@H]1C[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C2 ZINC000852535020 1299743212 /nfs/dbraw/zinc/74/32/12/1299743212.db2.gz TYMITXXQHDNSRC-BXUZGUMPSA-N 1 1 341.205 2.826 10 5 EFBEMO COc1cc(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)c(Cl)cc1[N+](=O)[O-] ZINC000853242738 1300063719 /nfs/dbraw/zinc/06/37/19/1300063719.db2.gz WLAVYEXGVRYAPL-WDEREUQCSA-N 1 1 341.795 2.532 10 5 EFBEMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+](CCC1CC1)CC1CC1 ZINC000853606484 1300191399 /nfs/dbraw/zinc/19/13/99/1300191399.db2.gz MLASVBFKNYSWBV-UHFFFAOYSA-N 1 1 331.372 2.972 10 5 EFBEMO C[N@@H+](C[C@H]1CC1(C)C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000853627860 1300199782 /nfs/dbraw/zinc/19/97/82/1300199782.db2.gz IBAJISBOHILWIS-GDBMZVCRSA-N 1 1 331.416 2.846 10 5 EFBEMO COc1cc(N2CCC([N@H+]3CCCOCC3)CC2)c([N+](=O)[O-])cc1C ZINC000853688375 1300231055 /nfs/dbraw/zinc/23/10/55/1300231055.db2.gz NMUFZCXHEVUFGJ-UHFFFAOYSA-N 1 1 349.431 2.603 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC000854735835 1300682633 /nfs/dbraw/zinc/68/26/33/1300682633.db2.gz YBPRCHNHWKQFIA-QZEGLACASA-N 1 1 343.427 2.942 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[N@H+](C(C)(C)C)C1 ZINC000855286362 1300888567 /nfs/dbraw/zinc/88/85/67/1300888567.db2.gz PQCUGHOYIDNTJR-HFBDAHEESA-N 1 1 331.416 2.987 10 5 EFBEMO CCN(C(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](CC)C1 ZINC000855489598 1300978568 /nfs/dbraw/zinc/97/85/68/1300978568.db2.gz AVMQIAMYJQAZPT-BHEFUSTPSA-N 1 1 331.416 2.941 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]2CCC[C@H]21 ZINC000859954096 1301649402 /nfs/dbraw/zinc/64/94/02/1301649402.db2.gz KNKGCHRBUJEUCD-GZBFAFLISA-N 1 1 336.363 2.898 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]2CCC[C@H]21 ZINC000859954096 1301649407 /nfs/dbraw/zinc/64/94/07/1301649407.db2.gz KNKGCHRBUJEUCD-GZBFAFLISA-N 1 1 336.363 2.898 10 5 EFBEMO COCC[N@H+]1CCC[C@H]1COC(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1 ZINC000861036172 1301993572 /nfs/dbraw/zinc/99/35/72/1301993572.db2.gz WIQVWDZERNEKJG-VSOYFRJCSA-N 1 1 348.399 2.652 10 5 EFBEMO C[N@H+]1C[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc4ccccc43)[C@@H]2C1 ZINC000861807856 1302210569 /nfs/dbraw/zinc/21/05/69/1302210569.db2.gz GLRHYCHWXMGMRB-CXAGYDPISA-N 1 1 325.368 2.524 10 5 EFBEMO C/C(=C\C(=O)NC[C@@H]1CCCC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000862793581 1302462531 /nfs/dbraw/zinc/46/25/31/1302462531.db2.gz QCLJDNHUPZYXCT-GOFCXVBSSA-N 1 1 331.416 2.846 10 5 EFBEMO C[N@@H+](CCNc1cc(F)c([N+](=O)[O-])cc1CO)C1CCCCC1 ZINC000865470735 1303272073 /nfs/dbraw/zinc/27/20/73/1303272073.db2.gz FRMWZFVGIXVNHF-UHFFFAOYSA-N 1 1 325.384 2.903 10 5 EFBEMO CC[N@@H+](CCNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1)C(C)C ZINC000865818808 1303417021 /nfs/dbraw/zinc/41/70/21/1303417021.db2.gz FVZIFVFDSMPPSB-UHFFFAOYSA-N 1 1 333.432 2.863 10 5 EFBEMO Cc1ccccc1C[N@@H+]1CCO[C@@H](CNc2ccc([N+](=O)[O-])cn2)C1 ZINC000866140655 1303541097 /nfs/dbraw/zinc/54/10/97/1303541097.db2.gz KZUWMLOOJJOZHY-KRWDZBQOSA-N 1 1 342.399 2.611 10 5 EFBEMO Cc1ccccc1C[N@H+]1CCO[C@@H](CNc2ccc([N+](=O)[O-])cn2)C1 ZINC000866140655 1303541101 /nfs/dbraw/zinc/54/11/01/1303541101.db2.gz KZUWMLOOJJOZHY-KRWDZBQOSA-N 1 1 342.399 2.611 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000868342061 1304252828 /nfs/dbraw/zinc/25/28/28/1304252828.db2.gz VJXQDJUUKDITBQ-NUEKZKHPSA-N 1 1 346.431 2.700 10 5 EFBEMO Cc1ccc(CNC(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000868755520 1304456930 /nfs/dbraw/zinc/45/69/30/1304456930.db2.gz ISGCIHGUODFPHS-HZPDHXFCSA-N 1 1 346.431 2.719 10 5 EFBEMO Cc1ccc(CNC(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000868812470 1304487491 /nfs/dbraw/zinc/48/74/91/1304487491.db2.gz FDGJSRLYDIBHNV-MRXNPFEDSA-N 1 1 346.431 2.719 10 5 EFBEMO CSc1ccc(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)cc1[N+](=O)[O-] ZINC000871150231 1305837225 /nfs/dbraw/zinc/83/72/25/1305837225.db2.gz KRCNBYXJAGHTFH-UHFFFAOYSA-N 1 1 337.445 2.873 10 5 EFBEMO C[N@H+]1CCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CCC1(C)C ZINC000871151175 1305838407 /nfs/dbraw/zinc/83/84/07/1305838407.db2.gz YJPGADHVLZBSAC-UHFFFAOYSA-N 1 1 330.388 2.632 10 5 EFBEMO C/C(=C/C(=O)N1CC[N@H+](C)C(C)(C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000871155789 1305845033 /nfs/dbraw/zinc/84/50/33/1305845033.db2.gz BQBKPPKPLKNRFG-YPKPFQOOSA-N 1 1 331.416 2.941 10 5 EFBEMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC000901017056 1309202430 /nfs/dbraw/zinc/20/24/30/1309202430.db2.gz PQKPFYWIUAPALB-DOMZBBRYSA-N 1 1 337.807 2.881 10 5 EFBEMO Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)[C@H]1CC[C@H]3CCCC[N@H+]31)CC2 ZINC000901317383 1310129323 /nfs/dbraw/zinc/12/93/23/1310129323.db2.gz JCIVNMVGQUCPET-HUUCEWRRSA-N 1 1 329.400 2.809 10 5 EFBEMO C/C(=C\C(=O)NCC[N@H+](C)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000752031027 1311142984 /nfs/dbraw/zinc/14/29/84/1311142984.db2.gz UFYKKBQLRYBGNE-BUHFOSPRSA-N 1 1 331.416 2.989 10 5 EFBEMO C/C(=C/C(=O)NCC[N@H+](C)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000752031035 1311142993 /nfs/dbraw/zinc/14/29/93/1311142993.db2.gz UFYKKBQLRYBGNE-YPKPFQOOSA-N 1 1 331.416 2.989 10 5 EFBEMO C/C(=C\C(=O)N(C)C[C@H]1CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1 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CC[C@@H]1CO[C@@H](CC)C[N@H+]1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC001307907856 1324785359 /nfs/dbraw/zinc/78/53/59/1324785359.db2.gz NWOMNUVXAHTHLO-KGLIPLIRSA-N 1 1 338.404 2.872 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1Cc2c[nH]nc2[C@@H](C)C1 ZINC001307989097 1324788871 /nfs/dbraw/zinc/78/88/71/1324788871.db2.gz PHTIHMVAGOJOCX-LBPRGKRZSA-N 1 1 343.387 2.574 10 5 EFBEMO CC[N@H+](CCNC(=O)/C=C(/C)C1CC1)Cc1ccccc1[N+](=O)[O-] ZINC001317477454 1324865846 /nfs/dbraw/zinc/86/58/46/1324865846.db2.gz PXUBMMFHJJGAKQ-OWBHPGMISA-N 1 1 331.416 2.889 10 5 EFBEMO CC[N@@H+](CCNC(=O)/C=C(/C)C1CC1)Cc1ccccc1[N+](=O)[O-] ZINC001317477454 1324865857 /nfs/dbraw/zinc/86/58/57/1324865857.db2.gz PXUBMMFHJJGAKQ-OWBHPGMISA-N 1 1 331.416 2.889 10 5 EFBEMO C[N@@H+](CCCNC(=O)/C=C\c1ccc[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC001316817861 1325074417 /nfs/dbraw/zinc/07/44/17/1325074417.db2.gz BPVOYLRKHMNNRH-YFHOEESVSA-N 1 1 342.399 2.574 10 5 EFBEMO C[N@H+](CCNC(=O)Cc1ccc(F)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC001317468818 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ZINC001560108891 1415263529 /nfs/dbraw/zinc/26/35/29/1415263529.db2.gz OLVZRXHZVUKEAG-OAHLLOKOSA-N 1 1 342.399 2.579 10 5 EFBEMO Cc1cccnc1[C@H](C)[NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001560221489 1415268711 /nfs/dbraw/zinc/26/87/11/1415268711.db2.gz XFVMPHCFVRWVAK-STQMWFEESA-N 1 1 328.372 2.976 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NCCn1cc[nH+]c1C(C)C ZINC001565649046 1415408518 /nfs/dbraw/zinc/40/85/18/1415408518.db2.gz RYKJYVDPKHZVHV-UHFFFAOYSA-N 1 1 334.351 2.792 10 5 EFBEMO C[N@@H+](CCCNC(=O)CC(C)(F)F)Cc1cccc([N+](=O)[O-])c1 ZINC001566488884 1415580989 /nfs/dbraw/zinc/58/09/89/1415580989.db2.gz ZSFNRXTUKMRYEK-UHFFFAOYSA-N 1 1 329.347 2.578 10 5 EFBEMO Cc1ccsc1C(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001567268971 1416047723 /nfs/dbraw/zinc/04/77/23/1416047723.db2.gz IEVYVISCMUIWSK-UHFFFAOYSA-N 1 1 333.413 2.827 10 5 EFBEMO Cc1ccsc1C(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001567268971 1416047729 /nfs/dbraw/zinc/04/77/29/1416047729.db2.gz IEVYVISCMUIWSK-UHFFFAOYSA-N 1 1 333.413 2.827 10 5 EFBEMO C[N@H+](CCNC(=O)c1occc1Cl)Cc1cccc([N+](=O)[O-])c1 ZINC001567303012 1416064087 /nfs/dbraw/zinc/06/40/87/1416064087.db2.gz VZCKWKWNDYPLFO-UHFFFAOYSA-N 1 1 337.763 2.703 10 5 EFBEMO C[N@@H+](CCNC(=O)c1occc1Cl)Cc1cccc([N+](=O)[O-])c1 ZINC001567303012 1416064092 /nfs/dbraw/zinc/06/40/92/1416064092.db2.gz VZCKWKWNDYPLFO-UHFFFAOYSA-N 1 1 337.763 2.703 10 5 EFBEMO Cc1cc(C(=O)NCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)co1 ZINC001567440179 1416139586 /nfs/dbraw/zinc/13/95/86/1416139586.db2.gz UZBNZMHBOUAGQO-UHFFFAOYSA-N 1 1 343.383 2.891 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1nccs1)Cc1ccc([N+](=O)[O-])cc1 ZINC001689961518 1417107254 /nfs/dbraw/zinc/10/72/54/1417107254.db2.gz BEPWMCWGPDEIQU-UHFFFAOYSA-N 1 1 348.428 2.693 10 5 EFBEMO C=C/C(C)=C\CC(=O)NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC001699659633 1417442006 /nfs/dbraw/zinc/44/20/06/1417442006.db2.gz AJRNBZLROYGKGP-QCDXTXTGSA-N 1 1 335.429 2.917 10 5 EFBEMO CC(C)(C)CC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21 ZINC001713280154 1418450188 /nfs/dbraw/zinc/45/01/88/1418450188.db2.gz AXSXBGFLXLAOMI-QLPKVWCKSA-N 1 1 331.416 2.577 10 5 EFBEMO C[N@H+](CCNC(=O)c1ccc(F)cc1F)Cc1ccccc1[N+](=O)[O-] ZINC001713475591 1418549324 /nfs/dbraw/zinc/54/93/24/1418549324.db2.gz WEXVATUZYAXXRA-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccc(F)cc1F)Cc1ccccc1[N+](=O)[O-] ZINC001713475591 1418549325 /nfs/dbraw/zinc/54/93/25/1418549325.db2.gz WEXVATUZYAXXRA-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO CC(C)[N@@H+](CCCNC(=O)c1cocn1)Cc1ccccc1[N+](=O)[O-] ZINC001714815486 1418639307 /nfs/dbraw/zinc/63/93/07/1418639307.db2.gz DIIQGAGDEQSZEG-UHFFFAOYSA-N 1 1 346.387 2.613 10 5 EFBEMO CC/C=C(\C)C(=O)N1C[C@@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@@H]2C1 ZINC001717008689 1419144735 /nfs/dbraw/zinc/14/47/35/1419144735.db2.gz UAISMPIUARNOSJ-IUNVMDDCSA-N 1 1 343.427 2.841 10 5 EFBEMO CC/C=C(/C)C(=O)N1C[C@@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@@H]2C1 ZINC001717008690 1419144903 /nfs/dbraw/zinc/14/49/03/1419144903.db2.gz UAISMPIUARNOSJ-VWHBIUGESA-N 1 1 343.427 2.841 10 5 EFBEMO Cc1cc[nH]c1C(=O)NCCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001731238200 1426346631 /nfs/dbraw/zinc/34/66/31/1426346631.db2.gz OSZUCVYOHPUOCQ-UHFFFAOYSA-N 1 1 336.417 2.545 10 5 EFBEMO Cc1cc[nH]c1C(=O)NCCC[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001731238200 1426346639 /nfs/dbraw/zinc/34/66/39/1426346639.db2.gz OSZUCVYOHPUOCQ-UHFFFAOYSA-N 1 1 336.417 2.545 10 5 EFBEMO CC[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)[C@@H]1CCOC1 ZINC000311471476 718721095 /nfs/dbraw/zinc/72/10/95/718721095.db2.gz ORBXDRNLKNZQQR-LLVKDONJSA-N 1 1 329.194 2.968 10 5 EFBEMO CC[N@@H+]1CC[C@H]1CNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000893871905 720135395 /nfs/dbraw/zinc/13/53/95/720135395.db2.gz IIVNRDAYGOWNHM-VIFPVBQESA-N 1 1 332.187 2.726 10 5 EFBEMO CC[N@H+]1CC[C@H]1CNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000893871905 720135400 /nfs/dbraw/zinc/13/54/00/720135400.db2.gz IIVNRDAYGOWNHM-VIFPVBQESA-N 1 1 332.187 2.726 10 5 EFBEMO COC(=O)[C@H]1[C@H](C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)C1(F)F ZINC000893945688 720177766 /nfs/dbraw/zinc/17/77/66/720177766.db2.gz JJZRFPUQVJBLCA-GXTWGEPZSA-N 1 1 340.326 2.614 10 5 EFBEMO COC(=O)[C@H]1[C@H](C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)C1(F)F ZINC000893945688 720177770 /nfs/dbraw/zinc/17/77/70/720177770.db2.gz JJZRFPUQVJBLCA-GXTWGEPZSA-N 1 1 340.326 2.614 10 5 EFBEMO C[C@H]1[C@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000928434945 722862671 /nfs/dbraw/zinc/86/26/71/722862671.db2.gz FQVVRWWUUVCLCC-GXSJLCMTSA-N 1 1 343.836 2.549 10 5 EFBEMO CC[C@@H](C)[N@@H+](C)CCNc1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] ZINC000727112252 723819795 /nfs/dbraw/zinc/81/97/95/723819795.db2.gz FFBNTDAJSPPTQK-BUUCAEBMSA-N 1 1 335.404 2.923 10 5 EFBEMO C[N@H+]1C[C@@H]2CN(c3cccc(Br)c3[N+](=O)[O-])C[C@]2(C)C1 ZINC000896913254 723866943 /nfs/dbraw/zinc/86/69/43/723866943.db2.gz PFZXSYROEBHXQD-YGRLFVJLSA-N 1 1 340.221 2.745 10 5 EFBEMO CC(=O)c1ccc(N[C@@H]2CCC[N@@H+]3CCSC[C@H]23)c([N+](=O)[O-])c1 ZINC000895567594 724203934 /nfs/dbraw/zinc/20/39/34/724203934.db2.gz ROQMZHGWRROJCJ-CZUORRHYSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1ccc(N[C@@H]2CCC[N@H+]3CCSC[C@H]23)c([N+](=O)[O-])c1 ZINC000895567594 724203937 /nfs/dbraw/zinc/20/39/37/724203937.db2.gz ROQMZHGWRROJCJ-CZUORRHYSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1cc(N[C@@H]2CCC[N@@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-] ZINC000895566979 724204047 /nfs/dbraw/zinc/20/40/47/724204047.db2.gz DPTVFZMKBACIKD-GDBMZVCRSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1cc(N[C@@H]2CCC[N@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-] ZINC000895566979 724204049 /nfs/dbraw/zinc/20/40/49/724204049.db2.gz DPTVFZMKBACIKD-GDBMZVCRSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCC[N@@H+]2CCSC[C@H]12 ZINC000895569839 724205047 /nfs/dbraw/zinc/20/50/47/724205047.db2.gz NSBDQGBBJLPASO-HZPDHXFCSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000895569839 724205051 /nfs/dbraw/zinc/20/50/51/724205051.db2.gz NSBDQGBBJLPASO-HZPDHXFCSA-N 1 1 335.429 2.789 10 5 EFBEMO CN(Cn1c2cc([N+](=O)[O-])ccc2oc1=S)[C@H]1CC[N@H+](C2CC2)C1 ZINC000732188992 727002015 /nfs/dbraw/zinc/00/20/15/727002015.db2.gz PDRIMZGPTPWPLI-ZDUSSCGKSA-N 1 1 348.428 2.998 10 5 EFBEMO CC[N@H+]1CCCN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)[C@@H](C)C1 ZINC000910267063 727425073 /nfs/dbraw/zinc/42/50/73/727425073.db2.gz QXRRQYMJECLZHJ-HNNXBMFYSA-N 1 1 345.443 2.959 10 5 EFBEMO CC[N@H+]1CCCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)[C@@H](C)C1 ZINC000910285436 727427464 /nfs/dbraw/zinc/42/74/64/727427464.db2.gz BVMYDMMHZFGDCI-LBPRGKRZSA-N 1 1 330.388 2.632 10 5 EFBEMO CC(C)c1[nH+]ccn1CC(=O)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC000911472814 727543285 /nfs/dbraw/zinc/54/32/85/727543285.db2.gz OHUQUYMLGHZQGE-UHFFFAOYSA-N 1 1 338.314 2.509 10 5 EFBEMO O=C(N1CCCCc2ccc([N+](=O)[O-])cc21)[C@@]12CC[N@@H+](C1)CCC2 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2.839 10 5 EFBEMO CC(C)CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CCCCCC1 ZINC001569450452 1085233350 /nfs/dbraw/zinc/23/33/50/1085233350.db2.gz WXTFUVFUHCVVQQ-IAGOWNOFSA-N 1 1 339.480 2.839 10 5 EFBEMO CC(C)CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CCCCCC1 ZINC001569450452 1085233360 /nfs/dbraw/zinc/23/33/60/1085233360.db2.gz WXTFUVFUHCVVQQ-IAGOWNOFSA-N 1 1 339.480 2.839 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC001570901196 1086600632 /nfs/dbraw/zinc/60/06/32/1086600632.db2.gz NSXFEPUAXFCBQW-TXEJJXNPSA-N 1 1 339.823 2.732 10 5 EFBEMO CC[N@H+]1[C@H](C)CN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@@H]1C ZINC001570900286 1086600883 /nfs/dbraw/zinc/60/08/83/1086600883.db2.gz JOLWSTDHTBFDSS-PHIMTYICSA-N 1 1 325.796 2.803 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@@H]1C ZINC001570900286 1086600888 /nfs/dbraw/zinc/60/08/88/1086600888.db2.gz JOLWSTDHTBFDSS-PHIMTYICSA-N 1 1 325.796 2.803 10 5 EFBEMO COc1cc(CN2CC[N@@H+](C)[C@H](C(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC001646536845 1087847536 /nfs/dbraw/zinc/84/75/36/1087847536.db2.gz KRHDIVOMLFZOCE-INIZCTEOSA-N 1 1 339.411 2.905 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCCC[C@]23CCOC3)c1 ZINC001620678555 1091126213 /nfs/dbraw/zinc/12/62/13/1091126213.db2.gz BFKJZPIGPQTZIO-QGZVFWFLSA-N 1 1 334.372 2.526 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@]23CCOC3)c1 ZINC001620678555 1091126221 /nfs/dbraw/zinc/12/62/21/1091126221.db2.gz BFKJZPIGPQTZIO-QGZVFWFLSA-N 1 1 334.372 2.526 10 5 EFBEMO CC(C)[C@@H]1C[C@H](N2CCCC2)C[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC001648591953 1092236502 /nfs/dbraw/zinc/23/65/02/1092236502.db2.gz SWDJBOYQUCYZBC-FHWLQOOXSA-N 1 1 347.459 2.823 10 5 EFBEMO CC(C)[C@@H]1C[C@H](N2CCCC2)C[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC001648591953 1092236513 /nfs/dbraw/zinc/23/65/13/1092236513.db2.gz SWDJBOYQUCYZBC-FHWLQOOXSA-N 1 1 347.459 2.823 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCN(c2cnccn2)[C@@H](C)C1 ZINC001648665066 1092249559 /nfs/dbraw/zinc/24/95/59/1092249559.db2.gz HPDNEFNCXCIHJW-GJZGRUSLSA-N 1 1 341.415 2.965 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCN(c2cnccn2)[C@@H](C)C1 ZINC001648665066 1092249565 /nfs/dbraw/zinc/24/95/65/1092249565.db2.gz HPDNEFNCXCIHJW-GJZGRUSLSA-N 1 1 341.415 2.965 10 5 EFBEMO C[C@@H]1C[C@H](N(C)C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC001586631909 1092748243 /nfs/dbraw/zinc/74/82/43/1092748243.db2.gz WTGCCCYIGRHGNW-DGCLKSJQSA-N 1 1 339.823 2.732 10 5 EFBEMO Cc1ccc(F)cc1C(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001267209406 1093204127 /nfs/dbraw/zinc/20/41/27/1093204127.db2.gz XJTSNUKAGJXCCB-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO Cc1ccc(F)cc1C(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001267209406 1093204132 /nfs/dbraw/zinc/20/41/32/1093204132.db2.gz XJTSNUKAGJXCCB-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@@H+](C)C3(CCCCC3)C2)c1 ZINC001651079421 1093524139 /nfs/dbraw/zinc/52/41/39/1093524139.db2.gz LDZOTYDRJWQZAQ-UHFFFAOYSA-N 1 1 347.415 2.836 10 5 EFBEMO COC(=O)[C@@H]([NH2+]CCCNc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC001651096063 1093527488 /nfs/dbraw/zinc/52/74/88/1093527488.db2.gz LHDLWICNNVYMDY-AWEZNQCLSA-N 1 1 343.811 2.837 10 5 EFBEMO Cc1nn(C[NH+]2CCC(c3ccc(C)nc3)CC2)c(C)c1[N+](=O)[O-] ZINC000782941945 1094517222 /nfs/dbraw/zinc/51/72/22/1094517222.db2.gz NGLPNVHIESNGQM-UHFFFAOYSA-N 1 1 329.404 2.949 10 5 EFBEMO O=C(NCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)C1CC=CC1 ZINC001481163442 1095070534 /nfs/dbraw/zinc/07/05/34/1095070534.db2.gz JMDSDUYGRKERDZ-UHFFFAOYSA-N 1 1 329.400 2.642 10 5 EFBEMO CCC[N@@H+]1Cc2cccc(NC(=O)c3[nH]nc([N+](=O)[O-])c3Cl)c2C1 ZINC001143528191 1095204431 /nfs/dbraw/zinc/20/44/31/1095204431.db2.gz IKTYNHTZJYTCQG-UHFFFAOYSA-N 1 1 349.778 2.949 10 5 EFBEMO CCC[N@H+]1Cc2cccc(NC(=O)c3[nH]nc([N+](=O)[O-])c3Cl)c2C1 ZINC001143528191 1095204441 /nfs/dbraw/zinc/20/44/41/1095204441.db2.gz IKTYNHTZJYTCQG-UHFFFAOYSA-N 1 1 349.778 2.949 10 5 EFBEMO O=C(CC1CCCC1)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001268495539 1096978107 /nfs/dbraw/zinc/97/81/07/1096978107.db2.gz UKVXDFSZXCTWQU-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO O=C(NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)C(F)=C1CCCC1 ZINC001268818761 1097664235 /nfs/dbraw/zinc/66/42/35/1097664235.db2.gz SLDLXXYTJZQMQZ-UHFFFAOYSA-N 1 1 347.390 2.940 10 5 EFBEMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC001611165642 1098985356 /nfs/dbraw/zinc/98/53/56/1098985356.db2.gz QYGKZYXVGDHYGS-WMLDXEAASA-N 1 1 333.432 2.887 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC001611391395 1099007911 /nfs/dbraw/zinc/00/79/11/1099007911.db2.gz OBZQVWCCELHXKA-LSDHHAIUSA-N 1 1 335.379 2.789 10 5 EFBEMO CC[N@H+]1CCN(c2c3cc(OC)ccc3ncc2[N+](=O)[O-])C[C@@H]1C ZINC001612145767 1099046603 /nfs/dbraw/zinc/04/66/03/1099046603.db2.gz XBWPIJXFTJQJEI-LBPRGKRZSA-N 1 1 330.388 2.682 10 5 EFBEMO CCC[N@@H+](CC)C[C@@H](C)Nc1ccc(CC(=O)OC)cc1[N+](=O)[O-] ZINC001612441643 1099058901 /nfs/dbraw/zinc/05/89/01/1099058901.db2.gz SITYWDTVKLANBG-CYBMUJFWSA-N 1 1 337.420 2.843 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NC[C@H]1CCCC[N@H+]1C ZINC001613026605 1099087268 /nfs/dbraw/zinc/08/72/68/1099087268.db2.gz HRRRKOZAEOBLCW-SNVBAGLBSA-N 1 1 341.795 2.931 10 5 EFBEMO COC(=O)/C=C\c1ccc(NC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC001613027379 1099087550 /nfs/dbraw/zinc/08/75/50/1099087550.db2.gz WDYKYHJNTROTPJ-IUCKJTJTSA-N 1 1 333.388 2.677 10 5 EFBEMO COC(=O)/C=C/c1ccc(NC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC001613027380 1099088217 /nfs/dbraw/zinc/08/82/17/1099088217.db2.gz WDYKYHJNTROTPJ-KGXGESDWSA-N 1 1 333.388 2.677 10 5 EFBEMO CC1(C)CC[N@@H+](CCNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001617111826 1099214523 /nfs/dbraw/zinc/21/45/23/1099214523.db2.gz CQGPFLFJUIGOLV-UHFFFAOYSA-N 1 1 325.796 2.710 10 5 EFBEMO C[N@@H+]1CC[C@@H]1CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC001617183162 1099222714 /nfs/dbraw/zinc/22/27/14/1099222714.db2.gz OUBPCSTWMXGYQS-OAHLLOKOSA-N 1 1 340.383 2.772 10 5 EFBEMO C[N@H+]1CC[C@@H]1CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC001617183162 1099222724 /nfs/dbraw/zinc/22/27/24/1099222724.db2.gz OUBPCSTWMXGYQS-OAHLLOKOSA-N 1 1 340.383 2.772 10 5 EFBEMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCC[C@]2(CCOC2)O1 ZINC001617464641 1099240800 /nfs/dbraw/zinc/24/08/00/1099240800.db2.gz HZYSDWGGKKMSDV-ZWKOTPCHSA-N 1 1 334.416 2.797 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NCCCCn1cc[nH+]c1C ZINC001618362805 1099293179 /nfs/dbraw/zinc/29/31/79/1099293179.db2.gz DORGWTIGVYLYFG-UHFFFAOYSA-N 1 1 346.387 2.709 10 5 EFBEMO Cc1nccnc1[C@@H](C)[NH2+]CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001620557834 1099359945 /nfs/dbraw/zinc/35/99/45/1099359945.db2.gz VVGUNESCPILZIY-SNVBAGLBSA-N 1 1 349.778 2.636 10 5 EFBEMO C[NH+](C)Cc1cc(NC(=O)c2ccnc(N)c2[N+](=O)[O-])ccc1Cl ZINC001626283322 1099858051 /nfs/dbraw/zinc/85/80/51/1099858051.db2.gz CNCCALVTNHUKRP-UHFFFAOYSA-N 1 1 349.778 2.539 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc([C@H]2CCC[N@H+]2C)[nH]n1 ZINC001628542645 1100111350 /nfs/dbraw/zinc/11/13/50/1100111350.db2.gz ZYRSQRCLLWTFPK-OAHLLOKOSA-N 1 1 329.360 2.645 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc([C@H]2CCC[N@@H+]2C)[nH]n1 ZINC001628542645 1100111355 /nfs/dbraw/zinc/11/13/55/1100111355.db2.gz ZYRSQRCLLWTFPK-OAHLLOKOSA-N 1 1 329.360 2.645 10 5 EFBEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001630352398 1100297453 /nfs/dbraw/zinc/29/74/53/1100297453.db2.gz FYICWMVHWBKFIH-ZDUSSCGKSA-N 1 1 339.823 2.591 10 5 EFBEMO CC[N@@H+](C)C[C@H]1CCN(C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001630352397 1100297787 /nfs/dbraw/zinc/29/77/87/1100297787.db2.gz FYICWMVHWBKFIH-CYBMUJFWSA-N 1 1 339.823 2.591 10 5 EFBEMO C[N@H+]1CCCC[C@@H]1CNc1ncc(Br)cc1[N+](=O)[O-] ZINC000044561317 1100308137 /nfs/dbraw/zinc/30/81/37/1100308137.db2.gz GYLIYQUHICEENW-SNVBAGLBSA-N 1 1 329.198 2.649 10 5 EFBEMO CC[N@H+]1[C@H](C)CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC001631499126 1100405131 /nfs/dbraw/zinc/40/51/31/1100405131.db2.gz SABPXVYFCMYVQK-BETUJISGSA-N 1 1 337.445 2.628 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC001631499126 1100405133 /nfs/dbraw/zinc/40/51/33/1100405133.db2.gz SABPXVYFCMYVQK-BETUJISGSA-N 1 1 337.445 2.628 10 5 EFBEMO Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)[C@@H]1CCC[N@H+](C(C)C)C1)CC2 ZINC001632740396 1100498347 /nfs/dbraw/zinc/49/83/47/1100498347.db2.gz WGXBBWPOSGFPLY-OAHLLOKOSA-N 1 1 331.416 2.913 10 5 EFBEMO CC[C@H](NC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC001633921438 1100574748 /nfs/dbraw/zinc/57/47/48/1100574748.db2.gz FLDAEFNZORWGLY-BSWAZPDLSA-N 1 1 346.431 2.685 10 5 EFBEMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC001634687081 1100624022 /nfs/dbraw/zinc/62/40/22/1100624022.db2.gz QOIBBCMMULCIOQ-BBRMVZONSA-N 1 1 342.399 2.563 10 5 EFBEMO CCC[N@H+]1CCC[C@H]1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC001637003999 1100750315 /nfs/dbraw/zinc/75/03/15/1100750315.db2.gz VXINHBVITRNIHY-HNNXBMFYSA-N 1 1 343.387 2.798 10 5 EFBEMO Cc1cc(NC(=O)c2cc(C[NH+]3CCCC3)on2)cc([N+](=O)[O-])c1 ZINC001637531843 1100788295 /nfs/dbraw/zinc/78/82/95/1100788295.db2.gz SISXCMVGAMYWPD-UHFFFAOYSA-N 1 1 330.344 2.739 10 5 EFBEMO Cc1ccc(NCCNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)[nH+]c1 ZINC001639039181 1100907001 /nfs/dbraw/zinc/90/70/01/1100907001.db2.gz HMVTWRVSKCIDLY-UITAMQMPSA-N 1 1 326.356 2.540 10 5 EFBEMO COc1cc(C(=O)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)cc([N+](=O)[O-])c1C ZINC001639427280 1100948405 /nfs/dbraw/zinc/94/84/05/1100948405.db2.gz BXKHSHFSYZKASK-MRXNPFEDSA-N 1 1 349.431 2.714 10 5 EFBEMO CCCC[N@@H+](C)C[C@@H](C)Nc1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC001639985174 1101000499 /nfs/dbraw/zinc/00/04/99/1101000499.db2.gz GVHZNGQVJBCVCR-SECBINFHSA-N 1 1 337.346 2.879 10 5 EFBEMO O=[N+]([O-])c1cnc(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)s1 ZINC001640057167 1101009503 /nfs/dbraw/zinc/00/95/03/1101009503.db2.gz DQFUXLNLJTVZFD-KGLIPLIRSA-N 1 1 330.413 2.762 10 5 EFBEMO CC1(CC(=O)N2CC3(C2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C3)CC1 ZINC001640228506 1101026037 /nfs/dbraw/zinc/02/60/37/1101026037.db2.gz HOXZQNSLSVTVGX-UHFFFAOYSA-N 1 1 343.427 2.819 10 5 EFBEMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001642071799 1101187583 /nfs/dbraw/zinc/18/75/83/1101187583.db2.gz HTBVRCMTQBMTIT-UHFFFAOYSA-N 1 1 345.359 2.673 10 5 EFBEMO CC[N@H+]1CCC[C@@H](CNc2c3cc(OC)ccc3ncc2[N+](=O)[O-])C1 ZINC001642153977 1101192838 /nfs/dbraw/zinc/19/28/38/1101192838.db2.gz FXMONKCTYPACLQ-ZDUSSCGKSA-N 1 1 344.415 2.717 10 5 EFBEMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC001642247910 1101201951 /nfs/dbraw/zinc/20/19/51/1101201951.db2.gz JCHOWRHLBCSQGS-ZDUSSCGKSA-N 1 1 330.363 2.600 10 5 EFBEMO COc1ccc2ncc([N+](=O)[O-])c(N[C@@H]3C[C@H](C)[N@H+](C4CC4)C3)c2c1 ZINC001642431539 1101213455 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Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441274771 250013715 /nfs/dbraw/zinc/01/37/15/250013715.db2.gz GALQIEGYWUZACB-LSDHHAIUSA-N 1 1 347.415 2.590 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441274771 250013721 /nfs/dbraw/zinc/01/37/21/250013721.db2.gz GALQIEGYWUZACB-LSDHHAIUSA-N 1 1 347.415 2.590 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441281245 250015792 /nfs/dbraw/zinc/01/57/92/250015792.db2.gz TWLWQCYEFOSCGR-QLFBSQMISA-N 1 1 347.415 2.670 10 5 EFBEMO CCCC(=O)N[C@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092708213 218160926 /nfs/dbraw/zinc/16/09/26/218160926.db2.gz NLBYNORJNLAKTM-RDTXFTJFSA-N 1 1 331.416 2.989 10 5 EFBEMO CCCC(=O)N[C@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092708213 218160930 /nfs/dbraw/zinc/16/09/30/218160930.db2.gz NLBYNORJNLAKTM-RDTXFTJFSA-N 1 1 331.416 2.989 10 5 EFBEMO CC[N@H+](CCc1nccs1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 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KCHTXRYYRHXSPQ-GFCCVEGCSA-N 1 1 331.338 2.911 10 5 EFBEMO C[C@H]1CN(CC(F)(F)F)CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000449666931 251107228 /nfs/dbraw/zinc/10/72/28/251107228.db2.gz QPLZONNSGZZCMW-GFCCVEGCSA-N 1 1 331.338 2.911 10 5 EFBEMO C[C@H]1CN(CC(F)(F)F)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000449666931 251107231 /nfs/dbraw/zinc/10/72/31/251107231.db2.gz QPLZONNSGZZCMW-GFCCVEGCSA-N 1 1 331.338 2.911 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]([C@H](O)C(F)(F)F)C2)c(Cl)c1 ZINC000449673627 251111741 /nfs/dbraw/zinc/11/17/41/251111741.db2.gz PKOPVGMRSYRRKP-CABZTGNLSA-N 1 1 338.713 2.993 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]([C@H](O)C(F)(F)F)C2)c(Cl)c1 ZINC000449673627 251111745 /nfs/dbraw/zinc/11/17/45/251111745.db2.gz PKOPVGMRSYRRKP-CABZTGNLSA-N 1 1 338.713 2.993 10 5 EFBEMO C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000449676597 251114259 /nfs/dbraw/zinc/11/42/59/251114259.db2.gz IJLPYZUWBSHBMR-DYVFJYSZSA-N 1 1 346.383 2.827 10 5 EFBEMO 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C[C@@H]1C[C@H](N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000356340714 147217009 /nfs/dbraw/zinc/21/70/09/147217009.db2.gz PDFJKPYOFXNJEW-CZUORRHYSA-N 1 1 333.432 2.814 10 5 EFBEMO COc1cc(C(=O)NCC[N@@H+](C)C2CCCCC2)cc([N+](=O)[O-])c1C ZINC000359336002 148059450 /nfs/dbraw/zinc/05/94/50/148059450.db2.gz SPSZUTIQEOJLMF-UHFFFAOYSA-N 1 1 349.431 2.906 10 5 EFBEMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)CC[C@H]1CCCC[N@H+]1C ZINC000359454738 148089139 /nfs/dbraw/zinc/08/91/39/148089139.db2.gz DREVQZBTOYXKQK-MRXNPFEDSA-N 1 1 333.432 2.860 10 5 EFBEMO O=C(C[NH2+][C@@H](CO)c1ccc(Cl)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000359539693 148114935 /nfs/dbraw/zinc/11/49/35/148114935.db2.gz BTFPNSFZAAUHPB-AWEZNQCLSA-N 1 1 349.774 2.510 10 5 EFBEMO Cc1c(C[N@H+](C)C2CCN(c3cnccn3)CC2)cccc1[N+](=O)[O-] ZINC000364835715 149254795 /nfs/dbraw/zinc/25/47/95/149254795.db2.gz WYXUMLHSAMCCJX-UHFFFAOYSA-N 1 1 341.415 2.794 10 5 EFBEMO Nc1nccc([C@@H]2CCC[N@@H+](CC=Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC000368046102 150018696 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333.388 2.951 10 5 EFBEMO CCOc1ccc(NC(=O)C[N@H+]2CCCC23CCC3)c([N+](=O)[O-])c1 ZINC000373096042 151112557 /nfs/dbraw/zinc/11/25/57/151112557.db2.gz BPUGVDAZRUWEFB-UHFFFAOYSA-N 1 1 333.388 2.951 10 5 EFBEMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@]2(CCO[C@H](C)C2)O1 ZINC000374012908 151268240 /nfs/dbraw/zinc/26/82/40/151268240.db2.gz GKXMGZHTYPRVPI-IIDMSEBBSA-N 1 1 334.416 2.796 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000123147945 222223871 /nfs/dbraw/zinc/22/38/71/222223871.db2.gz KSDDYYABTCXLAK-YHWZYXNKSA-N 1 1 348.403 2.740 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000123212897 222235414 /nfs/dbraw/zinc/23/54/14/222235414.db2.gz JEMRNDHXRKPEEH-HUUCEWRRSA-N 1 1 348.447 2.646 10 5 EFBEMO C[C@@H]1C[C@H](N(C)C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000123745774 222326520 /nfs/dbraw/zinc/32/65/20/222326520.db2.gz IEOQQJKOBVAWKI-GHMZBOCLSA-N 1 1 325.796 2.803 10 5 EFBEMO 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349.434 2.895 10 5 EFBEMO C[N@H+](Cc1ccc(F)cc1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067374941 472026133 /nfs/dbraw/zinc/02/61/33/472026133.db2.gz CJNVWNANCFHQEN-QGZVFWFLSA-N 1 1 343.358 2.971 10 5 EFBEMO C[N@@H+](Cc1ccc(F)cc1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067374941 472026140 /nfs/dbraw/zinc/02/61/40/472026140.db2.gz CJNVWNANCFHQEN-QGZVFWFLSA-N 1 1 343.358 2.971 10 5 EFBEMO CN(C(=O)C[N@H+](C)CCc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000055024115 472131300 /nfs/dbraw/zinc/13/13/00/472131300.db2.gz DTSVLMREASQYRZ-UHFFFAOYSA-N 1 1 345.374 2.871 10 5 EFBEMO CN(C(=O)C[N@@H+](C)CCc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000055024115 472131302 /nfs/dbraw/zinc/13/13/02/472131302.db2.gz DTSVLMREASQYRZ-UHFFFAOYSA-N 1 1 345.374 2.871 10 5 EFBEMO O=C(c1ccc([N+](=O)[O-])o1)N1CCC[N@H+](Cc2cccs2)CC1 ZINC000028038035 472210585 /nfs/dbraw/zinc/21/05/85/472210585.db2.gz CVEJLHAQWCYNIB-UHFFFAOYSA-N 1 1 335.385 2.597 10 5 EFBEMO O=C(c1ccc([N+](=O)[O-])o1)N1CCC[N@@H+](Cc2cccs2)CC1 ZINC000028038035 472210594 /nfs/dbraw/zinc/21/05/94/472210594.db2.gz CVEJLHAQWCYNIB-UHFFFAOYSA-N 1 1 335.385 2.597 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)CCOc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000076480401 472353436 /nfs/dbraw/zinc/35/34/36/472353436.db2.gz MLWSSFKLCKHDCB-CABCVRRESA-N 1 1 349.431 2.552 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000128603581 472474964 /nfs/dbraw/zinc/47/49/64/472474964.db2.gz ULXOBNQEGRNHBK-PBHICJAKSA-N 1 1 348.447 2.509 10 5 EFBEMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCCN(c2cccnn2)CC1 ZINC000118978862 472517455 /nfs/dbraw/zinc/51/74/55/472517455.db2.gz ZXRRFUJZWFSXTJ-UHFFFAOYSA-N 1 1 347.806 2.751 10 5 EFBEMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCCN(c2cccnn2)CC1 ZINC000118978862 472517460 /nfs/dbraw/zinc/51/74/60/472517460.db2.gz ZXRRFUJZWFSXTJ-UHFFFAOYSA-N 1 1 347.806 2.751 10 5 EFBEMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000155357442 472536577 /nfs/dbraw/zinc/53/65/77/472536577.db2.gz YNKCDHUIBGEHPR-NXEZZACHSA-N 1 1 345.321 2.778 10 5 EFBEMO COc1ccc(-c2ccc(C[NH2+]Cc3ccnn3C)o2)c([N+](=O)[O-])c1 ZINC000102421701 472576664 /nfs/dbraw/zinc/57/66/64/472576664.db2.gz JTXZJAZEEOALQS-UHFFFAOYSA-N 1 1 342.355 2.887 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000155603934 472578347 /nfs/dbraw/zinc/57/83/47/472578347.db2.gz MAQXTOOWVNHUTI-LSDHHAIUSA-N 1 1 347.415 2.550 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000155604059 472578463 /nfs/dbraw/zinc/57/84/63/472578463.db2.gz MAQXTOOWVNHUTI-GJZGRUSLSA-N 1 1 347.415 2.550 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000130133276 472586737 /nfs/dbraw/zinc/58/67/37/472586737.db2.gz PHZFCKUKUKVICO-LBPRGKRZSA-N 1 1 330.388 2.680 10 5 EFBEMO C[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@H](c2ccco2)C1 ZINC000090551350 472634044 /nfs/dbraw/zinc/63/40/44/472634044.db2.gz CZUOWZAKXKBDAW-ZFWWWQNUSA-N 1 1 331.372 2.823 10 5 EFBEMO Cc1ccc(C[N@H+](C)[C@H]2CCCN(c3cccnn3)C2)cc1[N+](=O)[O-] ZINC000120193950 472647396 /nfs/dbraw/zinc/64/73/96/472647396.db2.gz MGPQWGVIOMLAHU-INIZCTEOSA-N 1 1 341.415 2.794 10 5 EFBEMO CSCC[C@@H](C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000072290437 472651859 /nfs/dbraw/zinc/65/18/59/472651859.db2.gz JCMRYPNNSPUUME-GFCCVEGCSA-N 1 1 325.434 2.997 10 5 EFBEMO CSCC[C@H](C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000072290436 472651871 /nfs/dbraw/zinc/65/18/71/472651871.db2.gz JCMRYPNNSPUUME-LBPRGKRZSA-N 1 1 325.434 2.997 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000047142660 472659657 /nfs/dbraw/zinc/65/96/57/472659657.db2.gz VHHLVHYVIZWAOX-NSHDSACASA-N 1 1 325.796 2.852 10 5 EFBEMO COC(=O)[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000104689628 472684286 /nfs/dbraw/zinc/68/42/86/472684286.db2.gz BZYOAMOHFKXXHY-ZDUSSCGKSA-N 1 1 336.388 2.767 10 5 EFBEMO COC(=O)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000104689628 472684293 /nfs/dbraw/zinc/68/42/93/472684293.db2.gz BZYOAMOHFKXXHY-ZDUSSCGKSA-N 1 1 336.388 2.767 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1C[C@H]2CCC[N@@H+]2C[C@@H]1C ZINC000120841653 472755781 /nfs/dbraw/zinc/75/57/81/472755781.db2.gz FJQBUTPRRSAUIN-GXTWGEPZSA-N 1 1 332.404 2.912 10 5 EFBEMO CC[N@@H+](C)Cc1cccc(CNc2ccc3ncc([N+](=O)[O-])n3n2)c1 ZINC000091457227 472768241 /nfs/dbraw/zinc/76/82/41/472768241.db2.gz FLKHPPYCQMTVKI-UHFFFAOYSA-N 1 1 340.387 2.701 10 5 EFBEMO CO[C@@H]1CC[C@@H]2OCC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])[C@@H]2C1 ZINC000092095576 472859241 /nfs/dbraw/zinc/85/92/41/472859241.db2.gz HJLCFGJDDBMYIK-GZNMMVRTSA-N 1 1 332.400 2.876 10 5 EFBEMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])[C@@H]2C1 ZINC000092095576 472859243 /nfs/dbraw/zinc/85/92/43/472859243.db2.gz HJLCFGJDDBMYIK-GZNMMVRTSA-N 1 1 332.400 2.876 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)[C@H]1CCN(CC(F)(F)F)C1=O ZINC000106798043 472892656 /nfs/dbraw/zinc/89/26/56/472892656.db2.gz HDCXRACGNUECSA-MFKMUULPSA-N 1 1 345.321 2.751 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)[C@H]1CCN(CC(F)(F)F)C1=O ZINC000106798043 472892661 /nfs/dbraw/zinc/89/26/61/472892661.db2.gz HDCXRACGNUECSA-MFKMUULPSA-N 1 1 345.321 2.751 10 5 EFBEMO CCC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@H]1CCCCO1 ZINC000106867296 472901530 /nfs/dbraw/zinc/90/15/30/472901530.db2.gz OVSLFCVMDDNPKL-QGZVFWFLSA-N 1 1 349.431 2.839 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C[C@H]1CCCCO1 ZINC000121841457 472928308 /nfs/dbraw/zinc/92/83/08/472928308.db2.gz FOMZRPVFUXFQFC-OAHLLOKOSA-N 1 1 335.404 2.733 10 5 EFBEMO COCC[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000092649481 472951448 /nfs/dbraw/zinc/95/14/48/472951448.db2.gz CNOWAWUBLHPFLY-GFCCVEGCSA-N 1 1 345.346 2.719 10 5 EFBEMO C[C@H](NC(=O)NCC[N@H+]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000079983747 472952851 /nfs/dbraw/zinc/95/28/51/472952851.db2.gz CWXCNFMGEFDQFZ-KGLIPLIRSA-N 1 1 334.420 2.829 10 5 EFBEMO Cn1cc[nH+]c1CC1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000121966233 472954683 /nfs/dbraw/zinc/95/46/83/472954683.db2.gz VEIGDCYXZOZLFY-UHFFFAOYSA-N 1 1 346.362 2.562 10 5 EFBEMO C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000159566375 473040340 /nfs/dbraw/zinc/04/03/40/473040340.db2.gz DNJJNYNDOGQESE-OCCSQVGLSA-N 1 1 343.383 2.941 10 5 EFBEMO Cn1cc(C[N@@H+](C)CC2CCOCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093284265 473074979 /nfs/dbraw/zinc/07/49/79/473074979.db2.gz DKXMSQPYAMPINK-UHFFFAOYSA-N 1 1 344.415 2.854 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN(C[C@@H]2CCCC[N@H+]2C)CC1 ZINC000109755760 473117169 /nfs/dbraw/zinc/11/71/69/473117169.db2.gz RHWKAYTUDLTUOA-LPHOPBHVSA-N 1 1 346.475 2.758 10 5 EFBEMO CCOc1ccc(C(=O)NC[C@H]2CCC[N@H+]2CC(C)C)cc1[N+](=O)[O-] ZINC000160528270 473137812 /nfs/dbraw/zinc/13/78/12/473137812.db2.gz ZDXVDGUUQOTUCB-OAHLLOKOSA-N 1 1 349.431 2.844 10 5 EFBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000110351024 473153823 /nfs/dbraw/zinc/15/38/23/473153823.db2.gz IHXKUXBBPLTWCH-CYBMUJFWSA-N 1 1 342.399 2.549 10 5 EFBEMO C[C@]1(CNc2ncc([N+](=O)[O-])cn2)CCC[N@H+]1Cc1ccccc1 ZINC000160806106 473176938 /nfs/dbraw/zinc/17/69/38/473176938.db2.gz VZQRHBXGRYHPJE-QGZVFWFLSA-N 1 1 327.388 2.851 10 5 EFBEMO CCn1cnnc1C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000171644154 473427826 /nfs/dbraw/zinc/42/78/26/473427826.db2.gz TWGXVZAYDNCTMI-UHFFFAOYSA-N 1 1 333.367 2.725 10 5 EFBEMO CCC[C@H]([NH2+]C[C@@H](O)CN1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000151300368 473439713 /nfs/dbraw/zinc/43/97/13/473439713.db2.gz YPHNVVDQEQZIOB-MSOLQXFVSA-N 1 1 335.448 2.872 10 5 EFBEMO CC[C@@H](NC(=O)N(C)CC[N@@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000185510576 473446078 /nfs/dbraw/zinc/44/60/78/473446078.db2.gz DMEZXURKIXKEAS-MRXNPFEDSA-N 1 1 334.420 2.782 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3nncn3C3CC3)C2)cc1 ZINC000152404482 473557709 /nfs/dbraw/zinc/55/77/09/473557709.db2.gz HDVQXQLNMGYCQV-AWEZNQCLSA-N 1 1 327.388 2.901 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@@H]1CCCO1 ZINC000170688002 473586973 /nfs/dbraw/zinc/58/69/73/473586973.db2.gz OXEOIULBVYCFPY-RISCZKNCSA-N 1 1 332.360 2.817 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@@H]1CCCO1 ZINC000170688002 473586981 /nfs/dbraw/zinc/58/69/81/473586981.db2.gz OXEOIULBVYCFPY-RISCZKNCSA-N 1 1 332.360 2.817 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000127609476 473631859 /nfs/dbraw/zinc/63/18/59/473631859.db2.gz DJZDNRCMEPHKIX-CQSZACIVSA-N 1 1 332.404 2.914 10 5 EFBEMO Cn1cc([C@@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000116318947 473651419 /nfs/dbraw/zinc/65/14/19/473651419.db2.gz BPEQBJKGBHHZOM-CQSZACIVSA-N 1 1 330.388 2.587 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1OC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000154071687 473664703 /nfs/dbraw/zinc/66/47/03/473664703.db2.gz DZXBSQVOVDWEEG-SFHVURJKSA-N 1 1 342.395 2.701 10 5 EFBEMO Cc1ccc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)c(C)n1 ZINC000186597916 473697001 /nfs/dbraw/zinc/69/70/01/473697001.db2.gz SFCSSCPCWOSLIF-UHFFFAOYSA-N 1 1 326.400 2.929 10 5 EFBEMO Cn1nccc1[C@@H]1CCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000281398216 473706515 /nfs/dbraw/zinc/70/65/15/473706515.db2.gz NIADPTOOPCFCFO-HNNXBMFYSA-N 1 1 330.388 2.934 10 5 EFBEMO Cn1nccc1[C@@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000281398216 473706521 /nfs/dbraw/zinc/70/65/21/473706521.db2.gz NIADPTOOPCFCFO-HNNXBMFYSA-N 1 1 330.388 2.934 10 5 EFBEMO COC(=O)c1cc(C)nc(NC[C@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-] ZINC000287610043 473712439 /nfs/dbraw/zinc/71/24/39/473712439.db2.gz GACXKZHOZJIELC-CYBMUJFWSA-N 1 1 348.403 2.514 10 5 EFBEMO Cc1ccc([C@@H](C)[NH2+]CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)o1 ZINC000193283870 473778468 /nfs/dbraw/zinc/77/84/68/473778468.db2.gz PKVXEMVWNGVADV-GFCCVEGCSA-N 1 1 329.356 2.736 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000193316124 473780607 /nfs/dbraw/zinc/78/06/07/473780607.db2.gz PZSBVLPFZJYBEC-RYUDHWBXSA-N 1 1 348.321 2.609 10 5 EFBEMO C[N@@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@@H]1c1ccccc1 ZINC000180109985 473801866 /nfs/dbraw/zinc/80/18/66/473801866.db2.gz DRXKWPPWBDCTAN-WFASDCNBSA-N 1 1 331.397 2.832 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@@H]1c1ccccc1 ZINC000180109985 473801873 /nfs/dbraw/zinc/80/18/73/473801873.db2.gz DRXKWPPWBDCTAN-WFASDCNBSA-N 1 1 331.397 2.832 10 5 EFBEMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000274420648 473815959 /nfs/dbraw/zinc/81/59/59/473815959.db2.gz DGVCORWRHNZHQW-LBPRGKRZSA-N 1 1 330.388 2.679 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000180186897 473822063 /nfs/dbraw/zinc/82/20/63/473822063.db2.gz MKHXACAEXBAECP-SJORKVTESA-N 1 1 325.368 2.770 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000180197342 473825580 /nfs/dbraw/zinc/82/55/80/473825580.db2.gz AFPQJYFBJQNJFW-WBVHZDCISA-N 1 1 343.358 2.909 10 5 EFBEMO COc1ccc(OCC[N@@H+]2CCO[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])c1 ZINC000173541340 473871761 /nfs/dbraw/zinc/87/17/61/473871761.db2.gz MTPBMZNTMJQUOB-HOCLYGCPSA-N 1 1 336.388 2.626 10 5 EFBEMO COc1ccc(OCC[N@H+]2CCO[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])c1 ZINC000173541340 473871765 /nfs/dbraw/zinc/87/17/65/473871765.db2.gz MTPBMZNTMJQUOB-HOCLYGCPSA-N 1 1 336.388 2.626 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000246676644 473932447 /nfs/dbraw/zinc/93/24/47/473932447.db2.gz ZBSBQTYCSPIYBE-YPMHNXCESA-N 1 1 337.807 2.947 10 5 EFBEMO COc1ccc(C[N@@H+]2C[C@@H](c3ccsc3)[C@H](CO)C2)cc1[N+](=O)[O-] ZINC000188060666 473967737 /nfs/dbraw/zinc/96/77/37/473967737.db2.gz KEHKAMLYVUJTIL-GJZGRUSLSA-N 1 1 348.424 2.873 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)cc1[N+](=O)[O-] ZINC000247181417 474081780 /nfs/dbraw/zinc/08/17/80/474081780.db2.gz VXWUQHHVZUKSJB-YCPHGPKFSA-N 1 1 346.431 2.842 10 5 EFBEMO CCOCC[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC)c2)C[C@@H]1CC ZINC000174737823 474088081 /nfs/dbraw/zinc/08/80/81/474088081.db2.gz FCQNFDWCBBIULR-AWEZNQCLSA-N 1 1 337.420 2.541 10 5 EFBEMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)COCc1ccccc1 ZINC000282506670 474092143 /nfs/dbraw/zinc/09/21/43/474092143.db2.gz RNDBFUGRHLHDOD-LJQANCHMSA-N 1 1 344.411 2.647 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)CCNc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000247426485 474144476 /nfs/dbraw/zinc/14/44/76/474144476.db2.gz OIPFCRZJCWKAKF-HOCLYGCPSA-N 1 1 348.447 2.586 10 5 EFBEMO COC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1c1ccccc1[N+](=O)[O-] ZINC000220912608 474157401 /nfs/dbraw/zinc/15/74/01/474157401.db2.gz MKPCYUMNEHNKPH-IAGOWNOFSA-N 1 1 340.379 2.983 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)NCCc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000270529886 474157931 /nfs/dbraw/zinc/15/79/31/474157931.db2.gz NZGYTQORVLAKSG-PBHICJAKSA-N 1 1 348.447 2.509 10 5 EFBEMO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)o1 ZINC000182588499 474212579 /nfs/dbraw/zinc/21/25/79/474212579.db2.gz UXDVHXIHNCKQLB-SWLSCSKDSA-N 1 1 329.356 2.952 10 5 EFBEMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC1(CO)CC1 ZINC000188957174 474245242 /nfs/dbraw/zinc/24/52/42/474245242.db2.gz VLTRRSWNKVRVGM-UHFFFAOYSA-N 1 1 333.413 2.923 10 5 EFBEMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC1(CO)CC1 ZINC000188957174 474245248 /nfs/dbraw/zinc/24/52/48/474245248.db2.gz VLTRRSWNKVRVGM-UHFFFAOYSA-N 1 1 333.413 2.923 10 5 EFBEMO C[C@H](NC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000289413785 474260725 /nfs/dbraw/zinc/26/07/25/474260725.db2.gz AMHQBLUIMOGWTJ-YVEFUNNKSA-N 1 1 337.395 2.985 10 5 EFBEMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)CC[C@H]21 ZINC000248169029 474276458 /nfs/dbraw/zinc/27/64/58/474276458.db2.gz UJJMLNCEDCJCSC-SJKOYZFVSA-N 1 1 342.399 2.632 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1[C@@H](C)C[NH+](C)C[C@@H]1C ZINC000275730286 474297174 /nfs/dbraw/zinc/29/71/74/474297174.db2.gz AHALGOPKEPJIJK-QWRGUYRKSA-N 1 1 325.796 2.721 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)[C@@H]1CCC[N@@H+](C)C1 ZINC000275731989 474297492 /nfs/dbraw/zinc/29/74/92/474297492.db2.gz AMCSMHUTRLEUJI-GFCCVEGCSA-N 1 1 325.796 2.723 10 5 EFBEMO CO[C@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@@H]1C ZINC000189282221 474347291 /nfs/dbraw/zinc/34/72/91/474347291.db2.gz BWFUKSRFATYKSH-FZMZJTMJSA-N 1 1 332.360 2.502 10 5 EFBEMO CO[C@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@@H]1C ZINC000189282221 474347298 /nfs/dbraw/zinc/34/72/98/474347298.db2.gz BWFUKSRFATYKSH-FZMZJTMJSA-N 1 1 332.360 2.502 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000248563569 474358737 /nfs/dbraw/zinc/35/87/37/474358737.db2.gz KCLYPPAFFGTAII-BFQNTYOBSA-N 1 1 337.395 2.682 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCCC[C@H]1S(C)(=O)=O ZINC000248561074 474359165 /nfs/dbraw/zinc/35/91/65/474359165.db2.gz AWBGZISRFVBXPR-JKSUJKDBSA-N 1 1 340.445 2.691 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCCC[C@H]1S(C)(=O)=O ZINC000248561074 474359168 /nfs/dbraw/zinc/35/91/68/474359168.db2.gz AWBGZISRFVBXPR-JKSUJKDBSA-N 1 1 340.445 2.691 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C(=O)NCC2CC2)C1 ZINC000183267647 474362385 /nfs/dbraw/zinc/36/23/85/474362385.db2.gz DKAIZDRWUGSCAA-INIZCTEOSA-N 1 1 331.416 2.641 10 5 EFBEMO COc1ccccc1C[N@H+](CCO)Cc1ccc([N+](=O)[O-])cc1C ZINC000183283989 474366171 /nfs/dbraw/zinc/36/61/71/474366171.db2.gz JRUBVFWJFKMDRM-UHFFFAOYSA-N 1 1 330.384 2.906 10 5 EFBEMO COc1ccccc1C[N@@H+](CCO)Cc1ccc([N+](=O)[O-])cc1C ZINC000183283989 474366175 /nfs/dbraw/zinc/36/61/75/474366175.db2.gz JRUBVFWJFKMDRM-UHFFFAOYSA-N 1 1 330.384 2.906 10 5 EFBEMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)CC(F)(F)F ZINC000189344257 474367071 /nfs/dbraw/zinc/36/70/71/474367071.db2.gz FVAJSWPMRYZZRQ-SNVBAGLBSA-N 1 1 326.702 2.993 10 5 EFBEMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)CC(F)(F)F ZINC000189344257 474367084 /nfs/dbraw/zinc/36/70/84/474367084.db2.gz FVAJSWPMRYZZRQ-SNVBAGLBSA-N 1 1 326.702 2.993 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@H](O)COCc1ccccc1 ZINC000183296800 474369482 /nfs/dbraw/zinc/36/94/82/474369482.db2.gz YSAUODZAOUGXEV-IBGZPJMESA-N 1 1 344.411 2.913 10 5 EFBEMO C[C@@H]([NH2+][C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCCO1 ZINC000248589777 474370409 /nfs/dbraw/zinc/37/04/09/474370409.db2.gz KREIVWAUKCZDJA-UHIISALHSA-N 1 1 332.360 2.863 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000248611242 474375802 /nfs/dbraw/zinc/37/58/02/474375802.db2.gz XQUQRSMVSKSSMT-OCCSQVGLSA-N 1 1 337.395 2.780 10 5 EFBEMO C[C@@H]1C[C@H](N(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC[N@H+]1C ZINC000265942498 474394944 /nfs/dbraw/zinc/39/49/44/474394944.db2.gz IFTFJNGYYRAHQC-DGCLKSJQSA-N 1 1 331.372 2.896 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2CCC[N@H+]2C[C@H]1C ZINC000248842227 474452398 /nfs/dbraw/zinc/45/23/98/474452398.db2.gz NWHZSQCRJQTYFP-KYJSFNMBSA-N 1 1 345.443 2.859 10 5 EFBEMO Cc1c(C[NH+]2CCN(c3cc(C4CC4)[nH]n3)CC2)cccc1[N+](=O)[O-] ZINC000189678479 474460929 /nfs/dbraw/zinc/46/09/29/474460929.db2.gz UCUSUXCOBWREOV-UHFFFAOYSA-N 1 1 341.415 2.826 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC[N@@H+](CC)C1 ZINC000184703146 474589849 /nfs/dbraw/zinc/58/98/49/474589849.db2.gz ZSEXJELWLUHSCV-JKSUJKDBSA-N 1 1 333.432 2.622 10 5 EFBEMO COc1ccc(C[N@H+]2C[C@@H](CO)[C@@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000249557025 474592386 /nfs/dbraw/zinc/59/23/86/474592386.db2.gz KEHKAMLYVUJTIL-LSDHHAIUSA-N 1 1 348.424 2.873 10 5 EFBEMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000291618722 474632630 /nfs/dbraw/zinc/63/26/30/474632630.db2.gz TWGVAFGIGLJWTL-GFCCVEGCSA-N 1 1 332.404 2.926 10 5 EFBEMO C[N@H+]1CC[C@H]2OCCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000284447774 474642136 /nfs/dbraw/zinc/64/21/36/474642136.db2.gz CHFSTOPUNJVKLJ-ZIAGYGMSSA-N 1 1 345.321 2.523 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2c2cc[nH]n2)cccc1[N+](=O)[O-] ZINC000278521873 474679596 /nfs/dbraw/zinc/67/95/96/474679596.db2.gz CQWRCOLEGKIWOX-MRXNPFEDSA-N 1 1 343.387 2.792 10 5 EFBEMO Cc1nc(N[C@@H]2CC[N@H+](C[C@@H]3CCCO3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000252512294 474690643 /nfs/dbraw/zinc/69/06/43/474690643.db2.gz OWSOHGRCOGBKKM-VHDGCEQUSA-N 1 1 334.420 2.600 10 5 EFBEMO CCc1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)nc1 ZINC000338908644 474719932 /nfs/dbraw/zinc/71/99/32/474719932.db2.gz UDXCMYGUQXJSKN-UHFFFAOYSA-N 1 1 326.400 2.874 10 5 EFBEMO CC(C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1CCOC1 ZINC000291894133 474737575 /nfs/dbraw/zinc/73/75/75/474737575.db2.gz QVVSWZNIBFNSOD-CYBMUJFWSA-N 1 1 339.367 2.562 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1C[N@@H+](C2CC2)C[C@H]1C ZINC000278658526 474760138 /nfs/dbraw/zinc/76/01/38/474760138.db2.gz NYSUUZHSRFZUCZ-ZWNOBZJWSA-N 1 1 337.807 2.769 10 5 EFBEMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000284804368 474779588 /nfs/dbraw/zinc/77/95/88/474779588.db2.gz OUQSDCVLYWGDGU-HNNXBMFYSA-N 1 1 349.431 2.874 10 5 EFBEMO CC(C)(C)[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1O ZINC000273231373 474790259 /nfs/dbraw/zinc/79/02/59/474790259.db2.gz DIMYYDZDGYPUIJ-JSGCOSHPSA-N 1 1 333.388 2.965 10 5 EFBEMO CC(C)(C)[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1O ZINC000273231373 474790264 /nfs/dbraw/zinc/79/02/64/474790264.db2.gz DIMYYDZDGYPUIJ-JSGCOSHPSA-N 1 1 333.388 2.965 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H](Cn2cncn2)C1 ZINC000255073480 474797819 /nfs/dbraw/zinc/79/78/19/474797819.db2.gz HOKCJENTJKRIPC-IJVDHGTGSA-N 1 1 327.388 2.612 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)cc1[N+](=O)[O-] ZINC000344849531 474800016 /nfs/dbraw/zinc/80/00/16/474800016.db2.gz DNNZTDAVLWGXRU-CYBMUJFWSA-N 1 1 344.371 2.853 10 5 EFBEMO Cc1cc(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2ccnn2C)ncc1[N+](=O)[O-] ZINC000284878635 474810217 /nfs/dbraw/zinc/81/02/17/474810217.db2.gz NDODOQQHZCIRMD-SUMWQHHRSA-N 1 1 344.419 2.527 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@]2(CCCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000337259012 474835273 /nfs/dbraw/zinc/83/52/73/474835273.db2.gz VQQXLAACACZGLZ-SFHVURJKSA-N 1 1 347.415 2.816 10 5 EFBEMO Cc1nc(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2ccnn2C)ccc1[N+](=O)[O-] ZINC000284992117 474856163 /nfs/dbraw/zinc/85/61/63/474856163.db2.gz SVELDADWHWNNRB-SUMWQHHRSA-N 1 1 344.419 2.527 10 5 EFBEMO CCc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc1 ZINC000339037645 474863904 /nfs/dbraw/zinc/86/39/04/474863904.db2.gz OSZGQLIZMZHPCQ-OAHLLOKOSA-N 1 1 327.388 2.634 10 5 EFBEMO C[N@H+]1CCO[C@@H]2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C[C@H]21 ZINC000285065623 474880405 /nfs/dbraw/zinc/88/04/05/474880405.db2.gz OWIUTEKMDQPQKW-ZIAGYGMSSA-N 1 1 345.321 2.523 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000341056093 474923152 /nfs/dbraw/zinc/92/31/52/474923152.db2.gz IHCRABVGFXFBIT-GASCZTMLSA-N 1 1 348.447 2.776 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000292255294 474924730 /nfs/dbraw/zinc/92/47/30/474924730.db2.gz FANVLLZBKGPTQB-ZDUSSCGKSA-N 1 1 331.416 2.850 10 5 EFBEMO CC[N@H+]1CC[C@H]2OCCN(Cc3ccc(Cl)c([N+](=O)[O-])c3)[C@H]2C1 ZINC000293331105 474931163 /nfs/dbraw/zinc/93/11/63/474931163.db2.gz RPVLHWLNOOVMPV-JKSUJKDBSA-N 1 1 339.823 2.543 10 5 EFBEMO CNc1c(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000361212375 475274616 /nfs/dbraw/zinc/27/46/16/475274616.db2.gz MVYHPZMTRJQSKD-BETUJISGSA-N 1 1 334.420 2.629 10 5 EFBEMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(-c2ccoc2)no1 ZINC000352543249 475397761 /nfs/dbraw/zinc/39/77/61/475397761.db2.gz BVYNGOPIEOSZRV-UHFFFAOYSA-N 1 1 328.328 2.912 10 5 EFBEMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(-c2ccoc2)no1 ZINC000352543249 475397769 /nfs/dbraw/zinc/39/77/69/475397769.db2.gz BVYNGOPIEOSZRV-UHFFFAOYSA-N 1 1 328.328 2.912 10 5 EFBEMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)Nc1cc(F)cc(F)c1 ZINC000352543234 475398106 /nfs/dbraw/zinc/39/81/06/475398106.db2.gz BPRGJPOCTSQDQL-UHFFFAOYSA-N 1 1 349.337 2.986 10 5 EFBEMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)Nc1cc(F)cc(F)c1 ZINC000352543234 475398110 /nfs/dbraw/zinc/39/81/10/475398110.db2.gz BPRGJPOCTSQDQL-UHFFFAOYSA-N 1 1 349.337 2.986 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@]3(C2)CCCOC3)cccc1[N+](=O)[O-] ZINC000342024816 475513992 /nfs/dbraw/zinc/51/39/92/475513992.db2.gz ULGQHZVABYIHPN-KDOFPFPSSA-N 1 1 347.415 2.733 10 5 EFBEMO COc1cc(C[N@H+]2CCCCC[C@@H]2CCO)c([N+](=O)[O-])cc1F ZINC000342040519 475525845 /nfs/dbraw/zinc/52/58/45/475525845.db2.gz XCAHSUAXDIXQFS-CYBMUJFWSA-N 1 1 326.368 2.870 10 5 EFBEMO CC[C@H](NC(=O)C[N@@H+](C)[C@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000339990912 475666974 /nfs/dbraw/zinc/66/69/74/475666974.db2.gz CMYDICDYWCKNEI-GJZGRUSLSA-N 1 1 337.445 2.599 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000340087685 475748215 /nfs/dbraw/zinc/74/82/15/475748215.db2.gz 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COCC[N@H+](Cc1c(C)nn(C)c1C)Cc1ccc([N+](=O)[O-])cc1C ZINC000453619490 477255918 /nfs/dbraw/zinc/25/59/18/477255918.db2.gz UKEUPNWDPGVTSI-UHFFFAOYSA-N 1 1 346.431 2.902 10 5 EFBEMO COCC[N@@H+](Cc1c(C)nn(C)c1C)Cc1ccc([N+](=O)[O-])cc1C ZINC000453619490 477255922 /nfs/dbraw/zinc/25/59/22/477255922.db2.gz UKEUPNWDPGVTSI-UHFFFAOYSA-N 1 1 346.431 2.902 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C(N)=O)[C@@H](c2ccccc2)C1 ZINC000411966978 477400559 /nfs/dbraw/zinc/40/05/59/477400559.db2.gz CMTYDXSXVSHTCE-VHSSKADRSA-N 1 1 339.395 2.857 10 5 EFBEMO CC[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000425451536 477684563 /nfs/dbraw/zinc/68/45/63/477684563.db2.gz XBEZVPIRZCEJHO-GFCCVEGCSA-N 1 1 329.194 2.968 10 5 EFBEMO CC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000425451536 477684573 /nfs/dbraw/zinc/68/45/73/477684573.db2.gz XBEZVPIRZCEJHO-GFCCVEGCSA-N 1 1 329.194 2.968 10 5 EFBEMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(OC[C@@H]2CCOC2)CC1 ZINC000372391407 477783791 /nfs/dbraw/zinc/78/37/91/477783791.db2.gz BWKNGAUNBPNXDK-CYBMUJFWSA-N 1 1 338.379 2.751 10 5 EFBEMO C[C@@]1(F)CCC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1 ZINC000451112269 477831445 /nfs/dbraw/zinc/83/14/45/477831445.db2.gz HXRPPEIDJXDMQO-MRXNPFEDSA-N 1 1 337.351 2.717 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](O)CC23CCC3)cccc1[N+](=O)[O-] ZINC000420990450 477882292 /nfs/dbraw/zinc/88/22/92/477882292.db2.gz FSHXNELPJMMMHT-AWEZNQCLSA-N 1 1 347.415 2.611 10 5 EFBEMO CCC[N@@H+](CC)C[C@H](C)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000428501275 477915112 /nfs/dbraw/zinc/91/51/12/477915112.db2.gz UXUDLORLUDWDAD-NSHDSACASA-N 1 1 343.374 2.652 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451344128 477966091 /nfs/dbraw/zinc/96/60/91/477966091.db2.gz PETXMVBOGHUZNN-UXLLHSPISA-N 1 1 334.416 2.989 10 5 EFBEMO C[C@]12CC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@H]1C2(F)F ZINC000428727704 477969184 /nfs/dbraw/zinc/96/91/84/477969184.db2.gz CUOFECJEKQDGIU-HIFRSBDPSA-N 1 1 339.342 2.901 10 5 EFBEMO O=C(C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O)Nc1ccccc1[N+](=O)[O-] ZINC000451350864 477969576 /nfs/dbraw/zinc/96/95/76/477969576.db2.gz ZYHNTRPWCKILSG-LXZKKBNFSA-N 1 1 347.415 2.549 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H]2[C@@H]3C=C[C@@H](C3)[C@]2(C)C1 ZINC000451376140 477982615 /nfs/dbraw/zinc/98/26/15/477982615.db2.gz VJXAOBGEAGPBTI-DZASIIFFSA-N 1 1 341.411 2.986 10 5 EFBEMO Cc1[nH+]ccn1CCCN(C)c1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC000516764816 477985270 /nfs/dbraw/zinc/98/52/70/477985270.db2.gz NLJRBLRFTXIBGO-UHFFFAOYSA-N 1 1 329.404 2.900 10 5 EFBEMO COC(=O)C(C)(C)N1CC[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000494462754 477991571 /nfs/dbraw/zinc/99/15/71/477991571.db2.gz HKWXDKDFYJTYBJ-CQSZACIVSA-N 1 1 349.431 2.533 10 5 EFBEMO Cn1cc(C[N@@H+](C)[C@H]2CC[C@H](O)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000439774385 478027353 /nfs/dbraw/zinc/02/73/53/478027353.db2.gz KZFNQHCRHHXBOS-JCNLHEQBSA-N 1 1 344.415 2.731 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@@H](O)[C@H](C3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000459799803 478101178 /nfs/dbraw/zinc/10/11/78/478101178.db2.gz YEEGAGWRLGVTCE-DOTOQJQBSA-N 1 1 334.416 2.976 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@H]2C[C@@H](OC)C23CCC3)c1 ZINC000590661491 478280030 /nfs/dbraw/zinc/28/00/30/478280030.db2.gz ZFQWDHZEMXJWAE-JKSUJKDBSA-N 1 1 348.399 2.771 10 5 EFBEMO O=C(NC[C@H]1CC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000600227337 478296636 /nfs/dbraw/zinc/29/66/36/478296636.db2.gz AOOPBEFITUUMPD-CQSZACIVSA-N 1 1 335.379 2.871 10 5 EFBEMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)c1 ZINC000600228377 478298012 /nfs/dbraw/zinc/29/80/12/478298012.db2.gz KOLRIUFVCHJATN-CQSZACIVSA-N 1 1 347.415 2.740 10 5 EFBEMO Cc1c(CC(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)cccc1[N+](=O)[O-] ZINC000600228490 478298439 /nfs/dbraw/zinc/29/84/39/478298439.db2.gz BTWKMUBMRRXTSG-KRWDZBQOSA-N 1 1 345.443 2.969 10 5 EFBEMO O=[N+]([O-])c1cccnc1N1CC[NH+](Cc2ccc3cnccc3c2)CC1 ZINC000590781118 478336553 /nfs/dbraw/zinc/33/65/53/478336553.db2.gz YGKZCCABDMZFIT-UHFFFAOYSA-N 1 1 349.394 2.860 10 5 EFBEMO COc1cc(C[NH+]2CCC([C@@H](O)C(F)(F)F)CC2)ccc1[N+](=O)[O-] ZINC000538708676 478376759 /nfs/dbraw/zinc/37/67/59/478376759.db2.gz IVBFEJVFCBDXKU-CQSZACIVSA-N 1 1 348.321 2.739 10 5 EFBEMO CCOc1ccc(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000600470732 478381883 /nfs/dbraw/zinc/38/18/83/478381883.db2.gz IFBXVHVEKBLVJK-OAHLLOKOSA-N 1 1 347.415 2.740 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600468223 478383280 /nfs/dbraw/zinc/38/32/80/478383280.db2.gz DZQKNBVDDQXEKE-AWEZNQCLSA-N 1 1 347.415 2.740 10 5 EFBEMO C[C@@H](C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000600474527 478384471 /nfs/dbraw/zinc/38/44/71/478384471.db2.gz XWRQZZPLFLCOKX-DOMZBBRYSA-N 1 1 349.406 2.971 10 5 EFBEMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000600474067 478385090 /nfs/dbraw/zinc/38/50/90/478385090.db2.gz WNQDKRZLCCZJCK-CQSZACIVSA-N 1 1 342.399 2.823 10 5 EFBEMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000597576375 478417807 /nfs/dbraw/zinc/41/78/07/478417807.db2.gz BUTSQSQFBGEGCP-KGLIPLIRSA-N 1 1 347.346 2.599 10 5 EFBEMO CCc1ccc([C@H]([NH2+]C[C@@](C)(CO)OC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000594511773 478419106 /nfs/dbraw/zinc/41/91/06/478419106.db2.gz OOCRQAFSQHXIGA-MSOLQXFVSA-N 1 1 348.399 2.827 10 5 EFBEMO CC(C)(C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000597581820 478420437 /nfs/dbraw/zinc/42/04/37/478420437.db2.gz RKDYZJKWBVLYRH-CVEARBPZSA-N 1 1 349.406 2.517 10 5 EFBEMO O=[N+]([O-])c1ccc(CCO)c(-c2cccc(C[NH+]3CCOCC3)c2)c1 ZINC000600793389 478524105 /nfs/dbraw/zinc/52/41/05/478524105.db2.gz NRISAFFBNXUZEF-UHFFFAOYSA-N 1 1 342.395 2.629 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)c1 ZINC000597858187 478543881 /nfs/dbraw/zinc/54/38/81/478543881.db2.gz LSGBOYJOXGEPSD-CQSZACIVSA-N 1 1 349.431 2.661 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000597859593 478546202 /nfs/dbraw/zinc/54/62/02/478546202.db2.gz VTCPARYRHOHNGZ-GFCCVEGCSA-N 1 1 325.796 2.851 10 5 EFBEMO COc1ncc(C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)cc1Cl ZINC000541617246 478573374 /nfs/dbraw/zinc/57/33/74/478573374.db2.gz BYYBUAJFSKTIEJ-UHFFFAOYSA-N 1 1 334.763 2.605 10 5 EFBEMO COc1ncc(C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)cc1Cl ZINC000541617246 478573383 /nfs/dbraw/zinc/57/33/83/478573383.db2.gz BYYBUAJFSKTIEJ-UHFFFAOYSA-N 1 1 334.763 2.605 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000591529807 478573977 /nfs/dbraw/zinc/57/39/77/478573977.db2.gz KGOMRIRGRFRKGF-GOOCMWNKSA-N 1 1 331.416 2.957 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000571382093 478582537 /nfs/dbraw/zinc/58/25/37/478582537.db2.gz HNZVQZKSFDYQOS-KEYYUXOJSA-N 1 1 333.432 2.887 10 5 EFBEMO COc1cc(CNC[C@@H]2CC[N@@H+]2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000594967808 478610590 /nfs/dbraw/zinc/61/05/90/478610590.db2.gz VQYXATILYSWWIG-ZDUSSCGKSA-N 1 1 337.420 2.574 10 5 EFBEMO COc1cc(CNC[C@@H]2CC[N@H+]2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000594967808 478610595 /nfs/dbraw/zinc/61/05/95/478610595.db2.gz VQYXATILYSWWIG-ZDUSSCGKSA-N 1 1 337.420 2.574 10 5 EFBEMO C[C@@H]([NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1nccn1C ZINC000594995994 478622901 /nfs/dbraw/zinc/62/29/01/478622901.db2.gz PXGAVLLPCSJYAU-GFCCVEGCSA-N 1 1 340.387 2.580 10 5 EFBEMO CCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598039447 478626748 /nfs/dbraw/zinc/62/67/48/478626748.db2.gz KBRAXVCPIDIGRU-OAHLLOKOSA-N 1 1 349.431 2.938 10 5 EFBEMO CCN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1 ZINC000598039460 478627712 /nfs/dbraw/zinc/62/77/12/478627712.db2.gz KHYXSMDAMFWTJB-INIZCTEOSA-N 1 1 347.415 2.500 10 5 EFBEMO CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@@H+](CC)C1 ZINC000598040685 478628682 /nfs/dbraw/zinc/62/86/82/478628682.db2.gz QIWGGBPDUYSRRD-CQSZACIVSA-N 1 1 339.823 2.733 10 5 EFBEMO CCN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1 ZINC000598040697 478629382 /nfs/dbraw/zinc/62/93/82/478629382.db2.gz QNJYABGMCVPHJL-ZDUSSCGKSA-N 1 1 325.796 2.805 10 5 EFBEMO COC1CC(CC[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000595050648 478641746 /nfs/dbraw/zinc/64/17/46/478641746.db2.gz TVLOGUICLGULER-QWFMPGPPSA-N 1 1 344.415 2.822 10 5 EFBEMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000582625043 478645167 /nfs/dbraw/zinc/64/51/67/478645167.db2.gz IFCROIQTERKSNG-OAHLLOKOSA-N 1 1 349.431 2.615 10 5 EFBEMO CC[N@H+]1CCCC[C@@H]1CNc1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601115728 478664276 /nfs/dbraw/zinc/66/42/76/478664276.db2.gz JMDJDKXEVCWZRX-SECBINFHSA-N 1 1 335.330 2.633 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C[C@H]1C ZINC000601122404 478669895 /nfs/dbraw/zinc/66/98/95/478669895.db2.gz VVRPUFPAKDMPRD-NXEZZACHSA-N 1 1 349.357 2.656 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1c(Br)cnn1C ZINC000601145016 478686162 /nfs/dbraw/zinc/68/61/62/478686162.db2.gz YYHGXVIYEIQZJK-UHFFFAOYSA-N 1 1 339.193 2.689 10 5 EFBEMO Cc1cccn2c(C[NH2+][C@](C)(CO)c3cccc([N+](=O)[O-])c3)cnc12 ZINC000601149500 478689098 /nfs/dbraw/zinc/68/90/98/478689098.db2.gz MYZWDYYXAJOELH-GOSISDBHSA-N 1 1 340.383 2.548 10 5 EFBEMO COc1ccc(F)c(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c1 ZINC000601150312 478689839 /nfs/dbraw/zinc/68/98/39/478689839.db2.gz VGCPZPYBGLJYIV-QGZVFWFLSA-N 1 1 334.347 2.740 10 5 EFBEMO C[C@](CO)([NH2+]Cc1cnc(C2CC2)s1)c1cccc([N+](=O)[O-])c1 ZINC000601150349 478690405 /nfs/dbraw/zinc/69/04/05/478690405.db2.gz WCNWOZLKHJSKGI-MRXNPFEDSA-N 1 1 333.413 2.926 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000601154586 478692548 /nfs/dbraw/zinc/69/25/48/478692548.db2.gz PKXFROSHRGGRRV-JTQLQIEISA-N 1 1 347.341 2.776 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000601154587 478693049 /nfs/dbraw/zinc/69/30/49/478693049.db2.gz PKXFROSHRGGRRV-SNVBAGLBSA-N 1 1 347.341 2.776 10 5 EFBEMO CCC[N@H+]1CCC[C@H]1CNc1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601163322 478700154 /nfs/dbraw/zinc/70/01/54/478700154.db2.gz HONPCOALGWVELV-VIFPVBQESA-N 1 1 335.330 2.633 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC(Cn4cnnc4)CC3)c2c1 ZINC000601183867 478710787 /nfs/dbraw/zinc/71/07/87/478710787.db2.gz GNJAIMPHYKEATQ-UHFFFAOYSA-N 1 1 338.371 2.651 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)Nc1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601198854 478719100 /nfs/dbraw/zinc/71/91/00/478719100.db2.gz JADQVXRXOVXNMA-UHFFFAOYSA-N 1 1 337.346 2.879 10 5 EFBEMO CN(c1cc[nH+]c2ccc([N+](=O)[O-])cc21)[C@H]1CCCCN(C)C1=O ZINC000601229699 478737345 /nfs/dbraw/zinc/73/73/45/478737345.db2.gz YBGBNVHAPOWFDT-INIZCTEOSA-N 1 1 328.372 2.590 10 5 EFBEMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601311113 478779480 /nfs/dbraw/zinc/77/94/80/478779480.db2.gz YKGRKMHEYVJBJM-CXAGYDPISA-N 1 1 343.427 2.615 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H]1CCOC1)[C@H]1CC[C@H](O)CC1 ZINC000592131065 478787610 /nfs/dbraw/zinc/78/76/10/478787610.db2.gz SONHMLQFHHDHCW-XIRDDKMYSA-N 1 1 334.416 2.737 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccno1)[C@H]1CC[C@H](O)CC1 ZINC000592130734 478788050 /nfs/dbraw/zinc/78/80/50/478788050.db2.gz LHWLCBALCMFCFX-SHTZXODSSA-N 1 1 331.372 2.889 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccno1)[C@H]1CC[C@H](O)CC1 ZINC000592130734 478788057 /nfs/dbraw/zinc/78/80/57/478788057.db2.gz LHWLCBALCMFCFX-SHTZXODSSA-N 1 1 331.372 2.889 10 5 EFBEMO Cn1cc(C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)cn1 ZINC000592131042 478788481 /nfs/dbraw/zinc/78/84/81/478788481.db2.gz RNGKAFSJAGVHIK-QAQDUYKDSA-N 1 1 344.415 2.634 10 5 EFBEMO Cn1cc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)cn1 ZINC000592131042 478788488 /nfs/dbraw/zinc/78/84/88/478788488.db2.gz RNGKAFSJAGVHIK-QAQDUYKDSA-N 1 1 344.415 2.634 10 5 EFBEMO Cn1nccc1C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592132483 478789972 /nfs/dbraw/zinc/78/99/72/478789972.db2.gz HEYCEYDREBXVET-JCNLHEQBSA-N 1 1 344.415 2.634 10 5 EFBEMO Cn1nccc1C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592132483 478789978 /nfs/dbraw/zinc/78/99/78/478789978.db2.gz HEYCEYDREBXVET-JCNLHEQBSA-N 1 1 344.415 2.634 10 5 EFBEMO CC[C@@H]1[C@@H](C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CC[N@H+]1C ZINC000601353666 478797316 /nfs/dbraw/zinc/79/73/16/478797316.db2.gz DUVCPZLASWIGEF-JKSUJKDBSA-N 1 1 331.416 2.816 10 5 EFBEMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C1CCN(c2cnccn2)CC1 ZINC000595464323 478800239 /nfs/dbraw/zinc/80/02/39/478800239.db2.gz AHYGRLJQEUTBTD-UHFFFAOYSA-N 1 1 345.378 2.625 10 5 EFBEMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601402780 478819996 /nfs/dbraw/zinc/81/99/96/478819996.db2.gz WCLAPABXTVZSMB-ZIAGYGMSSA-N 1 1 331.416 2.568 10 5 EFBEMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601402780 478820006 /nfs/dbraw/zinc/82/00/06/478820006.db2.gz WCLAPABXTVZSMB-ZIAGYGMSSA-N 1 1 331.416 2.568 10 5 EFBEMO CCCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCc2ncsc2C1 ZINC000592189864 478820221 /nfs/dbraw/zinc/82/02/21/478820221.db2.gz YDCWCTVHPYGRAY-CYBMUJFWSA-N 1 1 349.460 2.907 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCC[C@@H]1C1CCC1 ZINC000592200472 478821987 /nfs/dbraw/zinc/82/19/87/478821987.db2.gz YZESVNCEVMKTJF-JKSUJKDBSA-N 1 1 334.416 2.989 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000598466598 478837665 /nfs/dbraw/zinc/83/76/65/478837665.db2.gz QJXQAINIEAOFRI-UHFFFAOYSA-N 1 1 339.461 2.924 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000598466203 478837898 /nfs/dbraw/zinc/83/78/98/478837898.db2.gz NPEQWKGZOULSFD-UHFFFAOYSA-N 1 1 346.431 2.855 10 5 EFBEMO COC(=O)[C@@H]1C[C@H](C(F)(F)F)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000595630182 478900343 /nfs/dbraw/zinc/90/03/43/478900343.db2.gz RQGUDYHZVKZULT-NEPJUHHUSA-N 1 1 346.305 2.768 10 5 EFBEMO COC(=O)[C@@H]1C[C@H](C(F)(F)F)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000595630182 478900349 /nfs/dbraw/zinc/90/03/49/478900349.db2.gz RQGUDYHZVKZULT-NEPJUHHUSA-N 1 1 346.305 2.768 10 5 EFBEMO C[C@@H]1CN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C[C@H](C)[N@H+]1C ZINC000601605992 478903276 /nfs/dbraw/zinc/90/32/76/478903276.db2.gz MZAQLXWRYKQKKH-OKILXGFUSA-N 1 1 331.416 2.568 10 5 EFBEMO C[C@@H]1CN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C[C@H](C)[N@@H+]1C ZINC000601605992 478903286 /nfs/dbraw/zinc/90/32/86/478903286.db2.gz MZAQLXWRYKQKKH-OKILXGFUSA-N 1 1 331.416 2.568 10 5 EFBEMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000601620427 478910935 /nfs/dbraw/zinc/91/09/35/478910935.db2.gz ITWMHHUGHYRKDH-QGZVFWFLSA-N 1 1 345.443 2.958 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](Nc3ncccn3)C2)c(Cl)c1 ZINC000592517144 478925753 /nfs/dbraw/zinc/92/57/53/478925753.db2.gz TZOKAXKAWSEYAL-GFCCVEGCSA-N 1 1 333.779 2.725 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Nc3ncccn3)C2)c(Cl)c1 ZINC000592517144 478925760 /nfs/dbraw/zinc/92/57/60/478925760.db2.gz TZOKAXKAWSEYAL-GFCCVEGCSA-N 1 1 333.779 2.725 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]2[C@H]2CCCOC2)c1 ZINC000592516981 478925845 /nfs/dbraw/zinc/92/58/45/478925845.db2.gz MNZOQSKAFDDWSZ-HOCLYGCPSA-N 1 1 348.399 2.772 10 5 EFBEMO C[C@@]12COC[C@@H]1C[N@@H+](Cc1coc(-c3ccc([N+](=O)[O-])cc3)n1)C2 ZINC000595760265 478981733 /nfs/dbraw/zinc/98/17/33/478981733.db2.gz SLMZKXGURFZTBE-SUMWQHHRSA-N 1 1 329.356 2.718 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000595781472 478993931 /nfs/dbraw/zinc/99/39/31/478993931.db2.gz UKCUXFXDIKZPGD-MBNYWOFBSA-N 1 1 335.404 2.730 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000595781472 478993940 /nfs/dbraw/zinc/99/39/40/478993940.db2.gz UKCUXFXDIKZPGD-MBNYWOFBSA-N 1 1 335.404 2.730 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](OC(F)F)C2)cccc1[N+](=O)[O-] ZINC000573147967 479002221 /nfs/dbraw/zinc/00/22/21/479002221.db2.gz VXVQGBKLPPEXLQ-NSHDSACASA-N 1 1 343.330 2.545 10 5 EFBEMO C[C@H]1COC2(CCCC2)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000595805702 479008615 /nfs/dbraw/zinc/00/86/15/479008615.db2.gz BCBQMKOPXNYXGV-AWEZNQCLSA-N 1 1 347.415 2.957 10 5 EFBEMO CCC[N@H+]1CC[C@@H](NC(=O)N[C@H](CC)c2cccc([N+](=O)[O-])c2)C1 ZINC000595808785 479010844 /nfs/dbraw/zinc/01/08/44/479010844.db2.gz WJZZZSVZTLEKIN-GDBMZVCRSA-N 1 1 334.420 2.829 10 5 EFBEMO C[C@H]1COC2(CCCC2)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000595813753 479012548 /nfs/dbraw/zinc/01/25/48/479012548.db2.gz BJSWDGXYHBFBQF-AWEZNQCLSA-N 1 1 347.415 2.957 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000592747400 479023646 /nfs/dbraw/zinc/02/36/46/479023646.db2.gz XSUVRHLWXSAPPL-ZDUSSCGKSA-N 1 1 345.403 2.533 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000592767092 479033598 /nfs/dbraw/zinc/03/35/98/479033598.db2.gz NUBPBAGSFUEJOT-CYBMUJFWSA-N 1 1 330.388 2.664 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)[C@@H](C)[C@@H]1C ZINC000584180091 479044275 /nfs/dbraw/zinc/04/42/75/479044275.db2.gz QUYQBMTYYOITST-QWRGUYRKSA-N 1 1 325.796 2.721 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C)[C@@H](C)[C@@H]1C ZINC000584180091 479044279 /nfs/dbraw/zinc/04/42/79/479044279.db2.gz QUYQBMTYYOITST-QWRGUYRKSA-N 1 1 325.796 2.721 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1ccc(NCC)c([N+](=O)[O-])c1 ZINC000598888446 479074233 /nfs/dbraw/zinc/07/42/33/479074233.db2.gz LGMHMTWPZQHNDT-UHFFFAOYSA-N 1 1 336.436 2.877 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](CCO)C2CCCCC2)c1 ZINC000593018016 479126824 /nfs/dbraw/zinc/12/68/24/479126824.db2.gz NONFPWNDFWUDQI-UHFFFAOYSA-N 1 1 336.388 2.508 10 5 EFBEMO Cc1cc(C2([NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)CCOCC2)on1 ZINC000599021233 479127888 /nfs/dbraw/zinc/12/78/88/479127888.db2.gz VJZRAMVDBVOLAM-UHFFFAOYSA-N 1 1 331.372 2.995 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](CO)c2ccccc2C)c1 ZINC000593022175 479128098 /nfs/dbraw/zinc/12/80/98/479128098.db2.gz CSPJCYVUFKEFHH-MRXNPFEDSA-N 1 1 344.367 2.513 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2cnccc2C)c1 ZINC000593023020 479130174 /nfs/dbraw/zinc/13/01/74/479130174.db2.gz NNVHETOBHQUZHB-LBPRGKRZSA-N 1 1 329.356 2.936 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCSC[C@@H]2C2CC2)c1 ZINC000593030927 479133759 /nfs/dbraw/zinc/13/37/59/479133759.db2.gz RREJSYPAQNVNFW-OAHLLOKOSA-N 1 1 336.413 2.709 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCSC[C@@H]2C2CC2)c1 ZINC000593030927 479133765 /nfs/dbraw/zinc/13/37/65/479133765.db2.gz RREJSYPAQNVNFW-OAHLLOKOSA-N 1 1 336.413 2.709 10 5 EFBEMO COC(=O)c1c(Cl)c(NC[C@@H]2CCC[N@H+]2C)ccc1[N+](=O)[O-] ZINC000596092955 479133809 /nfs/dbraw/zinc/13/38/09/479133809.db2.gz YIWXFSBBYWIZNJ-VIFPVBQESA-N 1 1 327.768 2.541 10 5 EFBEMO Cn1ccnc1[C@@H]([NH2+]CC[C@H]1CCCOC1)c1ccc([N+](=O)[O-])cc1 ZINC000599054458 479141125 /nfs/dbraw/zinc/14/11/25/479141125.db2.gz ABLFOFIASMNOAJ-PBHICJAKSA-N 1 1 344.415 2.824 10 5 EFBEMO COC(=O)c1c(Cl)c(NC[C@H](C)[N@@H+](C)C2CC2)ccc1[N+](=O)[O-] ZINC000596109518 479143652 /nfs/dbraw/zinc/14/36/52/479143652.db2.gz BXIHCNNAJMUQRL-VIFPVBQESA-N 1 1 341.795 2.929 10 5 EFBEMO CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)[C@H]1CCCOC1 ZINC000593068753 479157129 /nfs/dbraw/zinc/15/71/29/479157129.db2.gz OFYZXYLLUKBAEZ-AWEZNQCLSA-N 1 1 335.404 2.733 10 5 EFBEMO C[C@@H]1CO[C@@H](C)C[N@@H+]1CCNc1ccc2cnccc2c1[N+](=O)[O-] ZINC000599105541 479162711 /nfs/dbraw/zinc/16/27/11/479162711.db2.gz YQDGGZRWJAVOCM-OLZOCXBDSA-N 1 1 330.388 2.664 10 5 EFBEMO C[C@@H]1CO[C@@H](C)C[N@H+]1CCNc1ccc2cnccc2c1[N+](=O)[O-] ZINC000599105541 479162714 /nfs/dbraw/zinc/16/27/14/479162714.db2.gz YQDGGZRWJAVOCM-OLZOCXBDSA-N 1 1 330.388 2.664 10 5 EFBEMO COC(=O)c1ccnc(NC[C@@H]2CC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000599125675 479170667 /nfs/dbraw/zinc/17/06/67/479170667.db2.gz ABLQAQWVCZFRET-ZDUSSCGKSA-N 1 1 348.403 2.595 10 5 EFBEMO O=[N+]([O-])c1cccc2ncnc(NC[C@@H]3CC[N@H+]3C3CCCCC3)c21 ZINC000599126999 479170890 /nfs/dbraw/zinc/17/08/90/479170890.db2.gz LJDKQBVFPVZONO-AWEZNQCLSA-N 1 1 341.415 2.779 10 5 EFBEMO CC[N@@H+]1CCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)C[C@@H]1C ZINC000596172204 479178872 /nfs/dbraw/zinc/17/88/72/479178872.db2.gz INAVSUBAJHCOMR-JTQLQIEISA-N 1 1 341.795 2.565 10 5 EFBEMO CC[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)C[C@@H]1C ZINC000596172204 479178877 /nfs/dbraw/zinc/17/88/77/479178877.db2.gz INAVSUBAJHCOMR-JTQLQIEISA-N 1 1 341.795 2.565 10 5 EFBEMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593115214 479182053 /nfs/dbraw/zinc/18/20/53/479182053.db2.gz AMUDVZIJJFZSLB-HZMBPMFUSA-N 1 1 325.315 2.653 10 5 EFBEMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593115214 479182059 /nfs/dbraw/zinc/18/20/59/479182059.db2.gz AMUDVZIJJFZSLB-HZMBPMFUSA-N 1 1 325.315 2.653 10 5 EFBEMO COC(=O)c1c(Cl)c(NCC2=CC[N@@H+](C)CC2)ccc1[N+](=O)[O-] ZINC000596184345 479185219 /nfs/dbraw/zinc/18/52/19/479185219.db2.gz FUBGAQCZSVWNNI-UHFFFAOYSA-N 1 1 339.779 2.709 10 5 EFBEMO COC(=O)Cc1ccc(NC[C@H]2CC[N@H+]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000599165702 479191504 /nfs/dbraw/zinc/19/15/04/479191504.db2.gz QRJLJJPGWBOCPR-OAHLLOKOSA-N 1 1 347.415 2.739 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000593209049 479240792 /nfs/dbraw/zinc/24/07/92/479240792.db2.gz OIOCKRPDMHWRLA-UHFFFAOYSA-N 1 1 339.461 2.781 10 5 EFBEMO CC(C)[N@H+]1CCCC[C@H]1Cn1c(=O)c([N+](=O)[O-])cc2c1CCCC2 ZINC000596303808 479246337 /nfs/dbraw/zinc/24/63/37/479246337.db2.gz CZNLWHNFYJQQEO-HNNXBMFYSA-N 1 1 333.432 2.898 10 5 EFBEMO O=[N+]([O-])c1cccc(F)c1NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000596424545 479289563 /nfs/dbraw/zinc/28/95/63/479289563.db2.gz RVGZYOSEEXROBN-HNNXBMFYSA-N 1 1 345.374 2.913 10 5 EFBEMO O=[N+]([O-])c1ccsc1NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000596425528 479290387 /nfs/dbraw/zinc/29/03/87/479290387.db2.gz ZTAJRDFLTJMGJR-AWEZNQCLSA-N 1 1 333.413 2.835 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCOC3CCOCC3)C2)cc1 ZINC000599434291 479296454 /nfs/dbraw/zinc/29/64/54/479296454.db2.gz XGZLJWMKBSARBS-INIZCTEOSA-N 1 1 334.416 2.970 10 5 EFBEMO CCN(C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000596453680 479300376 /nfs/dbraw/zinc/30/03/76/479300376.db2.gz JUXCXVBZFHBSDX-HIFRSBDPSA-N 1 1 334.420 2.700 10 5 EFBEMO CCN(C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000596453681 479300855 /nfs/dbraw/zinc/30/08/55/479300855.db2.gz JUXCXVBZFHBSDX-UKRRQHHQSA-N 1 1 334.420 2.700 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H](C(F)F)C2)cccc1[N+](=O)[O-] ZINC000611179876 479303679 /nfs/dbraw/zinc/30/36/79/479303679.db2.gz MLIMBMOXPYHPMM-QWRGUYRKSA-N 1 1 327.331 2.817 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](C(F)F)C2)cccc1[N+](=O)[O-] ZINC000611179876 479303686 /nfs/dbraw/zinc/30/36/86/479303686.db2.gz MLIMBMOXPYHPMM-QWRGUYRKSA-N 1 1 327.331 2.817 10 5 EFBEMO C[N@H+]1CCO[C@@H]2CCN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)C[C@@H]21 ZINC000585781972 479325164 /nfs/dbraw/zinc/32/51/64/479325164.db2.gz GYPISXYTXYITOH-JKSUJKDBSA-N 1 1 349.431 2.681 10 5 EFBEMO COc1ccc(OCC[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c([N+](=O)[O-])c1 ZINC000599553128 479330906 /nfs/dbraw/zinc/33/09/06/479330906.db2.gz OEBVEFRIBKNESO-KGLIPLIRSA-N 1 1 338.429 2.952 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553480 479331150 /nfs/dbraw/zinc/33/11/50/479331150.db2.gz WPNSRZUXIMPQFW-DFBGVHRSSA-N 1 1 335.429 2.892 10 5 EFBEMO O=C(CC[N@H+]1CC[C@H]2CC[C@@H](C1)S2)Nc1ccccc1[N+](=O)[O-] ZINC000599553345 479331360 /nfs/dbraw/zinc/33/13/60/479331360.db2.gz PYDCZQZHJBWFNC-OLZOCXBDSA-N 1 1 335.429 2.893 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)[C@H](C)C1 ZINC000611273854 479333803 /nfs/dbraw/zinc/33/38/03/479333803.db2.gz PRMZZFGRDIJYMV-HIFRSBDPSA-N 1 1 349.431 2.528 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@@H]([C@H]3CCOC3)C1)OCCO2 ZINC000611287569 479338342 /nfs/dbraw/zinc/33/83/42/479338342.db2.gz RTBIFGDWPOXXHD-KGLIPLIRSA-N 1 1 348.399 2.615 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c1 ZINC000596569622 479343632 /nfs/dbraw/zinc/34/36/32/479343632.db2.gz AHFZTCSWDYJGBG-AWEZNQCLSA-N 1 1 347.415 2.915 10 5 EFBEMO CC(C)(CNc1ccnc2cc([N+](=O)[O-])ccc21)[NH+]1CCOCC1 ZINC000593458203 479350153 /nfs/dbraw/zinc/35/01/53/479350153.db2.gz JXIDHGGWQBYVKF-UHFFFAOYSA-N 1 1 330.388 2.666 10 5 EFBEMO C[N@@H+]1CCCC[C@H]1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000586835982 479362465 /nfs/dbraw/zinc/36/24/65/479362465.db2.gz UDFCMKBHJIYZDB-LBPRGKRZSA-N 1 1 342.193 2.780 10 5 EFBEMO C[N@H+]1CCCC[C@H]1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000586835982 479362471 /nfs/dbraw/zinc/36/24/71/479362471.db2.gz UDFCMKBHJIYZDB-LBPRGKRZSA-N 1 1 342.193 2.780 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)[C@@H]2CCC[C@H]21 ZINC000599649878 479368897 /nfs/dbraw/zinc/36/88/97/479368897.db2.gz DTFMGYZQOPOKTF-ARFHVFGLSA-N 1 1 348.399 2.767 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)[C@@H]2CCC[C@H]21 ZINC000599649878 479368898 /nfs/dbraw/zinc/36/88/98/479368898.db2.gz DTFMGYZQOPOKTF-ARFHVFGLSA-N 1 1 348.399 2.767 10 5 EFBEMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+](C)C1 ZINC000611402508 479369659 /nfs/dbraw/zinc/36/96/59/479369659.db2.gz QPPMAFKGMCHOPH-LBPRGKRZSA-N 1 1 337.445 2.919 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@H]21 ZINC000599662772 479377899 /nfs/dbraw/zinc/37/78/99/479377899.db2.gz XJLWZOAQEHGAOZ-GVDBMIGSSA-N 1 1 348.399 2.637 10 5 EFBEMO CCC1(N2CCOCC2)CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000599670687 479382538 /nfs/dbraw/zinc/38/25/38/479382538.db2.gz YMBIMBCMMCMMPS-UHFFFAOYSA-N 1 1 333.432 2.672 10 5 EFBEMO C[N@H+]1CC[C@H](Nc2cc(N)c([N+](=O)[O-])c(CO)c2)[C@H]1c1ccccc1 ZINC000588007910 479383272 /nfs/dbraw/zinc/38/32/72/479383272.db2.gz MKEXCIORZODVHB-FUHWJXTLSA-N 1 1 342.399 2.527 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(c2ncnc3cccc([N+](=O)[O-])c32)CC1 ZINC000588037814 479386479 /nfs/dbraw/zinc/38/64/79/479386479.db2.gz CCLWBMBNTKUGDF-UHFFFAOYSA-N 1 1 338.371 2.884 10 5 EFBEMO Nc1cc(NC[C@H]2CCC[N@H+]2C2CCCCC2)cc(CO)c1[N+](=O)[O-] ZINC000588039373 479386628 /nfs/dbraw/zinc/38/66/28/479386628.db2.gz RWXRYULLRDVDOG-MRXNPFEDSA-N 1 1 348.447 2.878 10 5 EFBEMO COc1cc(C[N@@H+]2CCC[C@H]2c2cn(C)nc2C)ccc1[N+](=O)[O-] ZINC000611516444 479403276 /nfs/dbraw/zinc/40/32/76/479403276.db2.gz ZMDMCNXCEYPXAJ-HNNXBMFYSA-N 1 1 330.388 2.982 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@H]2c2cn(C)nc2C)ccc1[N+](=O)[O-] ZINC000611516444 479403278 /nfs/dbraw/zinc/40/32/78/479403278.db2.gz ZMDMCNXCEYPXAJ-HNNXBMFYSA-N 1 1 330.388 2.982 10 5 EFBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2CCC(C3(O)CC3)CC2)c1 ZINC000593647716 479412858 /nfs/dbraw/zinc/41/28/58/479412858.db2.gz HVHRDLSDNGPMAU-UHFFFAOYSA-N 1 1 342.342 2.933 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3C[C@@H]4C[C@H]3C[S@]4=O)o2)c1 ZINC000593686439 479423013 /nfs/dbraw/zinc/42/30/13/479423013.db2.gz DNRHKWFEWBAAGG-VXOUBLIBSA-N 1 1 332.381 2.560 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3C[C@@H]4C[C@H]3C[S@]4=O)o2)c1 ZINC000593686439 479423020 /nfs/dbraw/zinc/42/30/20/479423020.db2.gz DNRHKWFEWBAAGG-VXOUBLIBSA-N 1 1 332.381 2.560 10 5 EFBEMO COCC[N@H+]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])C(C)(C)C1 ZINC000593694347 479425440 /nfs/dbraw/zinc/42/54/40/479425440.db2.gz YYSIJYUKKKCMSI-SOFGYWHQSA-N 1 1 333.432 2.651 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](c3ccncn3)C2)c1 ZINC000603833345 479433733 /nfs/dbraw/zinc/43/37/33/479433733.db2.gz HGGLWXBOMPBMRQ-AWEZNQCLSA-N 1 1 328.372 2.643 10 5 EFBEMO O=[N+]([O-])c1ccc(O)cc1CN1CC[NH2+]C[C@@H]1c1cccc(F)c1 ZINC000593727444 479436798 /nfs/dbraw/zinc/43/67/98/479436798.db2.gz JQCIUHWYTFQQTA-QGZVFWFLSA-N 1 1 331.347 2.586 10 5 EFBEMO C[C@@H]1C[C@H](NC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)CC[N@H+]1C ZINC000599832242 479443035 /nfs/dbraw/zinc/44/30/35/479443035.db2.gz TYGBZTVHQACPKJ-VXGBXAGGSA-N 1 1 343.387 2.747 10 5 EFBEMO CN(CC[N@@H+](C)C1CC1)C(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599832867 479444331 /nfs/dbraw/zinc/44/43/31/479444331.db2.gz LPQHITNQXHEDMJ-UHFFFAOYSA-N 1 1 343.387 2.701 10 5 EFBEMO C[N@@H+](CCNc1ncnc2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000611708219 479453057 /nfs/dbraw/zinc/45/30/57/479453057.db2.gz LGBGLLXIZMFHAV-UHFFFAOYSA-N 1 1 329.404 2.636 10 5 EFBEMO COc1cccc([N+](=O)[O-])c1NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000589104556 479478148 /nfs/dbraw/zinc/47/81/48/479478148.db2.gz RAJAHTXVFFBYMS-CHWSQXEVSA-N 1 1 337.420 2.903 10 5 EFBEMO CNc1ccc(C(=O)NCC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000604458811 479521506 /nfs/dbraw/zinc/52/15/06/479521506.db2.gz BSGDOCHYDZDDSM-UHFFFAOYSA-N 1 1 334.420 2.631 10 5 EFBEMO COCC[N@@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])C1CCCC1 ZINC000589496020 479534306 /nfs/dbraw/zinc/53/43/06/479534306.db2.gz ZLOQWYYRLBDEON-UHFFFAOYSA-N 1 1 336.388 2.772 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000589502207 479534333 /nfs/dbraw/zinc/53/43/33/479534333.db2.gz OOIRZGHVAFAALA-XJKSGUPXSA-N 1 1 349.431 2.686 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C3CCOCC3)C2)c1 ZINC000589502689 479535502 /nfs/dbraw/zinc/53/55/02/479535502.db2.gz DUMJFEXLBMZQFR-HNNXBMFYSA-N 1 1 348.399 2.630 10 5 EFBEMO CCC[N@@H+](C)C[C@H]1CCN(Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC000589502825 479535921 /nfs/dbraw/zinc/53/59/21/479535921.db2.gz BIGZXCFJUCEGMN-CQSZACIVSA-N 1 1 349.431 2.545 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C3CCOCC3)C2)c1 ZINC000589502691 479536218 /nfs/dbraw/zinc/53/62/18/479536218.db2.gz DUMJFEXLBMZQFR-OAHLLOKOSA-N 1 1 348.399 2.630 10 5 EFBEMO Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCN(c2ccc(Cl)cc2)CC1 ZINC000602767854 479538421 /nfs/dbraw/zinc/53/84/21/479538421.db2.gz GYBSVRVAPRLWIM-UHFFFAOYSA-N 1 1 349.822 2.575 10 5 EFBEMO C[C@@]12CC[N@H+](Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C[C@@H]1C2(F)F ZINC000590049574 479595234 /nfs/dbraw/zinc/59/52/34/479595234.db2.gz OAFVWCMEDIBBEU-LSDHHAIUSA-N 1 1 340.326 2.843 10 5 EFBEMO C[C@@]12CC[N@@H+](Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C[C@@H]1C2(F)F ZINC000590049574 479595242 /nfs/dbraw/zinc/59/52/42/479595242.db2.gz OAFVWCMEDIBBEU-LSDHHAIUSA-N 1 1 340.326 2.843 10 5 EFBEMO C[N@H+]1C[C@@H]2CCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)[C@@H]2C1 ZINC000590052570 479596464 /nfs/dbraw/zinc/59/64/64/479596464.db2.gz DZTNHPSAXPJWKI-WMLDXEAASA-N 1 1 327.384 2.991 10 5 EFBEMO CN1C[C@@H]2CC[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)[C@@H]2C1 ZINC000590052570 479596470 /nfs/dbraw/zinc/59/64/70/479596470.db2.gz DZTNHPSAXPJWKI-WMLDXEAASA-N 1 1 327.384 2.991 10 5 EFBEMO CN1C[C@@H]2CC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)[C@@H]2C1 ZINC000590052570 479596474 /nfs/dbraw/zinc/59/64/74/479596474.db2.gz DZTNHPSAXPJWKI-WMLDXEAASA-N 1 1 327.384 2.991 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](Cn2ccnn2)C1 ZINC000597172754 479604896 /nfs/dbraw/zinc/60/48/96/479604896.db2.gz CCBPAYLHHATVRL-IDJPSDCMSA-N 1 1 327.388 2.612 10 5 EFBEMO CC(C)c1ccc(C[N@H+]2CC[C@H](Cn3ccnn3)C2)cc1[N+](=O)[O-] ZINC000597176236 479606279 /nfs/dbraw/zinc/60/62/79/479606279.db2.gz SRHBTCXOMCESFY-HNNXBMFYSA-N 1 1 329.404 2.832 10 5 EFBEMO CO[C@]1(CO)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000597186083 479611601 /nfs/dbraw/zinc/61/16/01/479611601.db2.gz BFIUHGSSGNZODE-GOSISDBHSA-N 1 1 346.383 2.828 10 5 EFBEMO CO[C@@]1(CO)CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000597187541 479612142 /nfs/dbraw/zinc/61/21/42/479612142.db2.gz NONXQCOTIKJOKA-SFHVURJKSA-N 1 1 346.383 2.828 10 5 EFBEMO CN1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCC1=O ZINC000597215153 479625080 /nfs/dbraw/zinc/62/50/80/479625080.db2.gz XSKCVSQPXRTRHN-UHFFFAOYSA-N 1 1 329.356 2.519 10 5 EFBEMO CN1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCC1=O ZINC000597215153 479625085 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1 1 330.837 2.938 10 5 EFBEMO CO[C@@H](C)C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C(C)C ZINC000740888321 1269155330 /nfs/dbraw/zinc/15/53/30/1269155330.db2.gz PPGVELWXTMFJBB-NSHDSACASA-N 1 1 343.811 2.932 10 5 EFBEMO CCC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](CC)C(=O)OCC ZINC001169234140 1272748350 /nfs/dbraw/zinc/74/83/50/1272748350.db2.gz QGNFSDOJTVNYLS-HOTGVXAUSA-N 1 1 338.404 2.682 10 5 EFBEMO CCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](CC)C(=O)OCC ZINC001169234140 1272748355 /nfs/dbraw/zinc/74/83/55/1272748355.db2.gz QGNFSDOJTVNYLS-HOTGVXAUSA-N 1 1 338.404 2.682 10 5 EFBEMO CCN(CC)C(=O)C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000746705869 1275851613 /nfs/dbraw/zinc/85/16/13/1275851613.db2.gz JKYBERAEFQLORE-UHFFFAOYSA-N 1 1 337.395 2.814 10 5 EFBEMO CC(=O)Nc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cn1 ZINC000788524413 1276220126 /nfs/dbraw/zinc/22/01/26/1276220126.db2.gz NCJRZIAMVRAAIF-UHFFFAOYSA-N 1 1 334.763 2.891 10 5 EFBEMO 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ZINC000844747025 1279216840 /nfs/dbraw/zinc/21/68/40/1279216840.db2.gz HFVZWDPVZSLZOU-HNNXBMFYSA-N 1 1 349.341 2.932 10 5 EFBEMO Cc1nn(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)c2ncc([N+](=O)[O-])cc12 ZINC000844750235 1279218276 /nfs/dbraw/zinc/21/82/76/1279218276.db2.gz IYJJGFKITFHJNR-AWEZNQCLSA-N 1 1 337.330 2.727 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@]3(CC3(F)F)C2)c2ncc([N+](=O)[O-])cc12 ZINC000844750235 1279218282 /nfs/dbraw/zinc/21/82/82/1279218282.db2.gz IYJJGFKITFHJNR-AWEZNQCLSA-N 1 1 337.330 2.727 10 5 EFBEMO Cc1ccsc1[C@@H](CO)[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792880793 1279233047 /nfs/dbraw/zinc/23/30/47/1279233047.db2.gz VXKCZHHAXICUPU-GFCCVEGCSA-N 1 1 337.357 2.696 10 5 EFBEMO C[C@@]12CC[N@H+](Cn3cnc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]1C2(F)F ZINC000793544492 1279739300 /nfs/dbraw/zinc/73/93/00/1279739300.db2.gz LJQIPVBSCXQHHE-DZGCQCFKSA-N 1 1 349.341 2.788 10 5 EFBEMO C[C@@]12CC[N@@H+](Cn3cnc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]1C2(F)F ZINC000793544492 1279739305 /nfs/dbraw/zinc/73/93/05/1279739305.db2.gz LJQIPVBSCXQHHE-DZGCQCFKSA-N 1 1 349.341 2.788 10 5 EFBEMO C[C@]12CC[N@H+](Cn3cnc(-c4ccc([N+](=O)[O-])cc4)n3)C[C@H]1C2(F)F ZINC000793532853 1279753435 /nfs/dbraw/zinc/75/34/35/1279753435.db2.gz RUJXPORMWOOEMA-HIFRSBDPSA-N 1 1 349.341 2.788 10 5 EFBEMO C[C@]12CC[N@@H+](Cn3cnc(-c4ccc([N+](=O)[O-])cc4)n3)C[C@H]1C2(F)F ZINC000793532853 1279753438 /nfs/dbraw/zinc/75/34/38/1279753438.db2.gz RUJXPORMWOOEMA-HIFRSBDPSA-N 1 1 349.341 2.788 10 5 EFBEMO COC[C@@H](C)C[N@@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000793613353 1279773512 /nfs/dbraw/zinc/77/35/12/1279773512.db2.gz MBDUXDZIPOMMCV-JTQLQIEISA-N 1 1 343.221 2.998 10 5 EFBEMO COC[C@@H](C)C[N@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000793613353 1279773521 /nfs/dbraw/zinc/77/35/21/1279773521.db2.gz MBDUXDZIPOMMCV-JTQLQIEISA-N 1 1 343.221 2.998 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@@]3(CC3(F)F)C1)OCCO2 ZINC000846108205 1280020470 /nfs/dbraw/zinc/02/04/70/1280020470.db2.gz NCTWGOISHVGSCW-OAHLLOKOSA-N 1 1 340.326 2.987 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@@]3(CC3(F)F)C1)OCCO2 ZINC000846108205 1280020478 /nfs/dbraw/zinc/02/04/78/1280020478.db2.gz NCTWGOISHVGSCW-OAHLLOKOSA-N 1 1 340.326 2.987 10 5 EFBEMO C[C@@H]([NH2+]C[C@H](O)COc1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020232 1287401526 /nfs/dbraw/zinc/40/15/26/1287401526.db2.gz FXVUZJHDARROLF-OLZOCXBDSA-N 1 1 334.347 2.824 10 5 EFBEMO C[C@H](NCCC[N@H+]1CCCO[C@@H](C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872065562 1287417777 /nfs/dbraw/zinc/41/77/77/1287417777.db2.gz DNRUMIXCJJTFDS-KBPBESRZSA-N 1 1 339.411 2.885 10 5 EFBEMO C[C@H]([NH2+][C@@H](CO)C[C@H](O)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872070647 1287419913 /nfs/dbraw/zinc/41/99/13/1287419913.db2.gz VTSVRWBOJWAOBX-WDMOLILDSA-N 1 1 328.384 2.543 10 5 EFBEMO C[C@H]([NH2+][C@@H]1COc2ccccc2[C@@H]1O)c1c(F)cccc1[N+](=O)[O-] ZINC000872074258 1287420191 /nfs/dbraw/zinc/42/01/91/1287420191.db2.gz ZTCAJOLVGNYGKP-GDKCJGSASA-N 1 1 332.331 2.879 10 5 EFBEMO Cc1ccnc([C@@H]2CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000846972655 1280639943 /nfs/dbraw/zinc/63/99/43/1280639943.db2.gz XLZHWWSTGZSPNT-CRAIPNDOSA-N 1 1 327.384 2.821 10 5 EFBEMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)/C=C(/C)c1ccc([N+](=O)[O-])cc1 ZINC000846988514 1280675810 /nfs/dbraw/zinc/67/58/10/1280675810.db2.gz MHVQWFVVXVZMKD-OBEJXRGXSA-N 1 1 331.416 2.941 10 5 EFBEMO Cc1nccnc1[C@H](C)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC001175925347 1287614819 /nfs/dbraw/zinc/61/48/19/1287614819.db2.gz JJYOBQMSPRUKDL-JTQLQIEISA-N 1 1 349.778 2.636 10 5 EFBEMO Cc1[nH+]ccn1CCOC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000810701759 1283538871 /nfs/dbraw/zinc/53/88/71/1283538871.db2.gz IXEIDMUQDMAWDV-UHFFFAOYSA-N 1 1 332.360 2.535 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000810761699 1283606457 /nfs/dbraw/zinc/60/64/57/1283606457.db2.gz POTDBEORCRJURM-MRXNPFEDSA-N 1 1 349.366 2.622 10 5 EFBEMO Cc1ccccc1[C@H](CO)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC001176177191 1287728694 /nfs/dbraw/zinc/72/86/94/1287728694.db2.gz UATIBJWJNDHDJR-SFHVURJKSA-N 1 1 330.384 2.947 10 5 EFBEMO CC(C)[N@@H+](Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)[C@H]1CCOC1 ZINC000812290915 1285027877 /nfs/dbraw/zinc/02/78/77/1285027877.db2.gz IQZAISPKAKQKHZ-KRWDZBQOSA-N 1 1 330.388 2.915 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)N2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000813012341 1285609885 /nfs/dbraw/zinc/60/98/85/1285609885.db2.gz HYRJABYPKYALOC-QGZVFWFLSA-N 1 1 335.379 2.696 10 5 EFBEMO O=C(C[C@H]1CCCOC1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172078 1285701831 /nfs/dbraw/zinc/70/18/31/1285701831.db2.gz FUXVWAOLTRCDNU-WBVHZDCISA-N 1 1 348.399 2.529 10 5 EFBEMO O=C(C[C@H]1CCCOC1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172078 1285701838 /nfs/dbraw/zinc/70/18/38/1285701838.db2.gz FUXVWAOLTRCDNU-WBVHZDCISA-N 1 1 348.399 2.529 10 5 EFBEMO C[C@@H](C[N+](=O)[O-])OC(=O)[C@H](C)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000814049539 1286277660 /nfs/dbraw/zinc/27/76/60/1286277660.db2.gz SICLYUGTCYCDQB-GJZGRUSLSA-N 1 1 334.416 2.538 10 5 EFBEMO O=[N+]([O-])CC[N@H+]1CCC[C@H]1COc1ccc(Br)cc1 ZINC001176641533 1288054565 /nfs/dbraw/zinc/05/45/65/1288054565.db2.gz RCUUPTBNLRTDHW-LBPRGKRZSA-N 1 1 329.194 2.569 10 5 EFBEMO CC(C)[C@@H]1C[C@@H](N2CCCC2)C[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001176887185 1288162555 /nfs/dbraw/zinc/16/25/55/1288162555.db2.gz PGFOPJIELKVBKW-CEXWTWQISA-N 1 1 347.459 2.823 10 5 EFBEMO CC(C)[C@@H]1C[C@@H](N2CCCC2)C[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001176887185 1288162559 /nfs/dbraw/zinc/16/25/59/1288162559.db2.gz PGFOPJIELKVBKW-CEXWTWQISA-N 1 1 347.459 2.823 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCC[N@H+](C(C)C)C1 ZINC001136453155 1288737356 /nfs/dbraw/zinc/73/73/56/1288737356.db2.gz VYJCTXGSUMCAOE-CQSZACIVSA-N 1 1 349.431 2.844 10 5 EFBEMO CC[N@H+]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C(C)(C)C1 ZINC001178860582 1288967860 /nfs/dbraw/zinc/96/78/60/1288967860.db2.gz FTMQGCVKUPYZHT-MRXNPFEDSA-N 1 1 349.431 2.842 10 5 EFBEMO C[C@@H]1CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC001136772419 1289425051 /nfs/dbraw/zinc/42/50/51/1289425051.db2.gz BEEJLBVQCGRMAS-SNVBAGLBSA-N 1 1 343.836 2.503 10 5 EFBEMO C[C@@H]1CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC001136772419 1289425055 /nfs/dbraw/zinc/42/50/55/1289425055.db2.gz BEEJLBVQCGRMAS-SNVBAGLBSA-N 1 1 343.836 2.503 10 5 EFBEMO Cn1cc[nH+]c1[C@@H]1CCCN(c2nc3c(cc2[N+](=O)[O-])CCCC3)C1 ZINC000826010332 1291478186 /nfs/dbraw/zinc/47/81/86/1291478186.db2.gz NUGXHAZBOKELSM-CQSZACIVSA-N 1 1 341.415 2.986 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H]1CCC3(CCOCC3)O1)C2 ZINC000878303263 1291613829 /nfs/dbraw/zinc/61/38/29/1291613829.db2.gz LRQMCDQTALDMME-HNNXBMFYSA-N 1 1 332.400 2.681 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1CCC3(CCOCC3)O1)C2 ZINC000878303263 1291613838 /nfs/dbraw/zinc/61/38/38/1291613838.db2.gz LRQMCDQTALDMME-HNNXBMFYSA-N 1 1 332.400 2.681 10 5 EFBEMO Cc1ccc(COC(=O)c2cnn(-c3cc[nH+]cc3)c2)cc1[N+](=O)[O-] ZINC001273602351 1292184067 /nfs/dbraw/zinc/18/40/67/1292184067.db2.gz ZSBSVYCQAATKCE-UHFFFAOYSA-N 1 1 338.323 2.841 10 5 EFBEMO C[N@H+]1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H]1C(C)(C)C ZINC000880611955 1292558010 /nfs/dbraw/zinc/55/80/10/1292558010.db2.gz BIWZIVLMEWQODA-MRXNPFEDSA-N 1 1 344.415 2.878 10 5 EFBEMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCC[C@@]2(CCOC2)O1 ZINC001194262295 1293574269 /nfs/dbraw/zinc/57/42/69/1293574269.db2.gz MAMPPSNECPOAPR-AEFFLSMTSA-N 1 1 334.416 2.797 10 5 EFBEMO CC(=O)c1ccc2c(c1)CC[N@@H+](Cc1cccnc1[N+](=O)[O-])CC2 ZINC000886087593 1294667778 /nfs/dbraw/zinc/66/77/78/1294667778.db2.gz WYXPMHLLKBYSEH-UHFFFAOYSA-N 1 1 325.368 2.793 10 5 EFBEMO CC(=O)c1ccc2c(c1)CC[N@H+](Cc1cccnc1[N+](=O)[O-])CC2 ZINC000886087593 1294667789 /nfs/dbraw/zinc/66/77/89/1294667789.db2.gz WYXPMHLLKBYSEH-UHFFFAOYSA-N 1 1 325.368 2.793 10 5 EFBEMO COc1cc(CN2CC[N@@H+](C)C[C@H]2CC(C)C)c([N+](=O)[O-])cc1F ZINC001198084042 1294869036 /nfs/dbraw/zinc/86/90/36/1294869036.db2.gz FJJNVTDRORCVOM-CQSZACIVSA-N 1 1 339.411 2.905 10 5 EFBEMO C[N@H+]1CCCC[C@H]1CCC(=O)OCCOc1cccc([N+](=O)[O-])c1 ZINC000803859370 1313265173 /nfs/dbraw/zinc/26/51/73/1313265173.db2.gz ZNQDDFNBHXSFAR-AWEZNQCLSA-N 1 1 336.388 2.781 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCc3nc[nH]c3C23CCC3)c1 ZINC000931679518 1297361864 /nfs/dbraw/zinc/36/18/64/1297361864.db2.gz RRCBFXJGKYHZNY-UHFFFAOYSA-N 1 1 328.372 2.634 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCc3nc[nH]c3C23CCC3)c1 ZINC000931679518 1297361876 /nfs/dbraw/zinc/36/18/76/1297361876.db2.gz RRCBFXJGKYHZNY-UHFFFAOYSA-N 1 1 328.372 2.634 10 5 EFBEMO Cc1ccoc1CC(=O)NCCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001490246336 1298674117 /nfs/dbraw/zinc/67/41/17/1298674117.db2.gz KJFHVVNDKTYUGL-UHFFFAOYSA-N 1 1 345.399 2.677 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1ccn(C)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC001490324443 1298768832 /nfs/dbraw/zinc/76/88/32/1298768832.db2.gz XPJLGOQKGZKULH-UHFFFAOYSA-N 1 1 344.415 2.575 10 5 EFBEMO C[C@H](NC(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000852358830 1299673701 /nfs/dbraw/zinc/67/37/01/1299673701.db2.gz DLTOFWPGQZIVPO-WFASDCNBSA-N 1 1 334.420 2.828 10 5 EFBEMO C[C@@]12COC[C@]1(C)C[N@H+](Cn1cc(-c3ccccc3[N+](=O)[O-])cn1)C2 ZINC000853542001 1300156860 /nfs/dbraw/zinc/15/68/60/1300156860.db2.gz KOWLOQLQVVPKIE-HDICACEKSA-N 1 1 342.399 2.774 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNc1ccc([N+](=O)[O-])cc1N1CCOC1=O ZINC000853748269 1300257003 /nfs/dbraw/zinc/25/70/03/1300257003.db2.gz KRTUIXORDDNXOZ-CYBMUJFWSA-N 1 1 348.403 2.836 10 5 EFBEMO CCN(C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](CC)C1 ZINC000854097235 1300426519 /nfs/dbraw/zinc/42/65/19/1300426519.db2.gz FZTFHZLMTPLGQH-XJKSGUPXSA-N 1 1 334.420 2.782 10 5 EFBEMO C[C@H]([NH2+][C@@H]1CNCC[C@@H]1c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000854222982 1300476228 /nfs/dbraw/zinc/47/62/28/1300476228.db2.gz PZYIUNGRPMFAOF-FDQGKXFDSA-N 1 1 340.427 2.973 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC000854735836 1300681922 /nfs/dbraw/zinc/68/19/22/1300681922.db2.gz YBPRCHNHWKQFIA-RYBIEJRYSA-N 1 1 343.427 2.942 10 5 EFBEMO C/C(=C/C(=O)N[C@H]1CC[N@H+](C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000855286255 1300890711 /nfs/dbraw/zinc/89/07/11/1300890711.db2.gz NPENUJJIOGUECD-HVCHUGMYSA-N 1 1 331.416 2.987 10 5 EFBEMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000859284792 1301418563 /nfs/dbraw/zinc/41/85/63/1301418563.db2.gz PSCDHBCTRVFUCH-HNNXBMFYSA-N 1 1 339.395 2.962 10 5 EFBEMO Cc1cc([N+](=O)[O-])c(C(=O)N2CC[NH+](CCCF)CC2)cc1Cl ZINC000862114344 1302288147 /nfs/dbraw/zinc/28/81/47/1302288147.db2.gz GQBSTYFXEUMEEJ-UHFFFAOYSA-N 1 1 343.786 2.674 10 5 EFBEMO C/C(=C\C(=O)NC[C@H]1CCCC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000862793580 1302462132 /nfs/dbraw/zinc/46/21/32/1302462132.db2.gz QCLJDNHUPZYXCT-ATGUSINASA-N 1 1 331.416 2.846 10 5 EFBEMO C[N@H+](CCc1ccc(F)cc1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21 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GYRYZWXDNLKYNF-BXKDBHETSA-N 1 1 330.310 2.539 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(c3ccc([N+](=O)[O-])cc3OC(F)F)CC[C@H]21 ZINC000866208857 1303563642 /nfs/dbraw/zinc/56/36/42/1303563642.db2.gz OZBHALXOJMAWPP-ZYHUDNBSSA-N 1 1 327.331 2.727 10 5 EFBEMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1 ZINC000866209562 1303563815 /nfs/dbraw/zinc/56/38/15/1303563815.db2.gz UBWAWXHKRVUOJH-BLLLJJGKSA-N 1 1 342.399 2.682 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3ccc([N+](=O)[O-])cc3OC(F)F)CC[C@@H]21 ZINC000866208855 1303563991 /nfs/dbraw/zinc/56/39/91/1303563991.db2.gz OZBHALXOJMAWPP-JQWIXIFHSA-N 1 1 327.331 2.727 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(c3cccc(Br)c3[N+](=O)[O-])CC[C@@H]21 ZINC000866210227 1303565246 /nfs/dbraw/zinc/56/52/46/1303565246.db2.gz ZSVOFJOGVKIEDP-PWSUYJOCSA-N 1 1 340.221 2.888 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3cccc(Br)c3[N+](=O)[O-])CC[C@@H]21 ZINC000866210226 1303565289 /nfs/dbraw/zinc/56/52/89/1303565289.db2.gz ZSVOFJOGVKIEDP-JQWIXIFHSA-N 1 1 340.221 2.888 10 5 EFBEMO C[C@H]([NH2+]Cc1nn(C)cc1C(F)F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866567359 1303690131 /nfs/dbraw/zinc/69/01/31/1303690131.db2.gz KNEWCCRZVWAECY-QMMMGPOBSA-N 1 1 325.319 2.699 10 5 EFBEMO C[N@@H+]1Cc2ccccc2[C@H]1CNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000868061605 1304102436 /nfs/dbraw/zinc/10/24/36/1304102436.db2.gz GPKBPDMSPYZHQE-QGZVFWFLSA-N 1 1 340.383 2.581 10 5 EFBEMO C[N@H+]1Cc2ccccc2[C@H]1CNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000868061605 1304102440 /nfs/dbraw/zinc/10/24/40/1304102440.db2.gz GPKBPDMSPYZHQE-QGZVFWFLSA-N 1 1 340.383 2.581 10 5 EFBEMO C[N@@H+]1Cc2ccccc2[C@@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000868160980 1304162308 /nfs/dbraw/zinc/16/23/08/1304162308.db2.gz NJXNUZCUEGHGKX-KRWDZBQOSA-N 1 1 340.383 2.581 10 5 EFBEMO C[N@H+]1Cc2ccccc2[C@@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000868160980 1304162312 /nfs/dbraw/zinc/16/23/12/1304162312.db2.gz NJXNUZCUEGHGKX-KRWDZBQOSA-N 1 1 340.383 2.581 10 5 EFBEMO Cc1ccc(CNC(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000868812469 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VADMHSYKYKSSOZ-GFCCVEGCSA-N 1 1 337.395 2.780 10 5 EFBEMO C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Cl)CCC1(C)C ZINC000871158091 1305853871 /nfs/dbraw/zinc/85/38/71/1305853871.db2.gz NMDWDLUEOWPRJM-UHFFFAOYSA-N 1 1 325.796 2.805 10 5 EFBEMO CC(C)(C)OC(=O)N1CC(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)C1 ZINC000800364128 1307755362 /nfs/dbraw/zinc/75/53/62/1307755362.db2.gz CLPYONCETHKCLO-UHFFFAOYSA-N 1 1 347.415 2.820 10 5 EFBEMO CC(C)(C)OC(=O)N1CC(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)C1 ZINC000800364128 1307755364 /nfs/dbraw/zinc/75/53/64/1307755364.db2.gz CLPYONCETHKCLO-UHFFFAOYSA-N 1 1 347.415 2.820 10 5 EFBEMO CC[N@H+]1CCC[C@H](CNc2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])C1 ZINC000749441693 1311029427 /nfs/dbraw/zinc/02/94/27/1311029427.db2.gz GZKIGGOFHHDTJI-LOWQCSRCSA-N 1 1 347.415 2.925 10 5 EFBEMO C/C(=C/C(=O)N(C)C[C@H]1CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000752388336 1311154339 /nfs/dbraw/zinc/15/43/39/1311154339.db2.gz FSORGPCSDDZIOD-SZGZABIGSA-N 1 1 331.416 2.798 10 5 EFBEMO Cc1c(CNC(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC001226216874 1311632236 /nfs/dbraw/zinc/63/22/36/1311632236.db2.gz MAIDJCQWOLEYEI-INIZCTEOSA-N 1 1 348.447 2.775 10 5 EFBEMO CC1(C)CCC[N@H+]1CCNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC001163481271 1312321937 /nfs/dbraw/zinc/32/19/37/1312321937.db2.gz YXGQXDXEWRTQQT-UHFFFAOYSA-N 1 1 346.431 2.773 10 5 EFBEMO Cc1cc(F)cc(C(=O)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC001163929329 1312409322 /nfs/dbraw/zinc/40/93/22/1312409322.db2.gz JLFWTAZKCXXGBD-AWEZNQCLSA-N 1 1 337.395 2.845 10 5 EFBEMO Cc1cc(F)cc(C(=O)N2CC[N@H+](C)[C@H](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC001163929329 1312409324 /nfs/dbraw/zinc/40/93/24/1312409324.db2.gz JLFWTAZKCXXGBD-AWEZNQCLSA-N 1 1 337.395 2.845 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C)[C@@H](C(C)(C)C)C1 ZINC001163928600 1312409394 /nfs/dbraw/zinc/40/93/94/1312409394.db2.gz FDRMBLRPJLTIOI-OAHLLOKOSA-N 1 1 349.431 2.796 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)[C@@H](C(C)(C)C)C1 ZINC001163928600 1312409395 /nfs/dbraw/zinc/40/93/95/1312409395.db2.gz FDRMBLRPJLTIOI-OAHLLOKOSA-N 1 1 349.431 2.796 10 5 EFBEMO O=[N+]([O-])c1cnc2ccccc2c1N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC001164124941 1312452348 /nfs/dbraw/zinc/45/23/48/1312452348.db2.gz ROYGLUDNUGPGIP-GOEBONIOSA-N 1 1 344.440 2.557 10 5 EFBEMO C[C@@H]1C[NH+](Cc2c(Br)cccc2[N+](=O)[O-])C[C@@H](C)C1O ZINC000827151640 1315601774 /nfs/dbraw/zinc/60/17/74/1315601774.db2.gz HHUVXZNUYSAUDY-NXEZZACHSA-N 1 1 343.221 2.806 10 5 EFBEMO C[C@H]1C[NH+](Cc2c(Br)cccc2[N+](=O)[O-])C[C@H](C)C1O ZINC000827151641 1315602080 /nfs/dbraw/zinc/60/20/80/1315602080.db2.gz HHUVXZNUYSAUDY-UWVGGRQHSA-N 1 1 343.221 2.806 10 5 EFBEMO CC1(C(=O)N2CC3(C2)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C3)CCC1 ZINC001253538645 1315613520 /nfs/dbraw/zinc/61/35/20/1315613520.db2.gz JHHYOMIBGAMXNI-UHFFFAOYSA-N 1 1 343.427 2.819 10 5 EFBEMO Cc1ccc(NCCNC(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)[nH+]c1 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EFBEMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001307632499 1324774570 /nfs/dbraw/zinc/77/45/70/1324774570.db2.gz XFJYROFNNYSUKW-WDEREUQCSA-N 1 1 342.237 2.882 10 5 EFBEMO COc1ccc(OCC[N@H+]2C[C@H]3CSC[C@@]3(C)C2)c([N+](=O)[O-])c1 ZINC001308135025 1324795938 /nfs/dbraw/zinc/79/59/38/1324795938.db2.gz VMAMRQWAHQMQFE-BLLLJJGKSA-N 1 1 338.429 2.667 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H]2CSC[C@@]2(C)C1 ZINC001308134203 1324796130 /nfs/dbraw/zinc/79/61/30/1324796130.db2.gz OCVWNLAJSLYIKO-BLLLJJGKSA-N 1 1 335.429 2.527 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H]2CSC[C@@]2(C)C1 ZINC001308134203 1324796131 /nfs/dbraw/zinc/79/61/31/1324796131.db2.gz OCVWNLAJSLYIKO-BLLLJJGKSA-N 1 1 335.429 2.527 10 5 EFBEMO CCC[N@H+](CCNC(=O)C(C)(C)F)Cc1ccccc1[N+](=O)[O-] ZINC001317538394 1325006145 /nfs/dbraw/zinc/00/61/45/1325006145.db2.gz HLYHBRASSMRJIO-UHFFFAOYSA-N 1 1 325.384 2.671 10 5 EFBEMO CCC[N@@H+](CCNC(=O)C(C)(C)F)Cc1ccccc1[N+](=O)[O-] ZINC001317538394 1325006149 /nfs/dbraw/zinc/00/61/49/1325006149.db2.gz HLYHBRASSMRJIO-UHFFFAOYSA-N 1 1 325.384 2.671 10 5 EFBEMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-] ZINC001313354290 1325013606 /nfs/dbraw/zinc/01/36/06/1325013606.db2.gz YNEIZORMYGGCEO-GJZGRUSLSA-N 1 1 348.447 2.824 10 5 EFBEMO C[N@@H+](CCCNC(=O)C1(C(F)F)CC1)Cc1cccc([N+](=O)[O-])c1 ZINC001316824124 1325086813 /nfs/dbraw/zinc/08/68/13/1325086813.db2.gz FVPYUQOPZZAUKW-UHFFFAOYSA-N 1 1 341.358 2.578 10 5 EFBEMO Cc1cc(C)c(C(=O)NC/C=C/C[NH2+]Cc2csc([N+](=O)[O-])c2)[nH]1 ZINC001321120001 1329345428 /nfs/dbraw/zinc/34/54/28/1329345428.db2.gz DCCOCMASJRKGIS-ONEGZZNKSA-N 1 1 348.428 2.677 10 5 EFBEMO CCC(C)(C)CC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21 ZINC001317211851 1327753920 /nfs/dbraw/zinc/75/39/20/1327753920.db2.gz HFRSSZGOIRYHCD-VQFNDLOPSA-N 1 1 345.443 2.968 10 5 EFBEMO C[N@H+](CCNC(=O)c1cccc(F)c1)Cc1cccc([N+](=O)[O-])c1 ZINC001317438114 1328026822 /nfs/dbraw/zinc/02/68/22/1328026822.db2.gz 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CCCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CCCCCC1 ZINC001323709054 1329563919 /nfs/dbraw/zinc/56/39/19/1329563919.db2.gz TVNLBCZTPKQEBN-HZPDHXFCSA-N 1 1 325.453 2.593 10 5 EFBEMO CCCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CCCCCC1 ZINC001323709054 1329563920 /nfs/dbraw/zinc/56/39/20/1329563920.db2.gz TVNLBCZTPKQEBN-HZPDHXFCSA-N 1 1 325.453 2.593 10 5 EFBEMO CC(C)(C)CCC[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001326512453 1330307662 /nfs/dbraw/zinc/30/76/62/1330307662.db2.gz GQJYGRHJQVNLQJ-KLHDSHLOSA-N 1 1 339.480 2.743 10 5 EFBEMO CC[N@H+]1CCC[C@H](CNc2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)C1 ZINC001327643022 1330503619 /nfs/dbraw/zinc/50/36/19/1330503619.db2.gz OAMNHWTXZJFMBC-CYBMUJFWSA-N 1 1 335.404 2.834 10 5 EFBEMO Cc1noc(C[NH2+][C@@H]2CCN(C)[C@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001328410766 1330590026 /nfs/dbraw/zinc/59/00/26/1330590026.db2.gz VHQOUELKTKIVMZ-CJNGLKHVSA-N 1 1 334.351 2.565 10 5 EFBEMO CC/C=C/CC[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC001328503355 1330598119 /nfs/dbraw/zinc/59/81/19/1330598119.db2.gz JWONULZQVXLQGX-MULDZMIYSA-N 1 1 349.475 2.713 10 5 EFBEMO Cc1cccc(C[NH2+]CC2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)c1 ZINC001329818603 1330739829 /nfs/dbraw/zinc/73/98/29/1330739829.db2.gz LYJZDNHBCVIRLD-IAGOWNOFSA-N 1 1 345.443 2.569 10 5 EFBEMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001332484141 1330976991 /nfs/dbraw/zinc/97/69/91/1330976991.db2.gz IVTLKYKAUJTNAI-OAHLLOKOSA-N 1 1 343.358 2.829 10 5 EFBEMO CC(C)(C)C(=O)NCC1=CC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001333432507 1331141667 /nfs/dbraw/zinc/14/16/67/1331141667.db2.gz AMIPTHGIDQPZDJ-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO CC(C)(C)C(=O)NCC1=CC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001333432507 1331141669 /nfs/dbraw/zinc/14/16/69/1331141669.db2.gz AMIPTHGIDQPZDJ-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001340992769 1332225705 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EFBEMO CC[C@@H]1[C@H](C)CC[N@H+]1CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848483894 1334740835 /nfs/dbraw/zinc/74/08/35/1334740835.db2.gz AWRBDYOZZYYZMW-XOKHGSTOSA-N 1 1 331.416 2.989 10 5 EFBEMO C[C@H]1CSCC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848485844 1334742271 /nfs/dbraw/zinc/74/22/71/1334742271.db2.gz YTLWWNNWBFKUKL-CZUORRHYSA-N 1 1 349.456 2.553 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CC[C@@]3(C2)CCCOC3)c1 ZINC000848487430 1334742979 /nfs/dbraw/zinc/74/29/79/1334742979.db2.gz RYBKUEAYRUDKJP-GOSISDBHSA-N 1 1 342.399 2.918 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CC[C@]3(C2)CCCOC3)c1 ZINC000848487432 1334743254 /nfs/dbraw/zinc/74/32/54/1334743254.db2.gz RYBKUEAYRUDKJP-SFHVURJKSA-N 1 1 342.399 2.918 10 5 EFBEMO CC1=C[C@@H](C)C[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848487823 1334744628 /nfs/dbraw/zinc/74/46/28/1334744628.db2.gz XRYFRAFCUJJEGQ-CXAGYDPISA-N 1 1 329.400 2.766 10 5 EFBEMO CC1=C[C@@H](C)C[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848487823 1334744631 /nfs/dbraw/zinc/74/46/31/1334744631.db2.gz XRYFRAFCUJJEGQ-CXAGYDPISA-N 1 1 329.400 2.766 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC[N@H+]1CCC(C)(C)C1 ZINC001440030859 1389382528 /nfs/dbraw/zinc/38/25/28/1389382528.db2.gz BIWUTKSLGPZHHZ-UHFFFAOYSA-N 1 1 333.432 2.982 10 5 EFBEMO CC[N@@H+](C)[C@H]1CCN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC001457408262 1395100064 /nfs/dbraw/zinc/10/00/64/1395100064.db2.gz CKFUZPZLIBYBKR-JSGCOSHPSA-N 1 1 337.445 2.628 10 5 EFBEMO CC[N@@H+](C)[C@H]1CCN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC001457408267 1395100552 /nfs/dbraw/zinc/10/05/52/1395100552.db2.gz CKFUZPZLIBYBKR-OCCSQVGLSA-N 1 1 337.445 2.628 10 5 EFBEMO C[C@H]1CCC[N@@H+](CCCCNc2c(Cl)cncc2[N+](=O)[O-])C1 ZINC001458114414 1395409739 /nfs/dbraw/zinc/40/97/39/1395409739.db2.gz SYHUGWQFCBWPJS-LBPRGKRZSA-N 1 1 326.828 2.989 10 5 EFBEMO CC(C)[N@H+]1CCCC[C@@H]1Cn1nnc(-c2ccccc2[N+](=O)[O-])n1 ZINC001459282514 1395786099 /nfs/dbraw/zinc/78/60/99/1395786099.db2.gz KPXWJVCQRHGTNH-CYBMUJFWSA-N 1 1 330.392 2.511 10 5 EFBEMO COCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])Cc1ccc(C)c(C)c1 ZINC001460783425 1396256520 /nfs/dbraw/zinc/25/65/20/1396256520.db2.gz AIJRYEITZGEPDW-UHFFFAOYSA-N 1 1 346.431 2.865 10 5 EFBEMO Cc1cccnc1[C@@H](C)[NH2+][C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001460929968 1396270058 /nfs/dbraw/zinc/27/00/58/1396270058.db2.gz DJEOHNQEUDEXSX-CHWSQXEVSA-N 1 1 328.372 2.976 10 5 EFBEMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC001466060560 1396735199 /nfs/dbraw/zinc/73/51/99/1396735199.db2.gz HQDLPENMPCEMCD-GFCCVEGCSA-N 1 1 339.823 2.956 10 5 EFBEMO COC(=O)[C@]12C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C[C@H]1CCCC2 ZINC001473592448 1397313089 /nfs/dbraw/zinc/31/30/89/1397313089.db2.gz ORIIRYWSPVQEFZ-RDTXWAMCSA-N 1 1 348.399 2.639 10 5 EFBEMO Nc1nnc([C@H]2CCC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)o1 ZINC001473681955 1397320438 /nfs/dbraw/zinc/32/04/38/1397320438.db2.gz QNZGCKSSBBQNOA-JTQLQIEISA-N 1 1 337.767 2.593 10 5 EFBEMO Nc1nnc([C@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)o1 ZINC001473681955 1397320443 /nfs/dbraw/zinc/32/04/43/1397320443.db2.gz QNZGCKSSBBQNOA-JTQLQIEISA-N 1 1 337.767 2.593 10 5 EFBEMO C[C@@](CO)([NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 ZINC001473713651 1397324545 /nfs/dbraw/zinc/32/45/45/1397324545.db2.gz CVCWPXHPMLQGPL-INIZCTEOSA-N 1 1 331.328 2.500 10 5 EFBEMO C[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cc2cnccc2o1 ZINC001473743069 1397327633 /nfs/dbraw/zinc/32/76/33/1397327633.db2.gz CSEWGARWMVGMBE-JTQLQIEISA-N 1 1 340.339 2.686 10 5 EFBEMO Cc1cccn2c(=O)cc(C[NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)nc12 ZINC001473782785 1397330526 /nfs/dbraw/zinc/33/05/26/1397330526.db2.gz BQZYVJYOZWAQNK-CYBMUJFWSA-N 1 1 338.367 2.762 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H]2CSC[C@@]2(C)C1 ZINC001473861516 1397340786 /nfs/dbraw/zinc/34/07/86/1397340786.db2.gz AHACOENMKRSSMZ-BLLLJJGKSA-N 1 1 335.429 2.527 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H]2CSC[C@@]2(C)C1 ZINC001473861516 1397340790 /nfs/dbraw/zinc/34/07/90/1397340790.db2.gz AHACOENMKRSSMZ-BLLLJJGKSA-N 1 1 335.429 2.527 10 5 EFBEMO CC1(C)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC001473862031 1397341042 /nfs/dbraw/zinc/34/10/42/1397341042.db2.gz BEZDPXZRPKHFPT-QLFBSQMISA-N 1 1 334.416 2.845 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1[nH]ccc1C)Cc1cccc([N+](=O)[O-])c1 ZINC001479841821 1397940427 /nfs/dbraw/zinc/94/04/27/1397940427.db2.gz IIILUDGRSMATBF-UHFFFAOYSA-N 1 1 344.415 2.873 10 5 EFBEMO Cc1cc[nH]c1C(=O)NCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001493365416 1398644847 /nfs/dbraw/zinc/64/48/47/1398644847.db2.gz HYLOHNDHFDRBLY-UHFFFAOYSA-N 1 1 342.399 2.626 10 5 EFBEMO Cc1cocc1C(=O)NCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001493402840 1398678459 /nfs/dbraw/zinc/67/84/59/1398678459.db2.gz VYLSMDDYUGAFEH-UHFFFAOYSA-N 1 1 343.383 2.891 10 5 EFBEMO Cc1cocc1C(=O)NCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001493402840 1398678462 /nfs/dbraw/zinc/67/84/62/1398678462.db2.gz VYLSMDDYUGAFEH-UHFFFAOYSA-N 1 1 343.383 2.891 10 5 EFBEMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CCCCCC1 ZINC001493859255 1398930533 /nfs/dbraw/zinc/93/05/33/1398930533.db2.gz OSQHBDQYKWOHDF-IAGOWNOFSA-N 1 1 339.480 2.839 10 5 EFBEMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCCCCC1 ZINC001493859255 1398930536 /nfs/dbraw/zinc/93/05/36/1398930536.db2.gz OSQHBDQYKWOHDF-IAGOWNOFSA-N 1 1 339.480 2.839 10 5 EFBEMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCCCCC1 ZINC001493859255 1398930538 /nfs/dbraw/zinc/93/05/38/1398930538.db2.gz OSQHBDQYKWOHDF-IAGOWNOFSA-N 1 1 339.480 2.839 10 5 EFBEMO CN(CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)C(C1CC1)C1CC1 ZINC001496818962 1401007225 /nfs/dbraw/zinc/00/72/25/1401007225.db2.gz OCFIBOOXSOIGFI-UHFFFAOYSA-N 1 1 345.443 2.921 10 5 EFBEMO CN(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)C(C1CC1)C1CC1 ZINC001496818962 1401007232 /nfs/dbraw/zinc/00/72/32/1401007232.db2.gz OCFIBOOXSOIGFI-UHFFFAOYSA-N 1 1 345.443 2.921 10 5 EFBEMO O=C(/C=C\c1ccco1)NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001497520077 1401433268 /nfs/dbraw/zinc/43/32/68/1401433268.db2.gz ZRIAFIUDHQGNOX-YMPRJYOMSA-N 1 1 347.396 2.725 10 5 EFBEMO CC(C)c1ccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCC2)cc1 ZINC001501950142 1403899838 /nfs/dbraw/zinc/89/98/38/1403899838.db2.gz FQGBUSDBBSYMCC-IAGOWNOFSA-N 1 1 345.443 2.604 10 5 EFBEMO CCC[C@@H]1CN(c2nn(C)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC001559150660 1415226829 /nfs/dbraw/zinc/22/68/29/1415226829.db2.gz FVGYRFXLSKGQHA-MRXNPFEDSA-N 1 1 343.431 2.819 10 5 EFBEMO COc1cc(N2C[C@@H]3C[N@H+](C)CC[C@@H]3C2)c(Cl)cc1[N+](=O)[O-] ZINC001559227412 1415231467 /nfs/dbraw/zinc/23/14/67/1415231467.db2.gz OZOGDRJWLIYEMK-MNOVXSKESA-N 1 1 325.796 2.645 10 5 EFBEMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001559556774 1415250453 /nfs/dbraw/zinc/25/04/53/1415250453.db2.gz JBNNJIVUMIELMO-LSDHHAIUSA-N 1 1 346.387 2.770 10 5 EFBEMO C[C@](O)(C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(F)cc1 ZINC001559595148 1415251599 /nfs/dbraw/zinc/25/15/99/1415251599.db2.gz ZONRCJZNHUIHOJ-SFHVURJKSA-N 1 1 330.359 3.000 10 5 EFBEMO COC(=O)CC[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC001560116699 1415263671 /nfs/dbraw/zinc/26/36/71/1415263671.db2.gz GXXGXMLKLDAXNA-GFCCVEGCSA-N 1 1 346.387 2.636 10 5 EFBEMO COC(=O)CC[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC001560116699 1415263679 /nfs/dbraw/zinc/26/36/79/1415263679.db2.gz GXXGXMLKLDAXNA-GFCCVEGCSA-N 1 1 346.387 2.636 10 5 EFBEMO Cc1nccnc1[C@H](C)[NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC001560124252 1415265072 /nfs/dbraw/zinc/26/50/72/1415265072.db2.gz RFTLONQUAZZTBW-QWHCGFSZSA-N 1 1 343.387 2.679 10 5 EFBEMO Cc1cccnc1[C@@H](C)[NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001560221486 1415268583 /nfs/dbraw/zinc/26/85/83/1415268583.db2.gz XFVMPHCFVRWVAK-CHWSQXEVSA-N 1 1 328.372 2.976 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@]1(CO)c1ccccc1 ZINC001560231482 1415269919 /nfs/dbraw/zinc/26/99/19/1415269919.db2.gz UTMNUCKXFLGXQI-LJQANCHMSA-N 1 1 342.395 2.957 10 5 EFBEMO CC[C@@H](NC(=O)NC[C@@H]1CCCC[N@H+]1C)c1cccc([N+](=O)[O-])c1 ZINC001564376602 1415376183 /nfs/dbraw/zinc/37/61/83/1415376183.db2.gz OHYQCDOWORCCHT-JKSUJKDBSA-N 1 1 334.420 2.829 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC001566091211 1415511440 /nfs/dbraw/zinc/51/14/40/1415511440.db2.gz JLKAOKFIHGIJQX-AWEZNQCLSA-N 1 1 349.431 2.940 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC001566091212 1415511974 /nfs/dbraw/zinc/51/19/74/1415511974.db2.gz JLKAOKFIHGIJQX-CQSZACIVSA-N 1 1 349.431 2.940 10 5 EFBEMO C[C@@H]1C[C@H](NC(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC001566167056 1415532994 /nfs/dbraw/zinc/53/29/94/1415532994.db2.gz UBPOVRKLGUPGTM-DGCLKSJQSA-N 1 1 342.399 2.543 10 5 EFBEMO C[C@@H]1C[C@@H](NC(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC001566167058 1415533259 /nfs/dbraw/zinc/53/32/59/1415533259.db2.gz UBPOVRKLGUPGTM-YPMHNXCESA-N 1 1 342.399 2.543 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1ccncc1)Cc1cccc([N+](=O)[O-])c1 ZINC001566538302 1415625383 /nfs/dbraw/zinc/62/53/83/1415625383.db2.gz WRPQMZLJRKLXMU-UHFFFAOYSA-N 1 1 342.399 2.632 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1cc(C)no1)Cc1cccc([N+](=O)[O-])c1 ZINC001566540221 1415626864 /nfs/dbraw/zinc/62/68/64/1415626864.db2.gz CVMLAYOAQPWNTQ-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO C=C/C(C)=C/CC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21 ZINC001566974978 1415884453 /nfs/dbraw/zinc/88/44/53/1415884453.db2.gz BFDOILZEWJKHSY-VZUUALJRSA-N 1 1 341.411 2.664 10 5 EFBEMO CC(C)(C)CC[NH2+]CCc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001567181974 1415975218 /nfs/dbraw/zinc/97/52/18/1415975218.db2.gz WEMBNLYGKZLZNC-IAGOWNOFSA-N 1 1 347.459 2.536 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccccc1F)Cc1ccc([N+](=O)[O-])cc1 ZINC001567269415 1416048381 /nfs/dbraw/zinc/04/83/81/1416048381.db2.gz DWTOVPNDNCNUNX-UHFFFAOYSA-N 1 1 331.347 2.596 10 5 EFBEMO Cc1c(F)cccc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001567282087 1416053579 /nfs/dbraw/zinc/05/35/79/1416053579.db2.gz LZRZMHAHQIVCCZ-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO Cc1c(F)cccc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001567282087 1416053586 /nfs/dbraw/zinc/05/35/86/1416053586.db2.gz LZRZMHAHQIVCCZ-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO CC[N@H+](CCNC(=O)c1ncccc1C)Cc1ccccc1[N+](=O)[O-] ZINC001567329305 1416075788 /nfs/dbraw/zinc/07/57/88/1416075788.db2.gz BGVVAYURTDPGIG-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ncccc1C)Cc1ccccc1[N+](=O)[O-] ZINC001567329305 1416075794 /nfs/dbraw/zinc/07/57/94/1416075794.db2.gz BGVVAYURTDPGIG-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO Cc1cccnc1C(=O)NCCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001707370878 1418234522 /nfs/dbraw/zinc/23/45/22/1418234522.db2.gz FJTZVSJPGGPOTJ-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO CC(C)CCC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21 ZINC001713280210 1418449868 /nfs/dbraw/zinc/44/98/68/1418449868.db2.gz JQFCVJIVZIOGFQ-HWWDLCQESA-N 1 1 331.416 2.577 10 5 EFBEMO CC(C)(C)CC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21 ZINC001713280239 1418450382 /nfs/dbraw/zinc/45/03/82/1418450382.db2.gz MUXDXJDAIXPPFR-QLPKVWCKSA-N 1 1 331.416 2.577 10 5 EFBEMO C[N@H+](CCNC(=O)c1ccc(F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC001713444246 1418541112 /nfs/dbraw/zinc/54/11/12/1418541112.db2.gz JRWOHCPSUGGTNH-UHFFFAOYSA-N 1 1 331.347 2.596 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccc(F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC001713444246 1418541117 /nfs/dbraw/zinc/54/11/17/1418541117.db2.gz JRWOHCPSUGGTNH-UHFFFAOYSA-N 1 1 331.347 2.596 10 5 EFBEMO CC/C=C(/C)C(=O)N1C[C@@H]2C[N@@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001717008653 1419144889 /nfs/dbraw/zinc/14/48/89/1419144889.db2.gz RZNVPVMFKPWIAG-GPYPFEAASA-N 1 1 349.456 2.903 10 5 EFBEMO CC/C=C(/C)C(=O)N1C[C@@H]2C[N@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001717008653 1419144893 /nfs/dbraw/zinc/14/48/93/1419144893.db2.gz RZNVPVMFKPWIAG-GPYPFEAASA-N 1 1 349.456 2.903 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)C1CC=CC1 ZINC001717205921 1419265939 /nfs/dbraw/zinc/26/59/39/1419265939.db2.gz YYEZUVVNWKYCFI-UHFFFAOYSA-N 1 1 331.416 2.841 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1ccncc1 ZINC001724841181 1425055695 /nfs/dbraw/zinc/05/56/95/1425055695.db2.gz RLYWYHJNOIRZEN-UHFFFAOYSA-N 1 1 342.399 2.584 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)C1CC=CC1 ZINC001724847159 1425064341 /nfs/dbraw/zinc/06/43/41/1425064341.db2.gz MMTVOJTZJLLILC-UHFFFAOYSA-N 1 1 331.416 2.841 10 5 EFBEMO CC(C)N(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc[nH]1 ZINC001725725219 1425797926 /nfs/dbraw/zinc/79/79/26/1425797926.db2.gz JIKHHWYIRXZVBX-UHFFFAOYSA-N 1 1 344.415 2.906 10 5 EFBEMO CC(C)N(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc[nH]1 ZINC001725725219 1425797930 /nfs/dbraw/zinc/79/79/30/1425797930.db2.gz JIKHHWYIRXZVBX-UHFFFAOYSA-N 1 1 344.415 2.906 10 5 EFBEMO CC(C)(C)OC(=O)[C@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000176169718 715162207 /nfs/dbraw/zinc/16/22/07/715162207.db2.gz HOUFURSQIFFYIP-LBPRGKRZSA-N 1 1 346.387 2.566 10 5 EFBEMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000176169718 715162208 /nfs/dbraw/zinc/16/22/08/715162208.db2.gz HOUFURSQIFFYIP-LBPRGKRZSA-N 1 1 346.387 2.566 10 5 EFBEMO Cc1nn(C[N@H+]2CC[C@@]3(O)CCCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc12 ZINC000121264787 715210504 /nfs/dbraw/zinc/21/05/04/715210504.db2.gz TVHBTKJNGMJBOH-KDOFPFPSSA-N 1 1 344.415 2.837 10 5 EFBEMO C[C@H]1C[C@H](NCc2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000162209440 716777882 /nfs/dbraw/zinc/77/78/82/716777882.db2.gz AOTNWHSPRHCVDL-GXFFZTMASA-N 1 1 342.237 2.930 10 5 EFBEMO CC[N@H+]1CC[C@H]1CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893874003 720136296 /nfs/dbraw/zinc/13/62/96/720136296.db2.gz TVPIBGGMCIGAFW-NSHDSACASA-N 1 1 343.836 2.551 10 5 EFBEMO C[C@@H]1[C@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000928434949 722862717 /nfs/dbraw/zinc/86/27/17/722862717.db2.gz FQVVRWWUUVCLCC-MWLCHTKSSA-N 1 1 343.836 2.549 10 5 EFBEMO CC(C)(O)[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000721824285 723464040 /nfs/dbraw/zinc/46/40/40/723464040.db2.gz RVOJYALAVGZMOW-LLVKDONJSA-N 1 1 343.221 2.950 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H](c3nccs3)C1)OCCO2 ZINC000895581965 724212732 /nfs/dbraw/zinc/21/27/32/724212732.db2.gz DMXXEALQQJTAOF-NSHDSACASA-N 1 1 347.396 2.812 10 5 EFBEMO C[N@H+]1CC[C@H](C(=O)NCc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000895755841 724299532 /nfs/dbraw/zinc/29/95/32/724299532.db2.gz BZPGDXKOIDXMBV-WMZOPIPTSA-N 1 1 339.395 2.904 10 5 EFBEMO COC(=O)N[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000895850918 724350300 /nfs/dbraw/zinc/35/03/00/724350300.db2.gz QFIRMKCBWQLFCM-ZDUSSCGKSA-N 1 1 345.355 2.785 10 5 EFBEMO CC[N@H+]1CCN(C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000907122828 726869521 /nfs/dbraw/zinc/86/95/21/726869521.db2.gz FTGSJTLPXPQBFO-LBPRGKRZSA-N 1 1 339.823 2.733 10 5 EFBEMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000907204651 726884498 /nfs/dbraw/zinc/88/44/98/726884498.db2.gz FKWCVXCSCDAGBC-NWDGAFQWSA-N 1 1 339.823 2.732 10 5 EFBEMO C[N@H+]1CCN(C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C(C)(C)C1 ZINC000907182250 726888199 /nfs/dbraw/zinc/88/81/99/726888199.db2.gz CCUQZQWQZSXQHJ-UHFFFAOYSA-N 1 1 339.823 2.733 10 5 EFBEMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000907193785 726890521 /nfs/dbraw/zinc/89/05/21/726890521.db2.gz WBAJKNGQLLXYGE-NWDGAFQWSA-N 1 1 339.823 2.732 10 5 EFBEMO O=C([C@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1)N1CCCC1 ZINC000732412550 727072716 /nfs/dbraw/zinc/07/27/16/727072716.db2.gz NQOSUVGKTNQGRA-ZDUSSCGKSA-N 1 1 335.379 2.568 10 5 EFBEMO C[N@H+]1CCC[C@@](O)(CC(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000908078200 727094588 /nfs/dbraw/zinc/09/45/88/727094588.db2.gz ZOCGYHMEGRLUPT-GOSISDBHSA-N 1 1 349.431 2.678 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC000908282774 727150520 /nfs/dbraw/zinc/15/05/20/727150520.db2.gz VWWHCHVGOFIEAN-IUODEOHRSA-N 1 1 333.388 2.949 10 5 EFBEMO O=C(c1cc(Cl)c(F)c([N+](=O)[O-])c1)N1CC[NH+](CCCF)CC1 ZINC000911588332 727560897 /nfs/dbraw/zinc/56/08/97/727560897.db2.gz NIYBIMUJWAESAW-UHFFFAOYSA-N 1 1 347.749 2.505 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000916053727 727652608 /nfs/dbraw/zinc/65/26/08/727652608.db2.gz DRIVTMWYAQOKDW-LLVKDONJSA-N 1 1 325.796 2.852 10 5 EFBEMO CCN(C(=O)CCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@@H+](C)C1 ZINC000912308345 727693517 /nfs/dbraw/zinc/69/35/17/727693517.db2.gz XKRUBHZMVCRABI-CQSZACIVSA-N 1 1 339.823 2.733 10 5 EFBEMO C[C@H]1CCC[C@@H](CC[NH+](C)C)N1C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000912649839 727732197 /nfs/dbraw/zinc/73/21/97/727732197.db2.gz DPRQIJMAOPEXFZ-JSGCOSHPSA-N 1 1 335.404 2.635 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@]3(C)C[N@H+](C)C[C@]3(C)C2)c1C ZINC000913275369 727812628 /nfs/dbraw/zinc/81/26/28/727812628.db2.gz UPNRUPRYOCVAKT-HDICACEKSA-N 1 1 331.416 2.625 10 5 EFBEMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3cccc([N+](=O)[O-])c3Cl)C[C@@]2(C)C1 ZINC000913275815 727812813 /nfs/dbraw/zinc/81/28/13/727812813.db2.gz DTSSYEQHBKGZAZ-IYBDPMFKSA-N 1 1 337.807 2.662 10 5 EFBEMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])C[C@@]2(C)C1 ZINC000913285729 727816188 /nfs/dbraw/zinc/81/61/88/727816188.db2.gz VKLHPTJWLSRLOA-IYBDPMFKSA-N 1 1 337.807 2.662 10 5 EFBEMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCc1cc(F)c(Cl)c([N+](=O)[O-])c1 ZINC000913384700 727830435 /nfs/dbraw/zinc/83/04/35/727830435.db2.gz CEEKFXSSWSQICU-AOOOYVTPSA-N 1 1 343.786 2.876 10 5 EFBEMO CCC[N@H+]1CCC[C@H]1C(=O)NCc1cc(F)c(Cl)c([N+](=O)[O-])c1 ZINC000913385553 727830908 /nfs/dbraw/zinc/83/09/08/727830908.db2.gz ABSGLENHJYBSBZ-LBPRGKRZSA-N 1 1 343.786 2.878 10 5 EFBEMO C[N@@H+](CCNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000921028819 729252210 /nfs/dbraw/zinc/25/22/10/729252210.db2.gz YMRTXRCCLJABHO-XFXZXTDPSA-N 1 1 331.416 2.989 10 5 EFBEMO CCC(=O)NCC1(C)CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC001569695238 1085526354 /nfs/dbraw/zinc/52/63/54/1085526354.db2.gz IVCFRLUAPRMAGQ-UHFFFAOYSA-N 1 1 325.434 2.785 10 5 EFBEMO CC(C)(C)CC[NH2+]C[C@H]1CC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001569862455 1085690069 /nfs/dbraw/zinc/69/00/69/1085690069.db2.gz HKRCFCYVADYXKJ-KLHDSHLOSA-N 1 1 339.480 2.600 10 5 EFBEMO O=C(c1cc([N+](=O)[O-])ccc1F)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC001570353363 1086162760 /nfs/dbraw/zinc/16/27/60/1086162760.db2.gz PDMDYLYHIBVLAF-INIZCTEOSA-N 1 1 329.331 2.521 10 5 EFBEMO O=C(NC1(C[NH2+]CCCC2CCC2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001570796115 1086523018 /nfs/dbraw/zinc/52/30/18/1086523018.db2.gz FFJMLCVZRYQFFE-HZPDHXFCSA-N 1 1 337.464 2.641 10 5 EFBEMO O=C(CC[N@H+]1Cc2ccc(O)cc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC001647812619 1089884861 /nfs/dbraw/zinc/88/48/61/1089884861.db2.gz CDAZUEOPWMVRQF-UHFFFAOYSA-N 1 1 327.340 2.645 10 5 EFBEMO O=C(CC[N@@H+]1Cc2ccc(O)cc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC001647812619 1089884872 /nfs/dbraw/zinc/88/48/72/1089884872.db2.gz CDAZUEOPWMVRQF-UHFFFAOYSA-N 1 1 327.340 2.645 10 5 EFBEMO O=C(CC[N@H+]1Cc2ccc(O)cc2C1)Nc1ccccc1[N+](=O)[O-] ZINC001647813506 1089885192 /nfs/dbraw/zinc/88/51/92/1089885192.db2.gz LMDKTLLBHNBXDS-UHFFFAOYSA-N 1 1 327.340 2.645 10 5 EFBEMO O=C(CC[N@@H+]1Cc2ccc(O)cc2C1)Nc1ccccc1[N+](=O)[O-] ZINC001647813506 1089885205 /nfs/dbraw/zinc/88/52/05/1089885205.db2.gz LMDKTLLBHNBXDS-UHFFFAOYSA-N 1 1 327.340 2.645 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](C)c1ncccc1C ZINC001620665016 1091117224 /nfs/dbraw/zinc/11/72/24/1091117224.db2.gz UMMLBJZINRAWRF-ZDUSSCGKSA-N 1 1 328.372 2.896 10 5 EFBEMO C[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H](C)CCO1 ZINC001620678436 1091125512 /nfs/dbraw/zinc/12/55/12/1091125512.db2.gz WRVJKKOOCUMDAQ-VXGBXAGGSA-N 1 1 339.367 2.562 10 5 EFBEMO COc1ccc(C[C@@H]2CC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC001167635572 1093169066 /nfs/dbraw/zinc/16/90/66/1093169066.db2.gz NDLLNUSIZKKDHB-LPHOPBHVSA-N 1 1 342.395 2.954 10 5 EFBEMO Cc1cccc(F)c1C(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001267233675 1093303760 /nfs/dbraw/zinc/30/37/60/1093303760.db2.gz ROJRSOFDILEESR-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO Cc1cccc(F)c1C(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001267233675 1093303771 /nfs/dbraw/zinc/30/37/71/1093303771.db2.gz ROJRSOFDILEESR-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO C[N@@H+](CCCCNc1c2cc(F)ccc2ncc1[N+](=O)[O-])C1CC1 ZINC001651126424 1093529721 /nfs/dbraw/zinc/52/97/21/1093529721.db2.gz SIPGBFNZIBUFSJ-UHFFFAOYSA-N 1 1 332.379 2.990 10 5 EFBEMO CCC[N@H+](CCNC(=O)c1coc(C)n1)Cc1ccccc1[N+](=O)[O-] ZINC001267312797 1093555368 /nfs/dbraw/zinc/55/53/68/1093555368.db2.gz OHNGUWOJKOSQFK-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1coc(C)n1)Cc1ccccc1[N+](=O)[O-] ZINC001267312797 1093555372 /nfs/dbraw/zinc/55/53/72/1093555372.db2.gz OHNGUWOJKOSQFK-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO Cc1ccc(C(=O)NCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001480939346 1094444952 /nfs/dbraw/zinc/44/49/52/1094444952.db2.gz AIVHJVGXPUDLRD-UHFFFAOYSA-N 1 1 327.384 2.765 10 5 EFBEMO CCC[N@H+](CCNC(=O)c1cc(C)no1)Cc1ccccc1[N+](=O)[O-] ZINC001481130841 1094886941 /nfs/dbraw/zinc/88/69/41/1094886941.db2.gz TZRSYRYVIPUKDM-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1cc(C)no1)Cc1ccccc1[N+](=O)[O-] ZINC001481130841 1094886959 /nfs/dbraw/zinc/88/69/59/1094886959.db2.gz TZRSYRYVIPUKDM-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO CC(C)[N@@H+](CCCNC(=O)C(F)F)Cc1csc([N+](=O)[O-])c1 ZINC001267495817 1094978377 /nfs/dbraw/zinc/97/83/77/1094978377.db2.gz YGHKUEPXHLINKE-UHFFFAOYSA-N 1 1 335.376 2.638 10 5 EFBEMO C/C(=C\C(=O)NC[C@@H](C)Cn1cc[nH+]c1C)c1ccc([N+](=O)[O-])cc1 ZINC000785364914 1095221047 /nfs/dbraw/zinc/22/10/47/1095221047.db2.gz UHEXYRIDFVGLOR-PCRWRXJSSA-N 1 1 342.399 2.956 10 5 EFBEMO CC[N@@H+](CCNC(=O)Cc1ccsc1)Cc1cccc([N+](=O)[O-])c1 ZINC001480959697 1095443379 /nfs/dbraw/zinc/44/33/79/1095443379.db2.gz VFXVJAGPIAYGLA-UHFFFAOYSA-N 1 1 347.440 2.837 10 5 EFBEMO C=C/C(C)=C/CC(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001481640312 1096103570 /nfs/dbraw/zinc/10/35/70/1096103570.db2.gz GQUXIQDGGZHTRH-LNKIKWGQSA-N 1 1 329.400 2.665 10 5 EFBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)[C@H]1C[C@H]2C[C@H]2C1 ZINC001268247722 1096177042 /nfs/dbraw/zinc/17/70/42/1096177042.db2.gz OUNZZSJGVWPTQO-ZSHCYNCHSA-N 1 1 331.416 2.531 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)[C@H]1C[C@H]2C[C@H]2C1 ZINC001268247722 1096177052 /nfs/dbraw/zinc/17/70/52/1096177052.db2.gz OUNZZSJGVWPTQO-ZSHCYNCHSA-N 1 1 331.416 2.531 10 5 EFBEMO Nc1ccc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCCC2)cc1[N+](=O)[O-] ZINC001648952644 1097663235 /nfs/dbraw/zinc/66/32/35/1097663235.db2.gz YXQLOKBVBOELGT-HNNXBMFYSA-N 1 1 346.431 2.704 10 5 EFBEMO CCCC1(C(=O)NCC2C[NH+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC001268874387 1097694635 /nfs/dbraw/zinc/69/46/35/1097694635.db2.gz MTTVOUPGHMHBMB-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO O=C(NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)c1ccsc1 ZINC001269369116 1098090570 /nfs/dbraw/zinc/09/05/70/1098090570.db2.gz XABFMVLBZZNMAZ-UHFFFAOYSA-N 1 1 337.426 2.770 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC001611391394 1099006603 /nfs/dbraw/zinc/00/66/03/1099006603.db2.gz OBZQVWCCELHXKA-HUUCEWRRSA-N 1 1 335.379 2.789 10 5 EFBEMO COC(=O)Cc1ccc(NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001611794047 1099034478 /nfs/dbraw/zinc/03/44/78/1099034478.db2.gz LPDFVFDYHVLHRX-KBPBESRZSA-N 1 1 349.431 2.843 10 5 EFBEMO CCC[N@@H+](CC)C[C@@H](C)Nc1nccc(C(=O)OCC)c1[N+](=O)[O-] ZINC001612440974 1099057478 /nfs/dbraw/zinc/05/74/78/1099057478.db2.gz DPKMNRIJEIEPGB-GFCCVEGCSA-N 1 1 338.408 2.699 10 5 EFBEMO C[C@@H](CNc1nc2c(cc1[N+](=O)[O-])CCCC2)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001612545361 1099064377 /nfs/dbraw/zinc/06/43/77/1099064377.db2.gz NTUALWOVBZEXGM-MELADBBJSA-N 1 1 348.447 2.778 10 5 EFBEMO C[C@@H](CNc1nc2c(cc1[N+](=O)[O-])CCCC2)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001612545361 1099064388 /nfs/dbraw/zinc/06/43/88/1099064388.db2.gz NTUALWOVBZEXGM-MELADBBJSA-N 1 1 348.447 2.778 10 5 EFBEMO O=[N+]([O-])c1cnc2c(Cl)cccc2c1NCc1c[nH+]c2n1CCC2 ZINC001612917005 1099084124 /nfs/dbraw/zinc/08/41/24/1099084124.db2.gz NGFCAPAWZYRPIG-UHFFFAOYSA-N 1 1 343.774 2.973 10 5 EFBEMO CC1(C)CC[N@@H+](CCNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC001617112440 1099214564 /nfs/dbraw/zinc/21/45/64/1099214564.db2.gz PHGUEQATASJIJF-UHFFFAOYSA-N 1 1 325.796 2.710 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CC[C@H](O)C23CCCC3)o1 ZINC001618233665 1099286556 /nfs/dbraw/zinc/28/65/56/1099286556.db2.gz ATELCACLCLLFQA-AWEZNQCLSA-N 1 1 344.371 2.524 10 5 EFBEMO CCC(O)(CC)C[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001620475111 1099354300 /nfs/dbraw/zinc/35/43/00/1099354300.db2.gz OCUWGAHVKXOQSU-UHFFFAOYSA-N 1 1 334.376 2.628 10 5 EFBEMO C[C@@H]1CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C1CCCC1 ZINC001620583484 1099361825 /nfs/dbraw/zinc/36/18/25/1099361825.db2.gz MHLAQIOYBLVARL-RDTXWAMCSA-N 1 1 333.432 2.577 10 5 EFBEMO CC(C)C1(O)CC[NH+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC001620668247 1099368301 /nfs/dbraw/zinc/36/83/01/1099368301.db2.gz RCSZNIRRJIQILO-UHFFFAOYSA-N 1 1 346.387 2.628 10 5 EFBEMO CCC[N@H+]1CCC[C@@H](C(=O)N2CCc3cc(C)c([N+](=O)[O-])cc32)C1 ZINC001623968563 1099645859 /nfs/dbraw/zinc/64/58/59/1099645859.db2.gz SOHVXPDBIBOOCZ-OAHLLOKOSA-N 1 1 331.416 2.914 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N)C1CC1 ZINC001626759374 1099915483 /nfs/dbraw/zinc/91/54/83/1099915483.db2.gz BQQKNTSPXNFUSZ-UHFFFAOYSA-N 1 1 342.399 2.544 10 5 EFBEMO CCC[N@@H+](CC)CCNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001629245356 1100186235 /nfs/dbraw/zinc/18/62/35/1100186235.db2.gz VZYRRTKDXYMYTK-UHFFFAOYSA-N 1 1 327.812 2.639 10 5 EFBEMO CC(C)[N@H+]1CCC[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001630936594 1100355263 /nfs/dbraw/zinc/35/52/63/1100355263.db2.gz XDTNRAWBGGJCPT-OAHLLOKOSA-N 1 1 331.416 2.600 10 5 EFBEMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC001633420887 1100541847 /nfs/dbraw/zinc/54/18/47/1100541847.db2.gz DBYPVVIJBOGFBC-NSHDSACASA-N 1 1 325.796 2.852 10 5 EFBEMO CC[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 ZINC001634540662 1100614865 /nfs/dbraw/zinc/61/48/65/1100614865.db2.gz AXGCWOBHPYYEBI-QGZVFWFLSA-N 1 1 342.399 2.832 10 5 EFBEMO CCC[N@H+]1CCC[C@@H]1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC001637004000 1100750455 /nfs/dbraw/zinc/75/04/55/1100750455.db2.gz VXINHBVITRNIHY-OAHLLOKOSA-N 1 1 343.387 2.798 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cc([C@@H]2CCC[N@H+]2C)[nH]n1 ZINC001637069431 1100755110 /nfs/dbraw/zinc/75/51/10/1100755110.db2.gz WCCXQPHXOSSKPQ-HNNXBMFYSA-N 1 1 343.387 2.954 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cc([C@@H]2CCC[N@@H+]2C)[nH]n1 ZINC001637069431 1100755111 /nfs/dbraw/zinc/75/51/11/1100755111.db2.gz WCCXQPHXOSSKPQ-HNNXBMFYSA-N 1 1 343.387 2.954 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC2(CCC[N@H+]2C)CC1 ZINC001637352128 1100775384 /nfs/dbraw/zinc/77/53/84/1100775384.db2.gz FOVAAYILZFUZCM-UHFFFAOYSA-N 1 1 347.415 2.694 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1 ZINC001639271933 1100932522 /nfs/dbraw/zinc/93/25/22/1100932522.db2.gz DVSBTLNMDUZWBN-OLZOCXBDSA-N 1 1 335.404 2.914 10 5 EFBEMO C[N@H+]1C[C@@H]2CN(c3ccc([N+](=O)[O-])cc3Br)C[C@]2(C)C1 ZINC001640478314 1101051572 /nfs/dbraw/zinc/05/15/72/1101051572.db2.gz XBUBJFPDSLWVIP-YGRLFVJLSA-N 1 1 340.221 2.745 10 5 EFBEMO COc1ccc2ncc([N+](=O)[O-])c(N[C@@H]3C[C@@H](C)[N@H+](C4CC4)C3)c2c1 ZINC001642431541 1101212900 /nfs/dbraw/zinc/21/29/00/1101212900.db2.gz MQWAWAORCQWBPZ-VXGBXAGGSA-N 1 1 342.399 2.611 10 5 EFBEMO Cc1cc(C[NH+](C)C)ccc1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001642440522 1101213844 /nfs/dbraw/zinc/21/38/44/1101213844.db2.gz JSSLINBUODAUHK-UHFFFAOYSA-N 1 1 329.356 2.923 10 5 EFBEMO C[C@H]1[C@H](C)[N@@H+](C)CCN1Cc1cc([N+](=O)[O-])ccc1Br ZINC001642491278 1101216545 /nfs/dbraw/zinc/21/65/45/1101216545.db2.gz OXYAZYQCFOLQMP-QWRGUYRKSA-N 1 1 342.237 2.882 10 5 EFBEMO CCC[N@H+]1CC[C@H](Nc2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC001642976749 1101261761 /nfs/dbraw/zinc/26/17/61/1101261761.db2.gz GXJCWUCMPHAGOT-HNNXBMFYSA-N 1 1 341.415 2.678 10 5 EFBEMO Cn1cc([N+](=O)[O-])c(N2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)n1 ZINC001651330006 1101309941 /nfs/dbraw/zinc/30/99/41/1101309941.db2.gz AWRXJHNZCWWKHG-UHFFFAOYSA-N 1 1 349.822 2.694 10 5 EFBEMO Cn1cc([N+](=O)[O-])c(N2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)n1 ZINC001651330006 1101309955 /nfs/dbraw/zinc/30/99/55/1101309955.db2.gz AWRXJHNZCWWKHG-UHFFFAOYSA-N 1 1 349.822 2.694 10 5 EFBEMO CCc1cc(N[C@@H]2CC[N@@H+](C)[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001651435125 1101328712 /nfs/dbraw/zinc/32/87/12/1101328712.db2.gz QOSUSOQUUWNPNP-MLGOLLRUSA-N 1 1 341.415 2.541 10 5 EFBEMO CC[N@@H+](C)[C@H]1CCN(c2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC001651531346 1101344212 /nfs/dbraw/zinc/34/42/12/1101344212.db2.gz YNFQCLAEYROBJD-JTQLQIEISA-N 1 1 343.225 2.591 10 5 EFBEMO CN(C[C@@H]1CCC[N@H+]1C)c1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-] ZINC001651964088 1101411761 /nfs/dbraw/zinc/41/17/61/1101411761.db2.gz FLISVPKVJNOPKP-LBPRGKRZSA-N 1 1 345.359 2.582 10 5 EFBEMO COc1csc(C(=O)NCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001266306075 1101502879 /nfs/dbraw/zinc/50/28/79/1101502879.db2.gz BLVASOBSYOPQNB-UHFFFAOYSA-N 1 1 349.412 2.527 10 5 EFBEMO CC[N@H+]1C[C@@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C(C)(C)C1 ZINC001652603493 1101520026 /nfs/dbraw/zinc/52/00/26/1101520026.db2.gz MPNKDLKZMWTGIR-CYBMUJFWSA-N 1 1 341.358 2.533 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[NH+]2CCC(CCCO)CC2)o1 ZINC001653859501 1101656834 /nfs/dbraw/zinc/65/68/34/1101656834.db2.gz QEIQOJIXIUPOFF-UHFFFAOYSA-N 1 1 346.387 2.629 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccc(Cl)cn1)Cc1ccc([N+](=O)[O-])cc1 ZINC001266349875 1101660626 /nfs/dbraw/zinc/66/06/26/1101660626.db2.gz BEBDPXHAYDHLQW-UHFFFAOYSA-N 1 1 348.790 2.505 10 5 EFBEMO Cc1nsc(C)c1C(=O)NCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001266362412 1101722447 /nfs/dbraw/zinc/72/24/47/1101722447.db2.gz HLTFRRFOEAPYBA-UHFFFAOYSA-N 1 1 348.428 2.530 10 5 EFBEMO Cc1cccc(F)c1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001266368680 1101756410 /nfs/dbraw/zinc/75/64/10/1101756410.db2.gz WLSYTGAGEDKKQX-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO Cc1cccc(F)c1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001266368680 1101756416 /nfs/dbraw/zinc/75/64/16/1101756416.db2.gz WLSYTGAGEDKKQX-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO COC(=O)[C@]12C[N@@H+](CCOc3ccccc3[N+](=O)[O-])C[C@H]1CCCC2 ZINC001654884990 1101766275 /nfs/dbraw/zinc/76/62/75/1101766275.db2.gz JNTVZSHSXMGSDJ-RDTXWAMCSA-N 1 1 348.399 2.639 10 5 EFBEMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1C[C@H]2CCCC[C@H]21 ZINC001654965474 1101773119 /nfs/dbraw/zinc/77/31/19/1101773119.db2.gz UHIAZCVCDMCILB-TZMCWYRMSA-N 1 1 331.372 2.767 10 5 EFBEMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCc2ccccc2C(C)(C)C1 ZINC001655036650 1101779390 /nfs/dbraw/zinc/77/93/90/1101779390.db2.gz LNZZFCNFFPMKIH-UHFFFAOYSA-N 1 1 328.416 2.936 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@]23CCC[C@H]2OCC3)c1 ZINC001655130683 1101788169 /nfs/dbraw/zinc/78/81/69/1101788169.db2.gz KUATXNIQBHMKFL-SJLPKXTDSA-N 1 1 348.399 2.772 10 5 EFBEMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC[C@H]1CCCC[N@@H+]1CCO ZINC001655499874 1101835992 /nfs/dbraw/zinc/83/59/92/1101835992.db2.gz WTHUYNKDLXEOAL-GFCCVEGCSA-N 1 1 347.337 2.872 10 5 EFBEMO CN(C[C@@H]1CCC[N@H+]1C)c1c(Br)cccc1[N+](=O)[O-] ZINC001655591933 1101853262 /nfs/dbraw/zinc/85/32/62/1101853262.db2.gz ZGXUMYHJXIGVIR-JTQLQIEISA-N 1 1 328.210 2.888 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](C(=O)N(C)C)C1 ZINC001655709912 1101876638 /nfs/dbraw/zinc/87/66/38/1101876638.db2.gz ZSPSWOULRXATDT-CQSZACIVSA-N 1 1 349.431 2.682 10 5 EFBEMO Cn1cc([C@H]2CCC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)nn1 ZINC001655856455 1101902475 /nfs/dbraw/zinc/90/24/75/1101902475.db2.gz XIULCPCBTUMIBM-NSHDSACASA-N 1 1 335.795 2.756 10 5 EFBEMO Cn1cc([C@H]2CCC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)nn1 ZINC001655856455 1101902488 /nfs/dbraw/zinc/90/24/88/1101902488.db2.gz XIULCPCBTUMIBM-NSHDSACASA-N 1 1 335.795 2.756 10 5 EFBEMO CN(C)c1cc[nH+]c(CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1 ZINC001655855830 1101902716 /nfs/dbraw/zinc/90/27/16/1101902716.db2.gz CTGSGUAEGMJZBU-UHFFFAOYSA-N 1 1 341.371 2.553 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN(Cc2ccnn2C)CC1 ZINC001655895002 1101908849 /nfs/dbraw/zinc/90/88/49/1101908849.db2.gz RPDMDHODVQBHIV-OAHLLOKOSA-N 1 1 343.431 2.516 10 5 EFBEMO O=C(CC[N@H+]1CCCC[C@]12CCCOC2)Nc1ccccc1[N+](=O)[O-] ZINC001655921470 1101910501 /nfs/dbraw/zinc/91/05/01/1101910501.db2.gz BOIAYVOBDJMBKL-GOSISDBHSA-N 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PIDOHMQDOAQMBN-XJKSGUPXSA-N 1 1 347.415 2.610 10 5 EFBEMO CC[N@H+]1CCCN(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000277889794 267291277 /nfs/dbraw/zinc/29/12/77/267291277.db2.gz DHSUFYUOEMRPAD-UHFFFAOYSA-N 1 1 325.796 2.724 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCCc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000269738835 273089757 /nfs/dbraw/zinc/08/97/57/273089757.db2.gz YDCSEDLIEWFXJL-GDBMZVCRSA-N 1 1 348.447 2.509 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)NCCc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000269738838 273089844 /nfs/dbraw/zinc/08/98/44/273089844.db2.gz YDCSEDLIEWFXJL-ZBFHGGJFSA-N 1 1 348.447 2.509 10 5 EFBEMO COC(=O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000271117779 273098991 /nfs/dbraw/zinc/09/89/91/273098991.db2.gz WWMYQBVGPLHLNL-ZDUSSCGKSA-N 1 1 330.340 2.850 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000280280983 273310883 /nfs/dbraw/zinc/31/08/83/273310883.db2.gz DOOBRRSRHLHYGK-OLZOCXBDSA-N 1 1 335.404 2.548 10 5 EFBEMO O=[N+]([O-])c1cc(Br)ccc1N1CC[N@H+]2CCC[C@H]2C1 ZINC000245386480 275032861 /nfs/dbraw/zinc/03/28/61/275032861.db2.gz NUWMFULANRMEBW-NSHDSACASA-N 1 1 326.194 2.642 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[NH2+][C@@H]1CCOc3ccccc31)OCO2 ZINC000095385680 275033883 /nfs/dbraw/zinc/03/38/83/275033883.db2.gz OBMPEYSUWRLSJV-CYBMUJFWSA-N 1 1 328.324 2.937 10 5 EFBEMO CC(C)c1ccc(C[N@H+]2C[C@@H](C)[C@H](N3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000245776747 276053274 /nfs/dbraw/zinc/05/32/74/276053274.db2.gz SUIDUBCXRVWDFZ-DNVCBOLYSA-N 1 1 347.459 2.871 10 5 EFBEMO CC[N@H+]1CC[C@@H](CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000266277891 276212342 /nfs/dbraw/zinc/21/23/42/276212342.db2.gz QJYKZGKRGSSRHW-JTQLQIEISA-N 1 1 345.321 2.685 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])CC1 ZINC000253430227 279028776 /nfs/dbraw/zinc/02/87/76/279028776.db2.gz XZRVYUGACSQTRL-UHFFFAOYSA-N 1 1 328.372 2.885 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)[C@@H](C)C1 ZINC000342936589 279397128 /nfs/dbraw/zinc/39/71/28/279397128.db2.gz XTFWKUAYHYQFAE-SWLSCSKDSA-N 1 1 344.415 2.878 10 5 EFBEMO Cc1cc(NC[C@@H](O)C[NH+]2CCCCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000181454308 280626698 /nfs/dbraw/zinc/62/66/98/280626698.db2.gz YGQMOGPVCQIBJB-OAHLLOKOSA-N 1 1 344.415 2.710 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000291039242 294255650 /nfs/dbraw/zinc/25/56/50/294255650.db2.gz ARQPXJMOOXTTLA-OAHLLOKOSA-N 1 1 327.331 2.885 10 5 EFBEMO COc1ccc(NC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000291207273 294310185 /nfs/dbraw/zinc/31/01/85/294310185.db2.gz GSKHENSANLVGHG-INIZCTEOSA-N 1 1 339.367 2.754 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)Oc2cc(F)cc([N+](=O)[O-])c2)C1 ZINC000291272555 294331910 /nfs/dbraw/zinc/33/19/10/294331910.db2.gz LLVIRXRDMPOMPC-OAHLLOKOSA-N 1 1 328.315 2.852 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000294351725 295152038 /nfs/dbraw/zinc/15/20/38/295152038.db2.gz YMJGCXCMNZSEOV-QZEGLACASA-N 1 1 343.427 2.942 10 5 EFBEMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@](C)(F)C2)c([N+](=O)[O-])c1 ZINC000295570174 295342474 /nfs/dbraw/zinc/34/24/74/295342474.db2.gz YSCDHPPCTUXFLP-MRXNPFEDSA-N 1 1 339.367 2.756 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C(=O)NCC2CC2)C1 ZINC000298740988 311019385 /nfs/dbraw/zinc/01/93/85/311019385.db2.gz JQHRIVYOBKQYSJ-CZUORRHYSA-N 1 1 331.416 2.894 10 5 EFBEMO Cc1ccnc(NCc2ccc(C[NH+]3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000301281720 311128773 /nfs/dbraw/zinc/12/87/73/311128773.db2.gz KFQNDELZQRUFLJ-UHFFFAOYSA-N 1 1 342.399 2.743 10 5 EFBEMO O=[N+]([O-])c1ccc(N2C[C@H]3OCC[N@H+](Cc4ccccc4)[C@H]3C2)cc1 ZINC000301625646 311148455 /nfs/dbraw/zinc/14/84/55/311148455.db2.gz HDHQVXYOEYFUBJ-RBUKOAKNSA-N 1 1 339.395 2.684 10 5 EFBEMO O=[N+]([O-])c1ccc(N2C[C@H]3OCC[N@@H+](Cc4ccccc4)[C@H]3C2)cc1 ZINC000301625646 311148456 /nfs/dbraw/zinc/14/84/56/311148456.db2.gz HDHQVXYOEYFUBJ-RBUKOAKNSA-N 1 1 339.395 2.684 10 5 EFBEMO COC(=O)c1cc(NCC[N@H+]2CCC[C@@H](C)C2)cc(C)c1[N+](=O)[O-] ZINC000301688401 311152152 /nfs/dbraw/zinc/15/21/52/311152152.db2.gz MOYSEGLBISTLAW-GFCCVEGCSA-N 1 1 335.404 2.834 10 5 EFBEMO CC[N@H+]1CCCC[C@@H]1CNc1cc(C)c([N+](=O)[O-])c(C(=O)OC)c1 ZINC000301703432 311153617 /nfs/dbraw/zinc/15/36/17/311153617.db2.gz UPNFTAIGQNVCBK-CQSZACIVSA-N 1 1 335.404 2.976 10 5 EFBEMO CC1=CC[N@@H+](CCNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])CC1 ZINC000302175488 311182683 /nfs/dbraw/zinc/18/26/83/311182683.db2.gz WBBGHKTZJWTUBS-UHFFFAOYSA-N 1 1 346.431 2.797 10 5 EFBEMO COCC[N@@H+]1CCN(c2c(C)cc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000302672488 311196008 /nfs/dbraw/zinc/19/60/08/311196008.db2.gz LCKRXVPVAQZKSK-GFCCVEGCSA-N 1 1 327.812 2.714 10 5 EFBEMO COCC[N@H+]1CCN(c2c(C)cc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000302672488 311196009 /nfs/dbraw/zinc/19/60/09/311196009.db2.gz LCKRXVPVAQZKSK-GFCCVEGCSA-N 1 1 327.812 2.714 10 5 EFBEMO CC[C@H]1CN(c2c(C)cc([N+](=O)[O-])cc2Cl)CC[N@@H+]1C[C@@H](C)O ZINC000302688714 311196656 /nfs/dbraw/zinc/19/66/56/311196656.db2.gz RCGGTLPKMPCNKY-OLZOCXBDSA-N 1 1 341.839 2.838 10 5 EFBEMO CC[C@H]1CN(c2c(C)cc([N+](=O)[O-])cc2Cl)CC[N@H+]1C[C@@H](C)O ZINC000302688714 311196658 /nfs/dbraw/zinc/19/66/58/311196658.db2.gz RCGGTLPKMPCNKY-OLZOCXBDSA-N 1 1 341.839 2.838 10 5 EFBEMO Cc1ccccc1OC[C@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000305443225 311223163 /nfs/dbraw/zinc/22/31/63/311223163.db2.gz NXTBCRVYRRTTHD-MRXNPFEDSA-N 1 1 342.395 2.701 10 5 EFBEMO Cc1ccccc1OC[C@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000305443225 311223165 /nfs/dbraw/zinc/22/31/65/311223165.db2.gz NXTBCRVYRRTTHD-MRXNPFEDSA-N 1 1 342.395 2.701 10 5 EFBEMO CCC[C@H](C)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000330650757 311326874 /nfs/dbraw/zinc/32/68/74/311326874.db2.gz HRXOBWYLIBLMEX-LBPRGKRZSA-N 1 1 325.434 2.850 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000330708156 311330213 /nfs/dbraw/zinc/33/02/13/311330213.db2.gz NJFCEAWROYBCOX-DAXOMENPSA-N 1 1 349.431 2.651 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000330708156 311330214 /nfs/dbraw/zinc/33/02/14/311330214.db2.gz NJFCEAWROYBCOX-DAXOMENPSA-N 1 1 349.431 2.651 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000330708157 311330311 /nfs/dbraw/zinc/33/03/11/311330311.db2.gz NJFCEAWROYBCOX-KCXAZCMYSA-N 1 1 349.431 2.651 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000330708157 311330312 /nfs/dbraw/zinc/33/03/12/311330312.db2.gz NJFCEAWROYBCOX-KCXAZCMYSA-N 1 1 349.431 2.651 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)C[C@@H]1C(C)C ZINC000331258190 311363320 /nfs/dbraw/zinc/36/33/20/311363320.db2.gz FHOJJIQHWGVHPU-CQSZACIVSA-N 1 1 339.823 2.969 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C)C[C@@H]1C(C)C ZINC000331258190 311363322 /nfs/dbraw/zinc/36/33/22/311363322.db2.gz FHOJJIQHWGVHPU-CQSZACIVSA-N 1 1 339.823 2.969 10 5 EFBEMO CC[NH+](CC)Cc1nc(-c2ccc([N+](=O)[O-])c3c2CCCN3)no1 ZINC000453237537 312883739 /nfs/dbraw/zinc/88/37/39/312883739.db2.gz MYLANUGXDWCAGY-UHFFFAOYSA-N 1 1 331.376 2.845 10 5 EFBEMO CCN1C[C@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1=O ZINC000453375611 312894753 /nfs/dbraw/zinc/89/47/53/312894753.db2.gz XHDAVPJREZUBJO-VQIMIIECSA-N 1 1 339.395 2.895 10 5 EFBEMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cc(F)cc(F)c1 ZINC000549173789 318168208 /nfs/dbraw/zinc/16/82/08/318168208.db2.gz VILGEYWGCNUEEG-UHFFFAOYSA-N 1 1 349.337 2.986 10 5 EFBEMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cc(F)cc(F)c1 ZINC000549173789 318168210 /nfs/dbraw/zinc/16/82/10/318168210.db2.gz VILGEYWGCNUEEG-UHFFFAOYSA-N 1 1 349.337 2.986 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC[C@H]3C3(O)CC3)n2)cc1 ZINC000568363820 319275640 /nfs/dbraw/zinc/27/56/40/319275640.db2.gz LAQFKPYLDWZYSR-AWEZNQCLSA-N 1 1 344.371 2.524 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)C(C)(C)C1 ZINC000576290790 320002496 /nfs/dbraw/zinc/00/24/96/320002496.db2.gz PMSRYDNZGKNRIG-UHFFFAOYSA-N 1 1 325.796 2.723 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C)C(C)(C)C1 ZINC000576290790 320002497 /nfs/dbraw/zinc/00/24/97/320002497.db2.gz PMSRYDNZGKNRIG-UHFFFAOYSA-N 1 1 325.796 2.723 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184452570 323364576 /nfs/dbraw/zinc/36/45/76/323364576.db2.gz XQUQRSMVSKSSMT-JSGCOSHPSA-N 1 1 337.395 2.780 10 5 EFBEMO CCn1cnnc1[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000161264606 473221406 /nfs/dbraw/zinc/22/14/06/473221406.db2.gz QRDFNBPUPOUHDD-HNNXBMFYSA-N 1 1 329.404 2.628 10 5 EFBEMO CC[N@H+]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000112076025 473241135 /nfs/dbraw/zinc/24/11/35/473241135.db2.gz KMIRUIVPGRJZJI-OAHLLOKOSA-N 1 1 346.431 2.727 10 5 EFBEMO CCOc1ccc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000124482025 473250926 /nfs/dbraw/zinc/25/09/26/473250926.db2.gz JAQVMDFJLWNPFI-OCCSQVGLSA-N 1 1 335.404 2.548 10 5 EFBEMO C[C@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1C ZINC000124514749 473254677 /nfs/dbraw/zinc/25/46/77/473254677.db2.gz CHCQVIIJJAZKRD-WDEREUQCSA-N 1 1 325.796 2.803 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000124573130 473265854 /nfs/dbraw/zinc/26/58/54/473265854.db2.gz YNDLMYCBWJDULQ-JQWIXIFHSA-N 1 1 325.796 2.803 10 5 EFBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000177196794 473328143 /nfs/dbraw/zinc/32/81/43/473328143.db2.gz BUJLBMMSBQUHBZ-OAHLLOKOSA-N 1 1 328.372 2.713 10 5 EFBEMO O=C1C[C@@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(Cl)c([N+](=O)[O-])c2)CN1 ZINC000124986702 473336021 /nfs/dbraw/zinc/33/60/21/473336021.db2.gz YGHRVISJZHJHSY-OCCSQVGLSA-N 1 1 337.807 2.739 10 5 EFBEMO O=C1C[C@@H]([C@H]2CCCC[N@@H+]2Cc2ccc(Cl)c([N+](=O)[O-])c2)CN1 ZINC000124986428 473336526 /nfs/dbraw/zinc/33/65/26/473336526.db2.gz YGHRVISJZHJHSY-TZMCWYRMSA-N 1 1 337.807 2.739 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000125195163 473372421 /nfs/dbraw/zinc/37/24/21/473372421.db2.gz AEVKNLXWPDJVFK-CJNGLKHVSA-N 1 1 333.432 2.634 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2C)c1 ZINC000113233309 473374043 /nfs/dbraw/zinc/37/40/43/473374043.db2.gz RIYRGDKRQRKRFH-NWDGAFQWSA-N 1 1 335.429 2.625 10 5 EFBEMO COc1cc(C)[nH+]c(CN2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000459623326 478014353 /nfs/dbraw/zinc/01/43/53/478014353.db2.gz QWQNROZMLVTUFE-UHFFFAOYSA-N 1 1 329.356 2.570 10 5 EFBEMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCN(C[C@@H]2CCCC[N@H+]2C)CC1 ZINC000075718686 472188999 /nfs/dbraw/zinc/18/89/99/472188999.db2.gz BFKBLJBTCJFVLQ-SJORKVTESA-N 1 1 346.475 2.758 10 5 EFBEMO CNC(=O)c1ccc(NCC[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000068996786 472275665 /nfs/dbraw/zinc/27/56/65/472275665.db2.gz BVNFAEPNFRWPJO-UHFFFAOYSA-N 1 1 334.420 2.631 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)CCNc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000076486765 472354300 /nfs/dbraw/zinc/35/43/00/472354300.db2.gz OIPFCRZJCWKAKF-ZBFHGGJFSA-N 1 1 348.447 2.586 10 5 EFBEMO Cc1ccc(N2CCC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)nn1 ZINC000089652352 472479887 /nfs/dbraw/zinc/47/98/87/472479887.db2.gz QNTHNVZFQZTPGF-HNNXBMFYSA-N 1 1 341.415 2.967 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nc(CN3CC[N@H+]4CCCC[C@@H]4C3)co2)cc1 ZINC000089912594 472544133 /nfs/dbraw/zinc/54/41/33/472544133.db2.gz ZTMFHDDTQFKDMI-QGZVFWFLSA-N 1 1 342.399 2.920 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000129734577 472563060 /nfs/dbraw/zinc/56/30/60/472563060.db2.gz GIDBOTILOIMKEC-ABAIWWIYSA-N 1 1 332.404 2.620 10 5 EFBEMO C[C@@H]1CCC[N@@H+](CCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000119887318 472597010 /nfs/dbraw/zinc/59/70/10/472597010.db2.gz KFKSUOLLWJFWGR-GFCCVEGCSA-N 1 1 330.388 2.538 10 5 EFBEMO CCOc1ccc(C(=O)NCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000046859433 472611602 /nfs/dbraw/zinc/61/16/02/472611602.db2.gz QMOMFYMDLNUFJA-ZDUSSCGKSA-N 1 1 335.404 2.598 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1Cc1cccc(F)c1 ZINC000090517878 472628644 /nfs/dbraw/zinc/62/86/44/472628644.db2.gz YFWHOOWWXKBLBA-MRXNPFEDSA-N 1 1 345.374 2.603 10 5 EFBEMO CC[C@H](NC(=O)NC[C@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000090526910 472630761 /nfs/dbraw/zinc/63/07/61/472630761.db2.gz HEKYHIJCLCFZMP-DYVFJYSZSA-N 1 1 346.431 2.829 10 5 EFBEMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000156009752 472654857 /nfs/dbraw/zinc/65/48/57/472654857.db2.gz UUJJLFOFARXCEJ-CYBMUJFWSA-N 1 1 344.415 2.926 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000047145280 472659840 /nfs/dbraw/zinc/65/98/40/472659840.db2.gz GTVGBHULUYNHEX-CYBMUJFWSA-N 1 1 346.431 2.773 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1C[C@@H]2CCC[N@@H+]2C[C@@H]1C ZINC000120841520 472755077 /nfs/dbraw/zinc/75/50/77/472755077.db2.gz FJQBUTPRRSAUIN-JSGCOSHPSA-N 1 1 332.404 2.912 10 5 EFBEMO Cc1nc(C)n(C[C@H]2CCC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)n1 ZINC000105885630 472797658 /nfs/dbraw/zinc/79/76/58/472797658.db2.gz KSYOFJSVQZXQSB-AWEZNQCLSA-N 1 1 347.394 2.854 10 5 EFBEMO Cc1nc(C)n(C[C@H]2CCC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)n1 ZINC000105885630 472797665 /nfs/dbraw/zinc/79/76/65/472797665.db2.gz KSYOFJSVQZXQSB-AWEZNQCLSA-N 1 1 347.394 2.854 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000063812611 472816315 /nfs/dbraw/zinc/81/63/15/472816315.db2.gz CHCHUPQBQKVZFY-LBPRGKRZSA-N 1 1 330.388 2.680 10 5 EFBEMO Cc1cnc(CC[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)s1 ZINC000157782112 472859036 /nfs/dbraw/zinc/85/90/36/472859036.db2.gz UBLGBKKZXRNXJP-UHFFFAOYSA-N 1 1 348.428 2.863 10 5 EFBEMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000157828422 472863410 /nfs/dbraw/zinc/86/34/10/472863410.db2.gz HHPXJRSCRHEDLR-LLVKDONJSA-N 1 1 341.358 2.723 10 5 EFBEMO CCC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1CCCCO1 ZINC000106867585 472902981 /nfs/dbraw/zinc/90/29/81/472902981.db2.gz JWVXHVJMYBSGSJ-AWEZNQCLSA-N 1 1 335.404 2.814 10 5 EFBEMO CCC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1CCCCO1 ZINC000106867585 472902987 /nfs/dbraw/zinc/90/29/87/472902987.db2.gz JWVXHVJMYBSGSJ-AWEZNQCLSA-N 1 1 335.404 2.814 10 5 EFBEMO COc1cc(C[N@@H+](C[C@@H](C)O)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000107042470 472921847 /nfs/dbraw/zinc/92/18/47/472921847.db2.gz OHRYWEPIESZDIF-SNVBAGLBSA-N 1 1 348.346 2.796 10 5 EFBEMO C[C@H](NC(=O)NCC[N@H+]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000079983752 472953134 /nfs/dbraw/zinc/95/31/34/472953134.db2.gz CWXCNFMGEFDQFZ-KBPBESRZSA-N 1 1 334.420 2.829 10 5 EFBEMO Cc1cccc(C(=O)N2CCC(Cc3[nH+]ccn3C)CC2)c1[N+](=O)[O-] ZINC000122042924 472968899 /nfs/dbraw/zinc/96/88/99/472968899.db2.gz XOVLFAYVMVDXJM-UHFFFAOYSA-N 1 1 342.399 2.732 10 5 EFBEMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)C[C@@H](O)COCc1ccccc1 ZINC000074289414 472978386 /nfs/dbraw/zinc/97/83/86/472978386.db2.gz YLUZZSBSYCBUQK-OAHLLOKOSA-N 1 1 336.413 2.666 10 5 EFBEMO C[N@H+](Cc1csc([N+](=O)[O-])c1)C[C@@H](O)COCc1ccccc1 ZINC000074289414 472978392 /nfs/dbraw/zinc/97/83/92/472978392.db2.gz YLUZZSBSYCBUQK-OAHLLOKOSA-N 1 1 336.413 2.666 10 5 EFBEMO C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000159566803 473039948 /nfs/dbraw/zinc/03/99/48/473039948.db2.gz DNJJNYNDOGQESE-GXTWGEPZSA-N 1 1 343.383 2.941 10 5 EFBEMO O=C1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCN1 ZINC000093101437 473043375 /nfs/dbraw/zinc/04/33/75/473043375.db2.gz CQCXFNSTCIHWME-UHFFFAOYSA-N 1 1 349.774 2.830 10 5 EFBEMO C[N@H+]1CCC[C@@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000051377027 473044466 /nfs/dbraw/zinc/04/44/66/473044466.db2.gz IOFMOWXAENXHBM-GFCCVEGCSA-N 1 1 346.412 2.542 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N[C@H]2C[N@@H+](C(C)C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000122817854 473062174 /nfs/dbraw/zinc/06/21/74/473062174.db2.gz RAAWDAGIYVCTRE-DZKIICNBSA-N 1 1 348.447 2.992 10 5 EFBEMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@]3(O)CCCC[C@@H]3C2)cc1 ZINC000160752405 473171511 /nfs/dbraw/zinc/17/15/11/473171511.db2.gz JURNTKDXBWKOMS-QAPCUYQASA-N 1 1 334.416 2.991 10 5 EFBEMO CCOCC[N@H+]1CCN(c2cccc(OC)c2[N+](=O)[O-])C[C@@H]1CC ZINC000185365923 473406724 /nfs/dbraw/zinc/40/67/24/473406724.db2.gz SNRYDXDRBKJMPY-AWEZNQCLSA-N 1 1 337.420 2.541 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000185425300 473424155 /nfs/dbraw/zinc/42/41/55/473424155.db2.gz PPXATGXITUQOEH-VOMSXAGXSA-N 1 1 329.400 2.599 10 5 EFBEMO CCC[C@H]([NH2+]C[C@H](O)CN1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000151300239 473440593 /nfs/dbraw/zinc/44/05/93/473440593.db2.gz YPHNVVDQEQZIOB-ROUUACIJSA-N 1 1 335.448 2.872 10 5 EFBEMO CC1(C)C[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC2(CCCC2)O1 ZINC000190979341 473446965 /nfs/dbraw/zinc/44/69/65/473446965.db2.gz JKQAYWFRXRNUHR-UHFFFAOYSA-N 1 1 347.415 2.617 10 5 EFBEMO CC1(C)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC2(CCCC2)O1 ZINC000190979341 473446970 /nfs/dbraw/zinc/44/69/70/473446970.db2.gz JKQAYWFRXRNUHR-UHFFFAOYSA-N 1 1 347.415 2.617 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H](Cn3cncn3)C2)c1 ZINC000172180009 473542549 /nfs/dbraw/zinc/54/25/49/473542549.db2.gz PYVGCDIGKYFYOW-LBPRGKRZSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H](Cn3cncn3)C2)c1 ZINC000172180009 473542554 /nfs/dbraw/zinc/54/25/54/473542554.db2.gz PYVGCDIGKYFYOW-LBPRGKRZSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](c3nncn3C3CC3)C2)cs1 ZINC000152474544 473567422 /nfs/dbraw/zinc/56/74/22/473567422.db2.gz ZJKXNBIWJDDSLX-LBPRGKRZSA-N 1 1 333.417 2.962 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](c3nncn3C3CC3)C2)cs1 ZINC000152474544 473567427 /nfs/dbraw/zinc/56/74/27/473567427.db2.gz ZJKXNBIWJDDSLX-LBPRGKRZSA-N 1 1 333.417 2.962 10 5 EFBEMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H](c3cc(F)ccc3F)C2)c1 ZINC000191678750 473568135 /nfs/dbraw/zinc/56/81/35/473568135.db2.gz LDGJJOAWUPYIGR-GFCCVEGCSA-N 1 1 336.342 2.949 10 5 EFBEMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](c3cc(F)ccc3F)C2)c1 ZINC000191678750 473568143 /nfs/dbraw/zinc/56/81/43/473568143.db2.gz LDGJJOAWUPYIGR-GFCCVEGCSA-N 1 1 336.342 2.949 10 5 EFBEMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCO[C@@H](c3cccc(O)c3)C2)cc1 ZINC000127023551 473569293 /nfs/dbraw/zinc/56/92/93/473569293.db2.gz WCMNNSQYYVMCIK-GOSISDBHSA-N 1 1 328.368 2.916 10 5 EFBEMO O=[N+]([O-])c1ccc(CC[N@H+]2CCO[C@@H](c3cccc(O)c3)C2)cc1 ZINC000127023551 473569299 /nfs/dbraw/zinc/56/92/99/473569299.db2.gz WCMNNSQYYVMCIK-GOSISDBHSA-N 1 1 328.368 2.916 10 5 EFBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000127027430 473569585 /nfs/dbraw/zinc/56/95/85/473569585.db2.gz LJIDYEZDJJFEGX-QGZVFWFLSA-N 1 1 342.399 2.724 10 5 EFBEMO CSc1cccc(C(=O)N2CC[N@@H+]3CCCC[C@@H]3C2)c1[N+](=O)[O-] ZINC000186319008 473647527 /nfs/dbraw/zinc/64/75/27/473647527.db2.gz WCKIHRUDWQOHRH-GFCCVEGCSA-N 1 1 335.429 2.627 10 5 EFBEMO CSc1cccc(C(=O)N2CC[N@H+]3CCCC[C@@H]3C2)c1[N+](=O)[O-] ZINC000186319008 473647533 /nfs/dbraw/zinc/64/75/33/473647533.db2.gz WCKIHRUDWQOHRH-GFCCVEGCSA-N 1 1 335.429 2.627 10 5 EFBEMO CCOC(=O)c1nn(C)cc1C[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000186373433 473662415 /nfs/dbraw/zinc/66/24/15/473662415.db2.gz VKUJZVYYSUQDRK-HNNXBMFYSA-N 1 1 346.387 2.746 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000186401100 473669012 /nfs/dbraw/zinc/66/90/12/473669012.db2.gz MAVMQBWYMUEYDJ-WSYSLRRZSA-N 1 1 331.416 2.798 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000186401118 473669336 /nfs/dbraw/zinc/66/93/36/473669336.db2.gz MAVMQBWYMUEYDJ-UKYUDJEDSA-N 1 1 331.416 2.798 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)[C@H](C)C1 ZINC000172765209 473681805 /nfs/dbraw/zinc/68/18/05/473681805.db2.gz UVAQFIIYYQUUDL-DOMZBBRYSA-N 1 1 346.431 2.646 10 5 EFBEMO Cc1ccc([C@H](C)[NH2+]CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)o1 ZINC000192532586 473689627 /nfs/dbraw/zinc/68/96/27/473689627.db2.gz OKHWTLBNSSMHJR-LBPRGKRZSA-N 1 1 329.356 2.736 10 5 EFBEMO Cn1nccc1[C@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000281391796 473705178 /nfs/dbraw/zinc/70/51/78/473705178.db2.gz MYFLTIJUWNGXLN-QGZVFWFLSA-N 1 1 330.388 2.934 10 5 EFBEMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000245619153 473727385 /nfs/dbraw/zinc/72/73/85/473727385.db2.gz WFBOAUCKXGNQFW-JKSUJKDBSA-N 1 1 330.388 2.805 10 5 EFBEMO C[C@H](NC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000245970169 473768935 /nfs/dbraw/zinc/76/89/35/473768935.db2.gz NYALQTLXRURIMD-YSVLISHTSA-N 1 1 346.431 2.782 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H]1c1ccccc1 ZINC000180097797 473797622 /nfs/dbraw/zinc/79/76/22/473797622.db2.gz GJFJDJRYQUCOMM-SJORKVTESA-N 1 1 343.358 2.909 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000180109833 473801704 /nfs/dbraw/zinc/80/17/04/473801704.db2.gz HSOQJKBVQAUOHL-MJGOQNOKSA-N 1 1 339.395 2.699 10 5 EFBEMO CC(C)C(=O)NC[C@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000263684041 473805978 /nfs/dbraw/zinc/80/59/78/473805978.db2.gz FYFZPNGUJPLLFT-GFCCVEGCSA-N 1 1 325.434 2.641 10 5 EFBEMO CC(C)C(=O)NC[C@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000263684041 473805985 /nfs/dbraw/zinc/80/59/85/473805985.db2.gz FYFZPNGUJPLLFT-GFCCVEGCSA-N 1 1 325.434 2.641 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000180186877 473822094 /nfs/dbraw/zinc/82/20/94/473822094.db2.gz MKHXACAEXBAECP-IRXDYDNUSA-N 1 1 325.368 2.770 10 5 EFBEMO CCc1ccc([C@@H]2CCCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000173654230 473907074 /nfs/dbraw/zinc/90/70/74/473907074.db2.gz NECUXBOMNGCQRC-HOCLYGCPSA-N 1 1 348.403 2.535 10 5 EFBEMO C[C@@H]([NH2+]Cc1cccc(N2CCOCC2)n1)c1cccc([N+](=O)[O-])c1 ZINC000274788019 473959341 /nfs/dbraw/zinc/95/93/41/473959341.db2.gz MTHIINOFYXHKSD-CQSZACIVSA-N 1 1 342.399 2.677 10 5 EFBEMO O=[N+]([O-])c1ccc(CC[N@H+]2C[C@@H](c3ccsc3)[C@H](CO)C2)cc1 ZINC000188103016 473982501 /nfs/dbraw/zinc/98/25/01/473982501.db2.gz MNHBFRBIMPAPJK-RDJZCZTQSA-N 1 1 332.425 2.907 10 5 EFBEMO CCOCC[N@H+]1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000246970552 474020141 /nfs/dbraw/zinc/02/01/41/474020141.db2.gz KFTPNEROSYLHPW-CYBMUJFWSA-N 1 1 341.839 2.791 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](C)C1 ZINC000246985406 474024694 /nfs/dbraw/zinc/02/46/94/474024694.db2.gz JWHNRUZRJFNWGH-SUMWQHHRSA-N 1 1 349.431 2.623 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(=O)NCC(F)(F)F)C1 ZINC000275109628 474073567 /nfs/dbraw/zinc/07/35/67/474073567.db2.gz MVISZJIAZXXUPW-PWSUYJOCSA-N 1 1 345.321 2.656 10 5 EFBEMO CC1(C)CO[C@H](c2ccccc2)C[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000174843888 474105552 /nfs/dbraw/zinc/10/55/52/474105552.db2.gz VCYBWUWAVRZLPU-INIZCTEOSA-N 1 1 330.388 2.643 10 5 EFBEMO CC1(C)CO[C@H](c2ccccc2)C[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000174843888 474105557 /nfs/dbraw/zinc/10/55/57/474105557.db2.gz VCYBWUWAVRZLPU-INIZCTEOSA-N 1 1 330.388 2.643 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000247300825 474113026 /nfs/dbraw/zinc/11/30/26/474113026.db2.gz LKKAYALMRMXFHP-ZWNOBZJWSA-N 1 1 325.796 2.707 10 5 EFBEMO C[N@@H+](CCc1ccc(F)cc1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182221104 474126010 /nfs/dbraw/zinc/12/60/10/474126010.db2.gz AAYXFMPSVZPDTM-MRXNPFEDSA-N 1 1 348.374 2.648 10 5 EFBEMO CSc1ccc(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000247448667 474148759 /nfs/dbraw/zinc/14/87/59/474148759.db2.gz SNQFRDMFPXUULG-WCQYABFASA-N 1 1 337.445 2.775 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC3(C2)Oc2ccccc2O3)c1 ZINC000289112404 474153606 /nfs/dbraw/zinc/15/36/06/474153606.db2.gz WFIBYZBQYBLYIH-OAHLLOKOSA-N 1 1 342.351 2.502 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC3(C2)Oc2ccccc2O3)c1 ZINC000289112404 474153612 /nfs/dbraw/zinc/15/36/12/474153612.db2.gz WFIBYZBQYBLYIH-OAHLLOKOSA-N 1 1 342.351 2.502 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)NCCc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000270529892 474157484 /nfs/dbraw/zinc/15/74/84/474157484.db2.gz NZGYTQORVLAKSG-YOEHRIQHSA-N 1 1 348.447 2.509 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCCc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000270529890 474157805 /nfs/dbraw/zinc/15/78/05/474157805.db2.gz NZGYTQORVLAKSG-WMLDXEAASA-N 1 1 348.447 2.509 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCCc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000270529888 474157956 /nfs/dbraw/zinc/15/79/56/474157956.db2.gz NZGYTQORVLAKSG-RHSMWYFYSA-N 1 1 348.447 2.509 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2cnn(C)c2)C1 ZINC000175239981 474168488 /nfs/dbraw/zinc/16/84/88/474168488.db2.gz ZGNPFQFUDIWXAA-CYBMUJFWSA-N 1 1 330.388 2.717 10 5 EFBEMO COc1cc(C(=O)NCC[N@H+]2CCCC[C@H]2C)cc([N+](=O)[O-])c1C ZINC000188730665 474179026 /nfs/dbraw/zinc/17/90/26/474179026.db2.gz YCEZZJZZBKVQRJ-GFCCVEGCSA-N 1 1 335.404 2.516 10 5 EFBEMO Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)o1 ZINC000182588522 474211716 /nfs/dbraw/zinc/21/17/16/474211716.db2.gz UXDVHXIHNCKQLB-DOMZBBRYSA-N 1 1 329.356 2.952 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000175436778 474219263 /nfs/dbraw/zinc/21/92/63/474219263.db2.gz LRVSDNNCTDAHRQ-CHWSQXEVSA-N 1 1 337.807 2.947 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000175438695 474219334 /nfs/dbraw/zinc/21/93/34/474219334.db2.gz ZBSBQTYCSPIYBE-WCQYABFASA-N 1 1 337.807 2.947 10 5 EFBEMO C[N@@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@H]1c1ccccc1 ZINC000247966432 474236029 /nfs/dbraw/zinc/23/60/29/474236029.db2.gz DRXKWPPWBDCTAN-SWLSCSKDSA-N 1 1 331.397 2.832 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@H]1c1ccccc1 ZINC000247966432 474236037 /nfs/dbraw/zinc/23/60/37/474236037.db2.gz DRXKWPPWBDCTAN-SWLSCSKDSA-N 1 1 331.397 2.832 10 5 EFBEMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000265553165 474251142 /nfs/dbraw/zinc/25/11/42/474251142.db2.gz ZBPTYWHFZDPVMA-LBPRGKRZSA-N 1 1 343.387 2.525 10 5 EFBEMO CO[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC[C@H]1C ZINC000189276823 474344549 /nfs/dbraw/zinc/34/45/49/474344549.db2.gz LMVOSVWAAZUQKY-CZUORRHYSA-N 1 1 335.404 2.589 10 5 EFBEMO CO[C@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@H]1C ZINC000189282202 474347374 /nfs/dbraw/zinc/34/73/74/474347374.db2.gz BWFUKSRFATYKSH-RISCZKNCSA-N 1 1 332.360 2.502 10 5 EFBEMO CO[C@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@H]1C ZINC000189282202 474347380 /nfs/dbraw/zinc/34/73/80/474347380.db2.gz BWFUKSRFATYKSH-RISCZKNCSA-N 1 1 332.360 2.502 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000248557245 474356649 /nfs/dbraw/zinc/35/66/49/474356649.db2.gz ILCGXBIGOGJFMM-GUTXKFCHSA-N 1 1 349.406 2.923 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCNC(=O)C[C@@H]1c1ccccc1 ZINC000183289382 474367574 /nfs/dbraw/zinc/36/75/74/474367574.db2.gz HNDAKGLVTNJVHE-GOSISDBHSA-N 1 1 339.395 2.966 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCNC(=O)C[C@@H]1c1ccccc1 ZINC000183289382 474367581 /nfs/dbraw/zinc/36/75/81/474367581.db2.gz HNDAKGLVTNJVHE-GOSISDBHSA-N 1 1 339.395 2.966 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@H](O)COCc1ccccc1 ZINC000183296826 474368453 /nfs/dbraw/zinc/36/84/53/474368453.db2.gz YSAUODZAOUGXEV-LJQANCHMSA-N 1 1 344.411 2.913 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000248611245 474376043 /nfs/dbraw/zinc/37/60/43/474376043.db2.gz XQUQRSMVSKSSMT-TZMCWYRMSA-N 1 1 337.395 2.780 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC[N@H+]1C ZINC000265942496 474394882 /nfs/dbraw/zinc/39/48/82/474394882.db2.gz IFTFJNGYYRAHQC-AAEUAGOBSA-N 1 1 331.372 2.896 10 5 EFBEMO COc1ccc([C@H]2C[C@H](C)[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)cc1 ZINC000176250192 474422015 /nfs/dbraw/zinc/42/20/15/474422015.db2.gz VMLAPKGGPZZRSJ-ZFWWWQNUSA-N 1 1 330.388 2.678 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](C(F)(F)F)[C@@H](CO)C1 ZINC000289797701 474430118 /nfs/dbraw/zinc/43/01/18/474430118.db2.gz SGZOKNOJTPCSLP-TZMCWYRMSA-N 1 1 332.322 2.896 10 5 EFBEMO COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000248798828 474438736 /nfs/dbraw/zinc/43/87/36/474438736.db2.gz FTFJJRGOYCFMHV-JQFCIGGWSA-N 1 1 348.399 2.637 10 5 EFBEMO CO[C@@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[C@H]1C ZINC000249200442 474543649 /nfs/dbraw/zinc/54/36/49/474543649.db2.gz QUOGAXHPABVMES-CXAGYDPISA-N 1 1 344.415 2.852 10 5 EFBEMO CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC[C@H]1C(F)(F)F ZINC000190206942 474563088 /nfs/dbraw/zinc/56/30/88/474563088.db2.gz PWOKOHQGFMYNAY-GFCCVEGCSA-N 1 1 347.337 2.667 10 5 EFBEMO CS(=O)(=O)[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000184663347 474578446 /nfs/dbraw/zinc/57/84/46/474578446.db2.gz DQSTUOXZYIWDGM-ZIAGYGMSSA-N 1 1 346.836 2.694 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@@H](C)C1 ZINC000245435582 474586728 /nfs/dbraw/zinc/58/67/28/474586728.db2.gz QNEKLPRETOXPBT-YOEHRIQHSA-N 1 1 348.447 2.504 10 5 EFBEMO C[N@H+]1CC[C@@H](CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000277689714 474592914 /nfs/dbraw/zinc/59/29/14/474592914.db2.gz GNWNOFNINXDLTH-ZDUSSCGKSA-N 1 1 335.407 2.775 10 5 EFBEMO CC[N@H+]1CCC[C@H](NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000249614847 474600427 /nfs/dbraw/zinc/60/04/27/474600427.db2.gz ZTQDWMYAAHPSBU-STQMWFEESA-N 1 1 337.445 2.676 10 5 EFBEMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000249918569 474625014 /nfs/dbraw/zinc/62/50/14/474625014.db2.gz YCISQWRTCRLQON-OLZOCXBDSA-N 1 1 344.415 2.926 10 5 EFBEMO CC(C)(C)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1O ZINC000278474256 474653878 /nfs/dbraw/zinc/65/38/78/474653878.db2.gz ICGVYNZRXSSLAU-UKRRQHHQSA-N 1 1 337.376 2.732 10 5 EFBEMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1O ZINC000278474256 474653879 /nfs/dbraw/zinc/65/38/79/474653879.db2.gz ICGVYNZRXSSLAU-UKRRQHHQSA-N 1 1 337.376 2.732 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)Nc2ccncc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000253309276 474720615 /nfs/dbraw/zinc/72/06/15/474720615.db2.gz BXUSZYOKVMWFRR-GOEBONIOSA-N 1 1 341.371 2.557 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(N3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)nc2c1 ZINC000278607589 474733158 /nfs/dbraw/zinc/73/31/58/474733158.db2.gz ZWAGQBPTSODBKT-SJCJKPOMSA-N 1 1 341.415 2.924 10 5 EFBEMO CN(C(=O)C[N@@H+]1CC[C@@H](CC(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000278726848 474799219 /nfs/dbraw/zinc/79/92/19/474799219.db2.gz LAOFTECHVWONBR-NSHDSACASA-N 1 1 345.321 2.832 10 5 EFBEMO CN(C(=O)C[N@H+]1CC[C@@H](CC(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000278726848 474799225 /nfs/dbraw/zinc/79/92/25/474799225.db2.gz LAOFTECHVWONBR-NSHDSACASA-N 1 1 345.321 2.832 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278730601 474801210 /nfs/dbraw/zinc/80/12/10/474801210.db2.gz LDWCRXYYWJRJOY-RYUDHWBXSA-N 1 1 348.321 2.609 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+](C(C)C)[C@H]2CCOC2)cccc1[N+](=O)[O-] ZINC000292029873 474810118 /nfs/dbraw/zinc/81/01/18/474810118.db2.gz YVTHXNBQALYREN-AWEZNQCLSA-N 1 1 335.404 2.731 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+](C(C)C)[C@@H]2CCOC2)cccc1[N+](=O)[O-] ZINC000292029875 474811145 /nfs/dbraw/zinc/81/11/45/474811145.db2.gz YVTHXNBQALYREN-CQSZACIVSA-N 1 1 335.404 2.731 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCCCn1cc[nH+]c1C ZINC000273280026 474820139 /nfs/dbraw/zinc/82/01/39/474820139.db2.gz GRMOQAVIEKQBJR-SEYXRHQNSA-N 1 1 328.372 2.710 10 5 EFBEMO CCc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc1 ZINC000339037644 474864302 /nfs/dbraw/zinc/86/43/02/474864302.db2.gz OSZGQLIZMZHPCQ-HNNXBMFYSA-N 1 1 327.388 2.634 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1 ZINC000273446551 474901328 /nfs/dbraw/zinc/90/13/28/474901328.db2.gz AYHKHAJSWLSAJO-FNDVETGQSA-N 1 1 329.400 2.765 10 5 EFBEMO CC(C)[N@H+]1CC[C@H](Nc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000268479376 475004893 /nfs/dbraw/zinc/00/48/93/475004893.db2.gz KLKNEGHTWDKTLW-JTQLQIEISA-N 1 1 329.198 2.647 10 5 EFBEMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000285430431 475020826 /nfs/dbraw/zinc/02/08/26/475020826.db2.gz QYYUPFXXUTUNPU-PHIMTYICSA-N 1 1 329.194 2.967 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@H](n3cc(Cl)cn3)C2)ccc1[N+](=O)[O-] ZINC000352415670 475272463 /nfs/dbraw/zinc/27/24/63/475272463.db2.gz OYRZFBYBTVQWOT-ZDUSSCGKSA-N 1 1 336.779 2.900 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@H](n3cc(Cl)cn3)C2)ccc1[N+](=O)[O-] ZINC000352415670 475272470 /nfs/dbraw/zinc/27/24/70/475272470.db2.gz OYRZFBYBTVQWOT-ZDUSSCGKSA-N 1 1 336.779 2.900 10 5 EFBEMO CC[N@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000361239501 475294878 /nfs/dbraw/zinc/29/48/78/475294878.db2.gz VASVBSRFPBVLNJ-LLVKDONJSA-N 1 1 346.330 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ZINC000342058423 475538874 /nfs/dbraw/zinc/53/88/74/475538874.db2.gz JNQOOTLIUOTHHJ-AWEZNQCLSA-N 1 1 335.404 2.550 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000338045915 475541437 /nfs/dbraw/zinc/54/14/37/475541437.db2.gz GEJPASBZKLCOHQ-GUTXKFCHSA-N 1 1 333.432 2.999 10 5 EFBEMO CCNC(=O)[C@H](C)[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000352702256 475546050 /nfs/dbraw/zinc/54/60/50/475546050.db2.gz USDQOIUQGWAFNY-GUYCJALGSA-N 1 1 327.384 2.798 10 5 EFBEMO CCNC(=O)[C@@H](C)[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000352702255 475546552 /nfs/dbraw/zinc/54/65/52/475546552.db2.gz USDQOIUQGWAFNY-DYVFJYSZSA-N 1 1 327.384 2.798 10 5 EFBEMO CN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000348428478 475661264 /nfs/dbraw/zinc/66/12/64/475661264.db2.gz OEQFTKUOUBQCAA-GFCCVEGCSA-N 1 1 338.795 2.949 10 5 EFBEMO CC[C@@H](NC(=O)C[N@@H+](C)[C@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000339990913 475666423 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C[C@H](c1ccccc1)[C@H](O)C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000450690436 477683562 /nfs/dbraw/zinc/68/35/62/477683562.db2.gz GVINFEXKANHVAZ-FZKQIMNGSA-N 1 1 327.384 2.513 10 5 EFBEMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cn1 ZINC000377226939 477700983 /nfs/dbraw/zinc/70/09/83/477700983.db2.gz UAQCSVAIDWKCAZ-CQSZACIVSA-N 1 1 332.404 2.517 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@H](CO)C2)ccc1Br ZINC000377243121 477706912 /nfs/dbraw/zinc/70/69/12/477706912.db2.gz UGGZXNCRYHCNKG-LBPRGKRZSA-N 1 1 343.221 2.952 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@H](CO)C2)ccc1Br ZINC000377243121 477706919 /nfs/dbraw/zinc/70/69/19/477706919.db2.gz UGGZXNCRYHCNKG-LBPRGKRZSA-N 1 1 343.221 2.952 10 5 EFBEMO CN(C)c1nc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc[nH+]1 ZINC000450769051 477711259 /nfs/dbraw/zinc/71/12/59/477711259.db2.gz VSKILNSYHRKAOM-CQSZACIVSA-N 1 1 327.388 2.835 10 5 EFBEMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000438483199 477848644 /nfs/dbraw/zinc/84/86/44/477848644.db2.gz CURNXMZLOYGCMK-STQMWFEESA-N 1 1 335.404 2.908 10 5 EFBEMO COc1ccc(NC(=O)CC[N@H+]2CC[C@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000438494240 477851755 /nfs/dbraw/zinc/85/17/55/477851755.db2.gz NDQQGQYCIIUCOX-ZDUSSCGKSA-N 1 1 335.404 2.910 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[N@@H+](CC)C[C@H]2CC)cc1[N+](=O)[O-] ZINC000456348037 477876915 /nfs/dbraw/zinc/87/69/15/477876915.db2.gz KCQXVTYQXPEZMI-CQSZACIVSA-N 1 1 335.404 2.550 10 5 EFBEMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000456354390 477882247 /nfs/dbraw/zinc/88/22/47/477882247.db2.gz PDWHPWCSTVJZRF-LBPRGKRZSA-N 1 1 330.388 2.632 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@H](O)CC34CCC4)n2)cc1 ZINC000420990184 477883242 /nfs/dbraw/zinc/88/32/42/477883242.db2.gz DUPCXWCRDXGSSV-AWEZNQCLSA-N 1 1 344.371 2.524 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@H](O)CC34CCC4)n2)cc1 ZINC000420990184 477883251 /nfs/dbraw/zinc/88/32/51/477883251.db2.gz DUPCXWCRDXGSSV-AWEZNQCLSA-N 1 1 344.371 2.524 10 5 EFBEMO NC(=O)C[C@@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000559071272 477955778 /nfs/dbraw/zinc/95/57/78/477955778.db2.gz NNHHUPNDZULMPH-NSHDSACASA-N 1 1 345.321 2.844 10 5 EFBEMO NC(=O)C[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000559071272 477955789 /nfs/dbraw/zinc/95/57/89/477955789.db2.gz NNHHUPNDZULMPH-NSHDSACASA-N 1 1 345.321 2.844 10 5 EFBEMO C[C@@H]([NH2+][C@H]1COCC1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000451812785 478212874 /nfs/dbraw/zinc/21/28/74/478212874.db2.gz UKZNQTCETWDVTO-MFKMUULPSA-N 1 1 332.360 2.720 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451854587 478225008 /nfs/dbraw/zinc/22/50/08/478225008.db2.gz NQBILIKHLXLKAN-MRXNPFEDSA-N 1 1 329.356 2.577 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451854587 478225012 /nfs/dbraw/zinc/22/50/12/478225012.db2.gz NQBILIKHLXLKAN-MRXNPFEDSA-N 1 1 329.356 2.577 10 5 EFBEMO COC[C@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000590663895 478279268 /nfs/dbraw/zinc/27/92/68/478279268.db2.gz AFJAJEKVKURDRF-ZDUSSCGKSA-N 1 1 336.388 2.615 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](OC)C(C)(C)C2)c1 ZINC000590659231 478279420 /nfs/dbraw/zinc/27/94/20/478279420.db2.gz JWHPEJAGZGVJQW-OAHLLOKOSA-N 1 1 336.388 2.628 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](OC)C(C)(C)C2)c1 ZINC000590659231 478279425 /nfs/dbraw/zinc/27/94/25/478279425.db2.gz JWHPEJAGZGVJQW-OAHLLOKOSA-N 1 1 336.388 2.628 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@H]2C[C@H](OC)C23CCC3)c1 ZINC000590661489 478279744 /nfs/dbraw/zinc/27/97/44/478279744.db2.gz ZFQWDHZEMXJWAE-HOTGVXAUSA-N 1 1 348.399 2.771 10 5 EFBEMO CC(C)c1n[nH]c(C(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000600228964 478297916 /nfs/dbraw/zinc/29/79/16/478297916.db2.gz IHSVBGLATSMGHX-CYBMUJFWSA-N 1 1 349.435 2.578 10 5 EFBEMO COc1cc(C(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000600229096 478298251 /nfs/dbraw/zinc/29/82/51/478298251.db2.gz OZCBNUMMASWHDD-OAHLLOKOSA-N 1 1 347.415 2.740 10 5 EFBEMO CNc1ccc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000600228396 478299648 /nfs/dbraw/zinc/29/96/48/478299648.db2.gz LDIHBASJLGFDFY-HNNXBMFYSA-N 1 1 346.431 2.773 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000600229989 478300723 /nfs/dbraw/zinc/30/07/23/478300723.db2.gz MSLYPRCYVLEYHU-HNNXBMFYSA-N 1 1 347.415 2.740 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000570277437 478325228 /nfs/dbraw/zinc/32/52/28/478325228.db2.gz BTDRJAWFPJKLIQ-UHFFFAOYSA-N 1 1 326.360 2.818 10 5 EFBEMO C[N@H+]1CCC[C@@H](NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000590808390 478348543 /nfs/dbraw/zinc/34/85/43/478348543.db2.gz OFLCPFWSEZOVRT-HZPDHXFCSA-N 1 1 346.431 2.578 10 5 EFBEMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000594417198 478374917 /nfs/dbraw/zinc/37/49/17/478374917.db2.gz AXOZHQNFEIVFGW-SJORKVTESA-N 1 1 342.399 2.823 10 5 EFBEMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000600473125 478383732 /nfs/dbraw/zinc/38/37/32/478383732.db2.gz QZYWHYCOYNNXSN-CYBMUJFWSA-N 1 1 342.399 2.823 10 5 EFBEMO C[C@@H](C(=O)NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000600474528 478385119 /nfs/dbraw/zinc/38/51/19/478385119.db2.gz XWRQZZPLFLCOKX-IUODEOHRSA-N 1 1 349.406 2.971 10 5 EFBEMO C[C@H](C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000600474530 478385183 /nfs/dbraw/zinc/38/51/83/478385183.db2.gz XWRQZZPLFLCOKX-WFASDCNBSA-N 1 1 349.406 2.971 10 5 EFBEMO CC(C)(C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1)c1ccccc1[N+](=O)[O-] ZINC000597581833 478420071 /nfs/dbraw/zinc/42/00/71/478420071.db2.gz RMXIMCZJUCXFRV-GDBMZVCRSA-N 1 1 349.406 2.517 10 5 EFBEMO CCOC[C@H]1CCCC[N@@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000590971085 478422842 /nfs/dbraw/zinc/42/28/42/478422842.db2.gz NAGUVOZLGHMYTL-OAHLLOKOSA-N 1 1 336.388 2.772 10 5 EFBEMO CCOC[C@H]1CCCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000590971085 478422849 /nfs/dbraw/zinc/42/28/49/478422849.db2.gz NAGUVOZLGHMYTL-OAHLLOKOSA-N 1 1 336.388 2.772 10 5 EFBEMO COCc1cc([N+](=O)[O-])ccc1NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594591762 478452920 /nfs/dbraw/zinc/45/29/20/478452920.db2.gz JONAUCXRORIOEK-MCIONIFRSA-N 1 1 337.420 2.651 10 5 EFBEMO COCc1cc([N+](=O)[O-])ccc1NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594591762 478452928 /nfs/dbraw/zinc/45/29/28/478452928.db2.gz JONAUCXRORIOEK-MCIONIFRSA-N 1 1 337.420 2.651 10 5 EFBEMO C[NH2+]CCOCCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000600708746 478479112 /nfs/dbraw/zinc/47/91/12/478479112.db2.gz FPIPSMQINCQGAB-SFHVURJKSA-N 1 1 329.400 2.510 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000597856884 478543123 /nfs/dbraw/zinc/54/31/23/478543123.db2.gz CDMVFTYIUMARLV-NSHDSACASA-N 1 1 330.388 2.679 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000600965345 478589303 /nfs/dbraw/zinc/58/93/03/478589303.db2.gz NQTKWEWCJMBCMY-MRXNPFEDSA-N 1 1 331.416 2.617 10 5 EFBEMO CCN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@@H]1CC[N@@H+](C)C1 ZINC000597946632 478590811 /nfs/dbraw/zinc/59/08/11/478590811.db2.gz QYABGZLGCRLBPQ-CYBMUJFWSA-N 1 1 333.413 2.976 10 5 EFBEMO CC[N@H+]1CCC[C@H](CNC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000601021165 478618636 /nfs/dbraw/zinc/61/86/36/478618636.db2.gz SMPWCNVYCBEDQZ-OAHLLOKOSA-N 1 1 345.443 2.865 10 5 EFBEMO C[C@H]([NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1nccn1C ZINC000594995995 478622399 /nfs/dbraw/zinc/62/23/99/478622399.db2.gz PXGAVLLPCSJYAU-LBPRGKRZSA-N 1 1 340.387 2.580 10 5 EFBEMO CCN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598039461 478626870 /nfs/dbraw/zinc/62/68/70/478626870.db2.gz KHYXSMDAMFWTJB-MRXNPFEDSA-N 1 1 347.415 2.500 10 5 EFBEMO CCN(C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1CC[N@@H+](CC)C1 ZINC000598039647 478627461 /nfs/dbraw/zinc/62/74/61/478627461.db2.gz LOEHVXDZQIRAKS-HNNXBMFYSA-N 1 1 344.415 2.561 10 5 EFBEMO CCN(C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CC[N@@H+](CC)C1 ZINC000598039648 478627509 /nfs/dbraw/zinc/62/75/09/478627509.db2.gz LOEHVXDZQIRAKS-OAHLLOKOSA-N 1 1 344.415 2.561 10 5 EFBEMO CCN(C(=O)CCOc1cc(C)ccc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1 ZINC000598039865 478627570 /nfs/dbraw/zinc/62/75/70/478627570.db2.gz AWASTIAUHXGOJW-HNNXBMFYSA-N 1 1 349.431 2.615 10 5 EFBEMO CCN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598041817 478628344 /nfs/dbraw/zinc/62/83/44/478628344.db2.gz NJNKKFCSIUOBBV-OAHLLOKOSA-N 1 1 346.431 2.725 10 5 EFBEMO CCN(C(=O)c1ccc(SC)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598042591 478629028 /nfs/dbraw/zinc/62/90/28/478629028.db2.gz QFESTLYMMJUPTP-CYBMUJFWSA-N 1 1 337.445 2.873 10 5 EFBEMO CCO[C@H]1C[C@H]([NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000595066223 478647522 /nfs/dbraw/zinc/64/75/22/478647522.db2.gz GMSVFNMEAKQIFG-BPUTZDHNSA-N 1 1 330.388 2.575 10 5 EFBEMO CN(CC[C@@H]1CCCC[N@H+]1C)c1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601120482 478668281 /nfs/dbraw/zinc/66/82/81/478668281.db2.gz HFSGHLUSVGFHJL-JTQLQIEISA-N 1 1 349.357 2.658 10 5 EFBEMO CC(C)C[N@H+]1CC[C@H](CNc2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC000601129321 478674163 /nfs/dbraw/zinc/67/41/63/478674163.db2.gz QDHYQGGQNOSUKD-SNVBAGLBSA-N 1 1 349.357 2.737 10 5 EFBEMO COc1ccc(F)c(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c1 ZINC000601150310 478688850 /nfs/dbraw/zinc/68/88/50/478688850.db2.gz VGCPZPYBGLJYIV-KRWDZBQOSA-N 1 1 334.347 2.740 10 5 EFBEMO COc1cccc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c1OC ZINC000601150047 478689912 /nfs/dbraw/zinc/68/99/12/478689912.db2.gz SUSQFRSPWSAQDR-GOSISDBHSA-N 1 1 346.383 2.609 10 5 EFBEMO O=C(N1CC[NH+](C2CCC2)CC1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601170024 478703529 /nfs/dbraw/zinc/70/35/29/478703529.db2.gz JLPBRWCHFXHVBS-UHFFFAOYSA-N 1 1 343.427 2.713 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1 ZINC000601171958 478703931 /nfs/dbraw/zinc/70/39/31/478703931.db2.gz SWVBKKQHUPCFSM-YMTOWFKASA-N 1 1 341.289 2.893 10 5 EFBEMO Cn1cc[nH+]c1[C@H]1CCN(c2nc3c(cc2[N+](=O)[O-])CCCC3)C1 ZINC000591926040 478710434 /nfs/dbraw/zinc/71/04/34/478710434.db2.gz XBJXXVGOAFBZPQ-ZDUSSCGKSA-N 1 1 327.388 2.596 10 5 EFBEMO O=C([C@@H]1CCC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1)N1CCCC1 ZINC000595316454 478728739 /nfs/dbraw/zinc/72/87/39/478728739.db2.gz FQSDPAUECXUENP-CQSZACIVSA-N 1 1 335.379 2.568 10 5 EFBEMO Cc1noc(CN2CC[N@H+](Cc3ccccc3)CC[C@@H]2C)c1[N+](=O)[O-] ZINC000595339659 478738467 /nfs/dbraw/zinc/73/84/67/478738467.db2.gz ZPKBRNMNXSFVAO-AWEZNQCLSA-N 1 1 344.415 2.988 10 5 EFBEMO C[C@@H]1C[C@H](NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)CC[N@H+]1C ZINC000601233244 478738920 /nfs/dbraw/zinc/73/89/20/478738920.db2.gz ZTGLTOWXSOGZMY-UKRRQHHQSA-N 1 1 331.416 2.615 10 5 EFBEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000601260936 478752527 /nfs/dbraw/zinc/75/25/27/478752527.db2.gz WOBYGNPAHBDSDO-HNNXBMFYSA-N 1 1 345.443 2.817 10 5 EFBEMO CO[C@@H](C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CCCC1 ZINC000595373191 478752590 /nfs/dbraw/zinc/75/25/90/478752590.db2.gz XZTXWEHBQDDSKE-ZBFHGGJFSA-N 1 1 334.420 2.681 10 5 EFBEMO COC(=O)c1cc(N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)cc(C)c1[N+](=O)[O-] ZINC000564567616 478762195 /nfs/dbraw/zinc/76/21/95/478762195.db2.gz LRZDZZQWKNATGU-WCQYABFASA-N 1 1 333.388 2.727 10 5 EFBEMO CCC[N@H+]1CC[C@H](NC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000598343410 478777489 /nfs/dbraw/zinc/77/74/89/478777489.db2.gz UMULQXAIEOMYJB-LBPRGKRZSA-N 1 1 325.796 2.771 10 5 EFBEMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601311115 478779743 /nfs/dbraw/zinc/77/97/43/478779743.db2.gz YKGRKMHEYVJBJM-GUYCJALGSA-N 1 1 343.427 2.615 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[N@H+](C(C)(C)C)CC2)c1 ZINC000543902300 478798196 /nfs/dbraw/zinc/79/81/96/478798196.db2.gz MRPUSIVOLYAZEM-UHFFFAOYSA-N 1 1 335.404 2.692 10 5 EFBEMO COc1cc(C[NH2+][C@@H](CCO)c2ccccc2F)ccc1[N+](=O)[O-] ZINC000592162317 478807589 /nfs/dbraw/zinc/80/75/89/478807589.db2.gz VYIHJYDBIMSQRB-HNNXBMFYSA-N 1 1 334.347 2.956 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2c(F)cccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000601382898 478812104 /nfs/dbraw/zinc/81/21/04/478812104.db2.gz IUQOBQRWJNJZGT-PBHICJAKSA-N 1 1 343.358 2.909 10 5 EFBEMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601400326 478820359 /nfs/dbraw/zinc/82/03/59/478820359.db2.gz YLPGDCCGLWCKOY-KBPBESRZSA-N 1 1 331.416 2.568 10 5 EFBEMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601400326 478820363 /nfs/dbraw/zinc/82/03/63/478820363.db2.gz YLPGDCCGLWCKOY-KBPBESRZSA-N 1 1 331.416 2.568 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCC[C@@H]1C1CCC1 ZINC000592200471 478822994 /nfs/dbraw/zinc/82/29/94/478822994.db2.gz YZESVNCEVMKTJF-HZPDHXFCSA-N 1 1 334.416 2.989 10 5 EFBEMO C[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000601410262 478824335 /nfs/dbraw/zinc/82/43/35/478824335.db2.gz JGSLBNIBJUVCJO-ZDUSSCGKSA-N 1 1 345.374 2.984 10 5 EFBEMO C[C@@H](NC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1)C1=CC[N@@H+](C)CC1 ZINC000601421979 478829195 /nfs/dbraw/zinc/82/91/95/478829195.db2.gz NNVVHEHBGOZEFZ-CQSZACIVSA-N 1 1 343.427 2.783 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000598464255 478836502 /nfs/dbraw/zinc/83/65/02/478836502.db2.gz DDSDYKXMLIOGNS-JKSUJKDBSA-N 1 1 333.432 2.935 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000598466428 478837588 /nfs/dbraw/zinc/83/75/88/478837588.db2.gz UEWRBPJROFWCME-UHFFFAOYSA-N 1 1 332.404 2.926 10 5 EFBEMO Cc1noc(C[N@@H+]2CCC[C@H]2COc2cccnc2C)c1[N+](=O)[O-] ZINC000595549384 478849534 /nfs/dbraw/zinc/84/95/34/478849534.db2.gz DOZVAWKCLLHARI-ZDUSSCGKSA-N 1 1 332.360 2.638 10 5 EFBEMO Cc1noc(C[N@H+]2CCC[C@H]2COc2cccnc2C)c1[N+](=O)[O-] ZINC000595549384 478849544 /nfs/dbraw/zinc/84/95/44/478849544.db2.gz DOZVAWKCLLHARI-ZDUSSCGKSA-N 1 1 332.360 2.638 10 5 EFBEMO NC(=O)c1ccc(C[NH+]2CCC(c3ccco3)CC2)c([N+](=O)[O-])c1 ZINC000595614822 478888492 /nfs/dbraw/zinc/88/84/92/478888492.db2.gz ITCZQPPJSRHRAB-UHFFFAOYSA-N 1 1 329.356 2.666 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCO[C@](C)(C3CC3)C2)cccc1[N+](=O)[O-] ZINC000595624800 478896222 /nfs/dbraw/zinc/89/62/22/478896222.db2.gz GNTWXJHXOYKBAS-SFHVURJKSA-N 1 1 347.415 2.733 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@](C)(C2CC2)C1 ZINC000595627215 478899019 /nfs/dbraw/zinc/89/90/19/478899019.db2.gz XCLJFJVEFBSGEF-SFHVURJKSA-N 1 1 347.415 2.733 10 5 EFBEMO CC1(C)C[C@@H]([N@@H+](CCn2cc([N+](=O)[O-])cn2)Cc2ccccc2)CO1 ZINC000595634526 478904102 /nfs/dbraw/zinc/90/41/02/478904102.db2.gz BPKLSSMLJPWCAR-MRXNPFEDSA-N 1 1 344.415 2.861 10 5 EFBEMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C ZINC000595664169 478921997 /nfs/dbraw/zinc/92/19/97/478921997.db2.gz YNBJHLMQBNJSKP-AWEZNQCLSA-N 1 1 334.420 2.609 10 5 EFBEMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601644321 478923881 /nfs/dbraw/zinc/92/38/81/478923881.db2.gz OBKZHOOTAYHHFL-INIZCTEOSA-N 1 1 331.416 2.569 10 5 EFBEMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@@H](CCF)C2)c([N+](=O)[O-])c1 ZINC000595756287 478977797 /nfs/dbraw/zinc/97/77/97/478977797.db2.gz SJCOTRIMYNRCFO-LBPRGKRZSA-N 1 1 339.367 2.614 10 5 EFBEMO COc1ccc(NC(=O)C[N@H+]2CCC[C@@H](CCF)C2)c([N+](=O)[O-])c1 ZINC000595756287 478977805 /nfs/dbraw/zinc/97/78/05/478977805.db2.gz SJCOTRIMYNRCFO-LBPRGKRZSA-N 1 1 339.367 2.614 10 5 EFBEMO COc1cc(C[N@@H+]2CCOC(C3CC3)(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000595822374 479016758 /nfs/dbraw/zinc/01/67/58/479016758.db2.gz SBUXITLYGNYJHT-UHFFFAOYSA-N 1 1 332.400 2.994 10 5 EFBEMO COc1cc(C[N@H+]2CCOC(C3CC3)(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000595822374 479016767 /nfs/dbraw/zinc/01/67/67/479016767.db2.gz SBUXITLYGNYJHT-UHFFFAOYSA-N 1 1 332.400 2.994 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000592751568 479025126 /nfs/dbraw/zinc/02/51/26/479025126.db2.gz ZMTQZVWAXHBCMP-GFCCVEGCSA-N 1 1 346.387 2.630 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000595874632 479043995 /nfs/dbraw/zinc/04/39/95/479043995.db2.gz WZFMSGPUEAZMLT-UHFFFAOYSA-N 1 1 347.419 2.855 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000592793811 479045590 /nfs/dbraw/zinc/04/55/90/479045590.db2.gz ZPKFEMBUERFRNQ-GFCCVEGCSA-N 1 1 330.388 2.930 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1NC ZINC000592826366 479060928 /nfs/dbraw/zinc/06/09/28/479060928.db2.gz QANKNQQOZPNIQD-NSHDSACASA-N 1 1 331.376 2.985 10 5 EFBEMO COc1ccc(C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)cc1[N+](=O)[O-] ZINC000595904477 479062370 /nfs/dbraw/zinc/06/23/70/479062370.db2.gz DJGIODXIDPAYID-HDICACEKSA-N 1 1 332.400 2.996 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595911695 479065650 /nfs/dbraw/zinc/06/56/50/479065650.db2.gz VMFUFYPBGXUMPM-HDICACEKSA-N 1 1 332.400 2.996 10 5 EFBEMO C[C@H](CCN1CC[NH+](C)CC1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000546732248 479066418 /nfs/dbraw/zinc/06/64/18/479066418.db2.gz KFDVRXVNRYLMDB-CQSZACIVSA-N 1 1 343.431 2.581 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000598889086 479074163 /nfs/dbraw/zinc/07/41/63/479074163.db2.gz SWSQVBNPTFWAKO-UHFFFAOYSA-N 1 1 341.383 2.593 10 5 EFBEMO Cc1ccc(C[NH2+]Cc2c(C(F)(F)F)cnn2C)cc1[N+](=O)[O-] ZINC000598989707 479116807 /nfs/dbraw/zinc/11/68/07/479116807.db2.gz QZUBRLOMJIMKCS-UHFFFAOYSA-N 1 1 328.294 2.945 10 5 EFBEMO COCC[N@@H+](C)CCCNc1cc(OC)c([N+](=O)[O-])cc1Cl ZINC000596074109 479122201 /nfs/dbraw/zinc/12/22/01/479122201.db2.gz PGLFSVRMUXKCFE-UHFFFAOYSA-N 1 1 331.800 2.637 10 5 EFBEMO CN(C)CC[NH+]1CCC(Nc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599023825 479131410 /nfs/dbraw/zinc/13/14/10/479131410.db2.gz YRABESCQYUJAPD-UHFFFAOYSA-N 1 1 343.431 2.581 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H](CO)CC(C)(C)C)c1 ZINC000593029709 479133709 /nfs/dbraw/zinc/13/37/09/479133709.db2.gz GGIXFAYVIJWEHC-AWEZNQCLSA-N 1 1 338.404 2.610 10 5 EFBEMO C[C@@H](Nc1ccc2cnccc2c1[N+](=O)[O-])[C@@H](C)[NH+]1CCOCC1 ZINC000599038558 479133839 /nfs/dbraw/zinc/13/38/39/479133839.db2.gz LSACORFHNAUZJZ-CHWSQXEVSA-N 1 1 330.388 2.664 10 5 EFBEMO COC(=O)c1c(Cl)c(NC[C@H]2CCC[N@H+]2C)ccc1[N+](=O)[O-] ZINC000596092954 479134057 /nfs/dbraw/zinc/13/40/57/479134057.db2.gz YIWXFSBBYWIZNJ-SECBINFHSA-N 1 1 327.768 2.541 10 5 EFBEMO COC(=O)c1c(Cl)c(N[C@@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000596092389 479134130 /nfs/dbraw/zinc/13/41/30/479134130.db2.gz VASIEVCMCGWTPG-SECBINFHSA-N 1 1 339.779 2.683 10 5 EFBEMO CC1(C)COCC[N@@H+]1CCNc1ccc2cnccc2c1[N+](=O)[O-] ZINC000599040336 479134823 /nfs/dbraw/zinc/13/48/23/479134823.db2.gz ISLONXZWIMLLKG-UHFFFAOYSA-N 1 1 330.388 2.666 10 5 EFBEMO CC1(C)COCC[N@H+]1CCNc1ccc2cnccc2c1[N+](=O)[O-] ZINC000599040336 479134829 /nfs/dbraw/zinc/13/48/29/479134829.db2.gz ISLONXZWIMLLKG-UHFFFAOYSA-N 1 1 330.388 2.666 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(Cn2c[nH+]c3c2C[C@@H](C)[C@@H](C)C3)c1 ZINC000593031739 479134887 /nfs/dbraw/zinc/13/48/87/479134887.db2.gz LRSWQDQBMQJRLI-NWDGAFQWSA-N 1 1 343.383 2.997 10 5 EFBEMO COc1ccc(NC(=O)CC[N@H+]2CCC23CCCC3)c([N+](=O)[O-])c1 ZINC000593039295 479139125 /nfs/dbraw/zinc/13/91/25/479139125.db2.gz PXDHBXHPGLGJOT-UHFFFAOYSA-N 1 1 333.388 2.951 10 5 EFBEMO C[C@]1(c2cccc(F)c2)CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000593041774 479139961 /nfs/dbraw/zinc/13/99/61/479139961.db2.gz YHIAJVXWVPJKDV-SFHVURJKSA-N 1 1 345.374 2.559 10 5 EFBEMO COc1cc(N2CC[NH+](C3CCC3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596126175 479153716 /nfs/dbraw/zinc/15/37/16/479153716.db2.gz IVYGIPKARRNOBI-UHFFFAOYSA-N 1 1 325.796 2.931 10 5 EFBEMO COC(=O)c1c(Cl)c(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000596146822 479163658 /nfs/dbraw/zinc/16/36/58/479163658.db2.gz QGJPAEBHWFQGSH-VHSXEESVSA-N 1 1 341.795 2.929 10 5 EFBEMO Cc1cn2c([nH+]1)C[C@@H](c1nc(-c3ccc([N+](=O)[O-])cc3)no1)CC2 ZINC000599113257 479165043 /nfs/dbraw/zinc/16/50/43/479165043.db2.gz NBBDPYDDXCUTFA-LBPRGKRZSA-N 1 1 325.328 2.880 10 5 EFBEMO Cc1cn2c([nH+]1)C[C@@H](c1nc(-c3cccc([N+](=O)[O-])c3)no1)CC2 ZINC000599114813 479165930 /nfs/dbraw/zinc/16/59/30/479165930.db2.gz CYCPZTAFHOXUPA-LBPRGKRZSA-N 1 1 325.328 2.880 10 5 EFBEMO Cc1cn2c([nH+]1)C[C@H](c1nc(-c3cccc([N+](=O)[O-])c3)no1)CC2 ZINC000599114812 479166224 /nfs/dbraw/zinc/16/62/24/479166224.db2.gz CYCPZTAFHOXUPA-GFCCVEGCSA-N 1 1 325.328 2.880 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)OCC12CCC2 ZINC000593092354 479169401 /nfs/dbraw/zinc/16/94/01/479169401.db2.gz NGLMQFVFBBPONM-CQSZACIVSA-N 1 1 347.415 2.875 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)OCC12CCC2 ZINC000593093023 479170683 /nfs/dbraw/zinc/17/06/83/479170683.db2.gz QVKZURGYBSZCNM-CQSZACIVSA-N 1 1 347.415 2.875 10 5 EFBEMO COc1cc(N2CC[C@H](c3[nH+]ccn3C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596174187 479180066 /nfs/dbraw/zinc/18/00/66/479180066.db2.gz ITLZHBBMETWZLU-JTQLQIEISA-N 1 1 336.779 2.984 10 5 EFBEMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@H]1c1ccccc1 ZINC000596179227 479182623 /nfs/dbraw/zinc/18/26/23/479182623.db2.gz OPOISLJWYVPQCP-NVXWUHKLSA-N 1 1 340.383 2.551 10 5 EFBEMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@H]1c1ccccc1 ZINC000596179225 479183267 /nfs/dbraw/zinc/18/32/67/479183267.db2.gz OPOISLJWYVPQCP-DOTOQJQBSA-N 1 1 340.383 2.551 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000593115224 479183191 /nfs/dbraw/zinc/18/31/91/479183191.db2.gz AOAKZSVTERIBQW-XHDPSFHLSA-N 1 1 339.342 2.961 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000593115224 479183198 /nfs/dbraw/zinc/18/31/98/479183198.db2.gz AOAKZSVTERIBQW-XHDPSFHLSA-N 1 1 339.342 2.961 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000593115221 479183653 /nfs/dbraw/zinc/18/36/53/479183653.db2.gz AOAKZSVTERIBQW-ABAIWWIYSA-N 1 1 339.342 2.961 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000593115221 479183661 /nfs/dbraw/zinc/18/36/61/479183661.db2.gz AOAKZSVTERIBQW-ABAIWWIYSA-N 1 1 339.342 2.961 10 5 EFBEMO COC(=O)c1c(Cl)c(N2C[C@@H](C)[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000596180042 479184428 /nfs/dbraw/zinc/18/44/28/479184428.db2.gz WSAPUXZSDLQIQH-ZJUUUORDSA-N 1 1 341.795 2.564 10 5 EFBEMO COC(=O)c1c(Cl)c(N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000596180042 479184435 /nfs/dbraw/zinc/18/44/35/479184435.db2.gz WSAPUXZSDLQIQH-ZJUUUORDSA-N 1 1 341.795 2.564 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593119345 479186907 /nfs/dbraw/zinc/18/69/07/479186907.db2.gz WCNMHTHUGWMLHK-OAHLLOKOSA-N 1 1 339.342 2.963 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593119344 479187306 /nfs/dbraw/zinc/18/73/06/479187306.db2.gz WCNMHTHUGWMLHK-HNNXBMFYSA-N 1 1 339.342 2.963 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000593118908 479187452 /nfs/dbraw/zinc/18/74/52/479187452.db2.gz SXHXRUPHYQCHQZ-HNNXBMFYSA-N 1 1 339.342 2.963 10 5 EFBEMO O=c1[nH]cnc2cc(NC[C@@H]3CC[N@H+]3C3CCCC3)c([N+](=O)[O-])cc21 ZINC000599165728 479190879 /nfs/dbraw/zinc/19/08/79/479190879.db2.gz RMVYFQHEQSMNBG-LBPRGKRZSA-N 1 1 343.387 2.672 10 5 EFBEMO Cc1c[nH+]cn1Cc1nc(-c2ccc([N+](=O)[O-])c3c2CCCN3)no1 ZINC000599165430 479191470 /nfs/dbraw/zinc/19/14/70/479191470.db2.gz RWHZXSAKOXXBKI-UHFFFAOYSA-N 1 1 340.343 2.556 10 5 EFBEMO COc1cc(NCCC[N@@H+](C)CCN(C)C)c(Cl)cc1[N+](=O)[O-] ZINC000596235199 479216368 /nfs/dbraw/zinc/21/63/68/479216368.db2.gz TZGSVZBWQUXZID-UHFFFAOYSA-N 1 1 344.843 2.552 10 5 EFBEMO COc1cc(NCCCN(C)CC[NH+](C)C)c(Cl)cc1[N+](=O)[O-] ZINC000596235199 479216376 /nfs/dbraw/zinc/21/63/76/479216376.db2.gz TZGSVZBWQUXZID-UHFFFAOYSA-N 1 1 344.843 2.552 10 5 EFBEMO O=[N+]([O-])c1cccc(Cl)c1N1CCC([N@H+]2CCCOCC2)CC1 ZINC000596268433 479232817 /nfs/dbraw/zinc/23/28/17/479232817.db2.gz KKOVCBBNRMIGPU-UHFFFAOYSA-N 1 1 339.823 2.939 10 5 EFBEMO COc1cc(C(=O)NCCC[N@@H+](C)CC(C)C)cc([N+](=O)[O-])c1C ZINC000593203602 479238035 /nfs/dbraw/zinc/23/80/35/479238035.db2.gz PMXDBMJRLVLSFZ-UHFFFAOYSA-N 1 1 337.420 2.620 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000593206474 479240723 /nfs/dbraw/zinc/24/07/23/479240723.db2.gz TUKNPOXDUQREIW-UHFFFAOYSA-N 1 1 335.448 2.967 10 5 EFBEMO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCCN2Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000593324046 479296409 /nfs/dbraw/zinc/29/64/09/479296409.db2.gz XLRMKDUJDAJVHI-XOKHGSTOSA-N 1 1 337.395 2.595 10 5 EFBEMO CN(CCC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000574570425 479310216 /nfs/dbraw/zinc/31/02/16/479310216.db2.gz MTKWZMUZZOWVBL-UHFFFAOYSA-N 1 1 326.400 2.874 10 5 EFBEMO CN(CCC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000574570425 479310223 /nfs/dbraw/zinc/31/02/23/479310223.db2.gz MTKWZMUZZOWVBL-UHFFFAOYSA-N 1 1 326.400 2.874 10 5 EFBEMO Cc1cc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)ccc1[N+](=O)[O-] ZINC000596514048 479323434 /nfs/dbraw/zinc/32/34/34/479323434.db2.gz GBDIGZDGWWLIRC-IAGOWNOFSA-N 1 1 331.416 2.959 10 5 EFBEMO O=[N+]([O-])c1cc(F)ccc1N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000596514733 479323988 /nfs/dbraw/zinc/32/39/88/479323988.db2.gz BVVAKXHHVBHVMQ-HZPDHXFCSA-N 1 1 335.379 2.789 10 5 EFBEMO CN(C(=O)C[N@H+]1CC[C@H]2CC[C@@H](C1)S2)c1ccc([N+](=O)[O-])cc1 ZINC000599553390 479331127 /nfs/dbraw/zinc/33/11/27/479331127.db2.gz SCLLIEGLUZKLDH-CABCVRRESA-N 1 1 335.429 2.528 10 5 EFBEMO NC(=O)c1ccc(C[NH2+][C@H](c2ccccn2)C2CCC2)c([N+](=O)[O-])c1 ZINC000599572769 479337211 /nfs/dbraw/zinc/33/72/11/479337211.db2.gz BLPVMFVEJCTWSD-KRWDZBQOSA-N 1 1 340.383 2.720 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+](CC3CC3)C2)c1 ZINC000596569624 479343319 /nfs/dbraw/zinc/34/33/19/479343319.db2.gz AHFZTCSWDYJGBG-CQSZACIVSA-N 1 1 347.415 2.915 10 5 EFBEMO C[C@@H](Nc1ccnc2cc([N+](=O)[O-])ccc21)[C@H](C)[NH+]1CCOCC1 ZINC000593461959 479352007 /nfs/dbraw/zinc/35/20/07/479352007.db2.gz WMSCRHHYDLFLBO-OLZOCXBDSA-N 1 1 330.388 2.664 10 5 EFBEMO Cn1ncc2c1CC(C)(C)C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC000596598616 479353336 /nfs/dbraw/zinc/35/33/36/479353336.db2.gz IYGIARMTPFHGIH-UHFFFAOYSA-N 1 1 328.416 2.955 10 5 EFBEMO C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000599627041 479359706 /nfs/dbraw/zinc/35/97/06/479359706.db2.gz VAFVFHXLXPOFEX-JNIYBQFBSA-N 1 1 332.360 2.546 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000593480160 479360636 /nfs/dbraw/zinc/36/06/36/479360636.db2.gz NIDFCKNMZDBKBV-UHFFFAOYSA-N 1 1 348.447 2.877 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@@H]2CCC[C@H]21 ZINC000599648864 479368790 /nfs/dbraw/zinc/36/87/90/479368790.db2.gz BIBCMVRUHLQTNG-YWPYICTPSA-N 1 1 336.363 2.898 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@@H]2CCC[C@H]21 ZINC000599648864 479368792 /nfs/dbraw/zinc/36/87/92/479368792.db2.gz BIBCMVRUHLQTNG-YWPYICTPSA-N 1 1 336.363 2.898 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)[C@@H]2CCC[C@@H]21 ZINC000599656921 479373926 /nfs/dbraw/zinc/37/39/26/479373926.db2.gz JWYIXVWJJXJOJH-IIAWOOMASA-N 1 1 336.363 2.898 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)[C@@H]2CCC[C@@H]21 ZINC000599656921 479373930 /nfs/dbraw/zinc/37/39/30/479373930.db2.gz JWYIXVWJJXJOJH-IIAWOOMASA-N 1 1 336.363 2.898 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@H]2CCC[C@H]21 ZINC000599661170 479376643 /nfs/dbraw/zinc/37/66/43/479376643.db2.gz SKWYYFYTBXWVPY-ZNMIVQPWSA-N 1 1 348.399 2.767 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@@H]21 ZINC000599662775 479377933 /nfs/dbraw/zinc/37/79/33/479377933.db2.gz XJLWZOAQEHGAOZ-ZACQAIPSSA-N 1 1 348.399 2.637 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@H]21 ZINC000599663472 479378766 /nfs/dbraw/zinc/37/87/66/479378766.db2.gz ZXLCPIFJLGTLEK-RRFJBIMHSA-N 1 1 348.399 2.637 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC000599663471 479378785 /nfs/dbraw/zinc/37/87/85/479378785.db2.gz ZXLCPIFJLGTLEK-RBSFLKMASA-N 1 1 348.399 2.637 10 5 EFBEMO O=C1[C@@H]([N@H+]2CCCC3(CC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000599673843 479384129 /nfs/dbraw/zinc/38/41/29/479384129.db2.gz ZPRCDYGKVUVRST-INIZCTEOSA-N 1 1 329.400 2.966 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)CC1 ZINC000588037870 479386509 /nfs/dbraw/zinc/38/65/09/479386509.db2.gz QEJLCSCCPHGXEB-UHFFFAOYSA-N 1 1 338.371 2.884 10 5 EFBEMO COC(=O)C1C[C@@H](C)[NH+](Cc2cc([N+](=O)[O-])ccc2OC)[C@H](C)C1 ZINC000599689877 479393024 /nfs/dbraw/zinc/39/30/24/479393024.db2.gz LDRKJYZSBBFGLF-VXGBXAGGSA-N 1 1 336.388 2.765 10 5 EFBEMO COC(=O)C1C[C@H](C)[NH+](Cc2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1 ZINC000599699731 479397357 /nfs/dbraw/zinc/39/73/57/479397357.db2.gz YTNOABCPCVRNGN-RYUDHWBXSA-N 1 1 336.388 2.765 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000611502428 479397551 /nfs/dbraw/zinc/39/75/51/479397551.db2.gz SEQUOTBPBHYATL-WCQYABFASA-N 1 1 339.367 2.612 10 5 EFBEMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+](C)C1 ZINC000611554635 479413459 /nfs/dbraw/zinc/41/34/59/479413459.db2.gz JJYQWQYWHOQBHU-GFCCVEGCSA-N 1 1 337.445 2.921 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[NH+](Cc3cccs3)CC2)n1 ZINC000611615602 479429378 /nfs/dbraw/zinc/42/93/78/479429378.db2.gz JHAREALNLJDAEQ-UHFFFAOYSA-N 1 1 332.429 2.990 10 5 EFBEMO CC(C)C[N@@H+](C)CCC[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000593717009 479433394 /nfs/dbraw/zinc/43/33/94/479433394.db2.gz XARUPGCEULQOOT-CVEARBPZSA-N 1 1 337.468 2.843 10 5 EFBEMO C[N@H+]1CCC[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599829844 479442728 /nfs/dbraw/zinc/44/27/28/479442728.db2.gz MSNUKFLVBYSELX-LBPRGKRZSA-N 1 1 343.387 2.606 10 5 EFBEMO COc1ccc(NC(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000596833071 479446577 /nfs/dbraw/zinc/44/65/77/479446577.db2.gz VTLYGXSJALNXIK-GFCCVEGCSA-N 1 1 336.392 2.598 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000593754774 479449214 /nfs/dbraw/zinc/44/92/14/479449214.db2.gz OLHLFVGJSPCWKK-UHFFFAOYSA-N 1 1 332.404 2.784 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000618455942 479452893 /nfs/dbraw/zinc/45/28/93/479452893.db2.gz QPAYRLDALLFEKB-ZDUSSCGKSA-N 1 1 337.807 2.771 10 5 EFBEMO COc1cccc([N+](=O)[O-])c1NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000589104555 479478223 /nfs/dbraw/zinc/47/82/23/479478223.db2.gz RAJAHTXVFFBYMS-BETUJISGSA-N 1 1 337.420 2.903 10 5 EFBEMO COc1cccc([N+](=O)[O-])c1NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000589104555 479478230 /nfs/dbraw/zinc/47/82/30/479478230.db2.gz RAJAHTXVFFBYMS-BETUJISGSA-N 1 1 337.420 2.903 10 5 EFBEMO Cc1nccc([C@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000604472759 479523160 /nfs/dbraw/zinc/52/31/60/479523160.db2.gz GSPBLUUHMVSVQX-HNNXBMFYSA-N 1 1 342.399 2.952 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000589502352 479533395 /nfs/dbraw/zinc/53/33/95/479533395.db2.gz VCBDVLPJZFGJDZ-XJKSGUPXSA-N 1 1 349.431 2.544 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(CN(C)CC[C@@H]2CCCC[N@H+]2C)c1 ZINC000589502208 479533453 /nfs/dbraw/zinc/53/34/53/479533453.db2.gz OPCXCXYTXCYJAF-INIZCTEOSA-N 1 1 349.431 2.688 10 5 EFBEMO CCOC[C@@H]1CCC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC000589500009 479534243 /nfs/dbraw/zinc/53/42/43/479534243.db2.gz OYOXBTJPICYFQM-CYBMUJFWSA-N 1 1 336.388 2.630 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](OCC3CC3)C2)c1 ZINC000589514745 479536511 /nfs/dbraw/zinc/53/65/11/479536511.db2.gz KFRFFYULSDXLRL-INIZCTEOSA-N 1 1 348.399 2.772 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](OCC3CC3)C2)c1 ZINC000589514745 479536516 /nfs/dbraw/zinc/53/65/16/479536516.db2.gz KFRFFYULSDXLRL-INIZCTEOSA-N 1 1 348.399 2.772 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)c1 ZINC000589520581 479537673 /nfs/dbraw/zinc/53/76/73/479537673.db2.gz XTBFWORLVYSVHJ-JTQLQIEISA-N 1 1 328.315 2.859 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC(F)(F)[C@@H](C)C2)c1 ZINC000589520581 479537679 /nfs/dbraw/zinc/53/76/79/479537679.db2.gz XTBFWORLVYSVHJ-JTQLQIEISA-N 1 1 328.315 2.859 10 5 EFBEMO Cn1cc(C[N@@H+]2CCC[C@H]2CC(=O)c2ccc(F)cc2)c([N+](=O)[O-])n1 ZINC000602796102 479560012 /nfs/dbraw/zinc/56/00/12/479560012.db2.gz KAJDMXMPTKTWBD-HNNXBMFYSA-N 1 1 346.362 2.705 10 5 EFBEMO Cn1cc(C[N@H+]2CCC[C@H]2CC(=O)c2ccc(F)cc2)c([N+](=O)[O-])n1 ZINC000602796102 479560020 /nfs/dbraw/zinc/56/00/20/479560020.db2.gz KAJDMXMPTKTWBD-HNNXBMFYSA-N 1 1 346.362 2.705 10 5 EFBEMO C[N@@H+]1C[C@H]2[C@@H](CCN2Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590183921 479614823 /nfs/dbraw/zinc/61/48/23/479614823.db2.gz DWIPWEVYHVRPCK-HZMBPMFUSA-N 1 1 329.322 2.750 10 5 EFBEMO C[C@@H](O)[C@@H]([NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccccc1 ZINC000597249693 479644562 /nfs/dbraw/zinc/64/45/62/479644562.db2.gz YDSWCFIFNOBFDT-KZULUSFZSA-N 1 1 344.367 2.578 10 5 EFBEMO C[N@H+]1C[C@H]2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@H]2C1 ZINC000590442472 479648240 /nfs/dbraw/zinc/64/82/40/479648240.db2.gz HEQWABBEYIZQLN-MFKMUULPSA-N 1 1 331.397 2.586 10 5 EFBEMO COC(=O)c1c(Cl)c(N2CC[NH+](C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000590571526 479661455 /nfs/dbraw/zinc/66/14/55/479661455.db2.gz QETOGDAGKAGPEH-UHFFFAOYSA-N 1 1 341.795 2.565 10 5 EFBEMO C[C@H]1CC[N@@H+](CC(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000579244537 479678101 /nfs/dbraw/zinc/67/81/01/479678101.db2.gz ORVYRRPCCGGTDN-BLLLJJGKSA-N 1 1 335.429 2.511 10 5 EFBEMO CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@H](n2c[nH+]c3c2CCCC3)C1 ZINC000619491994 479810588 /nfs/dbraw/zinc/81/05/88/479810588.db2.gz JZGDAKNGUHSZLF-ZDUSSCGKSA-N 1 1 344.419 2.646 10 5 EFBEMO C[C@@H]([NH2+]C1CCN(C[C@@H]2CCCO2)CC1)c1ccccc1[N+](=O)[O-] ZINC000610420515 480302036 /nfs/dbraw/zinc/30/20/36/480302036.db2.gz DMOGHUWAIDIKGW-ZBFHGGJFSA-N 1 1 333.432 2.889 10 5 EFBEMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000610446383 480308366 /nfs/dbraw/zinc/30/83/66/480308366.db2.gz WFXZMQVQNOFLCM-AWEZNQCLSA-N 1 1 342.399 2.660 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)n1 ZINC000614517864 480329499 /nfs/dbraw/zinc/32/94/99/480329499.db2.gz CZNSKXNLKCPOLN-XHSDSOJGSA-N 1 1 348.447 2.685 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)n1 ZINC000614517864 480329504 /nfs/dbraw/zinc/32/95/04/480329504.db2.gz CZNSKXNLKCPOLN-XHSDSOJGSA-N 1 1 348.447 2.685 10 5 EFBEMO C[C@H]1CC[C@](CO)([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000187985280 533772254 /nfs/dbraw/zinc/77/22/54/533772254.db2.gz GMJVPPIOXOWWMY-SJCJKPOMSA-N 1 1 346.387 2.628 10 5 EFBEMO CCOc1ccc(C(=O)N(C)[C@H]2CC[N@@H+](CC)C[C@H]2C)cc1[N+](=O)[O-] ZINC000076490644 520890589 /nfs/dbraw/zinc/89/05/89/520890589.db2.gz LJSJGMJRNGKEHU-HIFRSBDPSA-N 1 1 349.431 2.796 10 5 EFBEMO CCOc1ccc(C(=O)N(C)C[C@@H]2CCC[N@H+]2CC)cc1[N+](=O)[O-] ZINC000176979546 520890731 /nfs/dbraw/zinc/89/07/31/520890731.db2.gz JSQBLQCKKMKKOW-AWEZNQCLSA-N 1 1 335.404 2.550 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)NCC[N@H+]1CCCC[C@H]1C ZINC000156104746 522978730 /nfs/dbraw/zinc/97/87/30/522978730.db2.gz VZBYORIEMIIKJT-GFCCVEGCSA-N 1 1 336.392 2.599 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000245434231 523317911 /nfs/dbraw/zinc/31/79/11/523317911.db2.gz REDNAJYMMKOGTM-GJZGRUSLSA-N 1 1 332.404 2.994 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000245571200 523486334 /nfs/dbraw/zinc/48/63/34/523486334.db2.gz ZBKQNUCXZUNTRP-CABCVRRESA-N 1 1 349.431 2.541 10 5 EFBEMO CCn1cnnc1[C@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000195520205 523607346 /nfs/dbraw/zinc/60/73/46/523607346.db2.gz RISPMFUGTKAFNE-LBPRGKRZSA-N 1 1 333.367 2.725 10 5 EFBEMO CCn1cnnc1[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000195520205 523607356 /nfs/dbraw/zinc/60/73/56/523607356.db2.gz RISPMFUGTKAFNE-LBPRGKRZSA-N 1 1 333.367 2.725 10 5 EFBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000175146873 534777428 /nfs/dbraw/zinc/77/74/28/534777428.db2.gz LUHMZJCHECKPPW-HNNXBMFYSA-N 1 1 329.360 2.796 10 5 EFBEMO Cc1cccc(N2CCC(NC(=O)c3ccc([N+](=O)[O-])cc3)CC2)[nH+]1 ZINC000116670759 524540332 /nfs/dbraw/zinc/54/03/32/524540332.db2.gz GJCMZMGAXGSQKJ-UHFFFAOYSA-N 1 1 340.383 2.697 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@]4(CCOC4)C3)o2)cc1 ZINC000187550115 534881368 /nfs/dbraw/zinc/88/13/68/534881368.db2.gz BOFNRKLWTGMDDC-GOSISDBHSA-N 1 1 344.367 2.846 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@]4(CCOC4)C3)o2)cc1 ZINC000187550115 534881370 /nfs/dbraw/zinc/88/13/70/534881370.db2.gz BOFNRKLWTGMDDC-GOSISDBHSA-N 1 1 344.367 2.846 10 5 EFBEMO Cc1nc(C[C@@H]2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)no1 ZINC000195518232 526920388 /nfs/dbraw/zinc/92/03/88/526920388.db2.gz PIOTWPALZABBLS-HNNXBMFYSA-N 1 1 330.388 2.783 10 5 EFBEMO O=C1CC[C@H]2C[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@H]2N1C1CC1 ZINC000245710514 526996203 /nfs/dbraw/zinc/99/62/03/526996203.db2.gz ZIQWTKNZLFXVJF-BLLLJJGKSA-N 1 1 347.390 2.709 10 5 EFBEMO O=C1CC[C@H]2C[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@H]2N1C1CC1 ZINC000245710514 526996209 /nfs/dbraw/zinc/99/62/09/526996209.db2.gz ZIQWTKNZLFXVJF-BLLLJJGKSA-N 1 1 347.390 2.709 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@]4(CCOC4)C3)o2)c1 ZINC000153967410 527381561 /nfs/dbraw/zinc/38/15/61/527381561.db2.gz QOXLOFPYTGAXGM-SFHVURJKSA-N 1 1 343.383 2.905 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](Oc2cccnc2)C1 ZINC000152526192 527403557 /nfs/dbraw/zinc/40/35/57/527403557.db2.gz JGCMEPPFQYLGBK-OAHLLOKOSA-N 1 1 329.356 2.522 10 5 EFBEMO O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H](Oc3cccc(Cl)c3)C2)n1 ZINC000120371910 527406987 /nfs/dbraw/zinc/40/69/87/527406987.db2.gz GBKXITQKZCQMHR-AWEZNQCLSA-N 1 1 336.779 2.598 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000184199275 527526088 /nfs/dbraw/zinc/52/60/88/527526088.db2.gz JNJJPSQWVPHYAB-RGCHEUQESA-N 1 1 331.416 2.939 10 5 EFBEMO CC[N@@H+](C)C[C@H]1CCN(C(=O)/C(C)=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000182908038 527823340 /nfs/dbraw/zinc/82/33/40/527823340.db2.gz KDXOSOFWGTVISX-WSYSLRRZSA-N 1 1 331.416 2.798 10 5 EFBEMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000174855040 528611832 /nfs/dbraw/zinc/61/18/32/528611832.db2.gz HTZBLHFNNCNHQM-AWEZNQCLSA-N 1 1 332.404 2.753 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000174533085 529066044 /nfs/dbraw/zinc/06/60/44/529066044.db2.gz NSNNOPZJDWWYQG-GFCCVEGCSA-N 1 1 325.796 2.805 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000174533295 529068394 /nfs/dbraw/zinc/06/83/94/529068394.db2.gz JQCIZLHGTYAKTB-GFCCVEGCSA-N 1 1 325.796 2.805 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000174533063 529096983 /nfs/dbraw/zinc/09/69/83/529096983.db2.gz DNGMJWUNMUJXKC-LBPRGKRZSA-N 1 1 325.796 2.805 10 5 EFBEMO CC[C@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)CCN1CC(F)F ZINC000153544158 529295161 /nfs/dbraw/zinc/29/51/61/529295161.db2.gz QLUKLXHXVHBLOW-ZDUSSCGKSA-N 1 1 343.374 2.635 10 5 EFBEMO CC[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CCN1CC(F)F ZINC000153544158 529295163 /nfs/dbraw/zinc/29/51/63/529295163.db2.gz QLUKLXHXVHBLOW-ZDUSSCGKSA-N 1 1 343.374 2.635 10 5 EFBEMO CC[C@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)CCN1CC(F)F ZINC000153726589 529295571 /nfs/dbraw/zinc/29/55/71/529295571.db2.gz JIVBNNCKPRYOAK-ZDUSSCGKSA-N 1 1 343.374 2.635 10 5 EFBEMO CC[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CCN1CC(F)F ZINC000153726589 529295572 /nfs/dbraw/zinc/29/55/72/529295572.db2.gz JIVBNNCKPRYOAK-ZDUSSCGKSA-N 1 1 343.374 2.635 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000153975950 529303163 /nfs/dbraw/zinc/30/31/63/529303163.db2.gz LIQRCVUOPJDIKM-DOTOQJQBSA-N 1 1 331.416 2.613 10 5 EFBEMO CC1(C)C[C@H]([NH2+]Cc2cc(C(N)=O)co2)c2cc([N+](=O)[O-])ccc21 ZINC000433066796 535368268 /nfs/dbraw/zinc/36/82/68/535368268.db2.gz IOLMUDKZFHQWKN-HNNXBMFYSA-N 1 1 329.356 2.799 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@@H](CNC(=O)C(C)C)C2)ccc1[N+](=O)[O-] ZINC000352416504 536751769 /nfs/dbraw/zinc/75/17/69/536751769.db2.gz HJUFKMKHMJZUGZ-HNNXBMFYSA-N 1 1 349.431 2.588 10 5 EFBEMO COc1cc(C[NH2+][C@H](C[S@](C)=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000347691448 536812896 /nfs/dbraw/zinc/81/28/96/536812896.db2.gz ZOCJYYPLKNNSOQ-MYYSRTQBSA-N 1 1 348.424 2.813 10 5 EFBEMO COCC[C@H]1CCCC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000342705814 536822482 /nfs/dbraw/zinc/82/24/82/536822482.db2.gz UXMACBNTRSVQCX-OAHLLOKOSA-N 1 1 349.431 2.980 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@@H+](C)C1CCCCC1 ZINC000427454659 536886221 /nfs/dbraw/zinc/88/62/21/536886221.db2.gz CBHXKAGLOXVCIA-UHFFFAOYSA-N 1 1 335.404 2.598 10 5 EFBEMO COc1ccccc1NC(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000342288643 537083058 /nfs/dbraw/zinc/08/30/58/537083058.db2.gz ZGPVPGKUYDCOEO-GFCCVEGCSA-N 1 1 329.356 2.893 10 5 EFBEMO CC[N@H+]1CCC[C@@H](CNC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)C1 ZINC000755197062 575559377 /nfs/dbraw/zinc/55/93/77/575559377.db2.gz DKHWJPNIRPCCHC-QBOMHBFWSA-N 1 1 331.416 2.846 10 5 EFBEMO CC[N@H+]1CCC[C@H](CNC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)C1 ZINC000755197065 575559490 /nfs/dbraw/zinc/55/94/90/575559490.db2.gz DKHWJPNIRPCCHC-SYCZXOQXSA-N 1 1 331.416 2.846 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCCNc1cccc(C)[nH+]1 ZINC000755418703 575584841 /nfs/dbraw/zinc/58/48/41/575584841.db2.gz ZJKTWZWHTLUILP-SEYXRHQNSA-N 1 1 340.383 2.930 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@@H]4COCC[C@@H]43)c2)cc1 ZINC000756892439 575797487 /nfs/dbraw/zinc/79/74/87/575797487.db2.gz WXJDLKHZERHJRO-QAPCUYQASA-N 1 1 342.399 2.917 10 5 EFBEMO CCCCCC[C@H](O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000759391483 575890716 /nfs/dbraw/zinc/89/07/16/575890716.db2.gz YIXKJOJXAOCLAO-ZBFHGGJFSA-N 1 1 336.436 2.807 10 5 EFBEMO COc1cc(F)c([N+](=O)[O-])c(NCCC[N@H+]2CCCO[C@@H](C)C2)c1 ZINC000763052301 576357379 /nfs/dbraw/zinc/35/73/79/576357379.db2.gz AQSMGNJURRKOCT-LBPRGKRZSA-N 1 1 341.383 2.655 10 5 EFBEMO COc1cc(F)c([N+](=O)[O-])c(NCCC[N@H+]2CCCO[C@H](C)C2)c1 ZINC000763052289 576357493 /nfs/dbraw/zinc/35/74/93/576357493.db2.gz AQSMGNJURRKOCT-GFCCVEGCSA-N 1 1 341.383 2.655 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@@H]3COCC[C@H]32)c2ccc([N+](=O)[O-])cc12 ZINC000765081869 577004769 /nfs/dbraw/zinc/00/47/69/577004769.db2.gz RDPKSMJUAXHQLV-CZUORRHYSA-N 1 1 330.388 2.711 10 5 EFBEMO C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000823754150 1265424035 /nfs/dbraw/zinc/42/40/35/1265424035.db2.gz SDIKNWSECGULCQ-TXEJJXNPSA-N 1 1 343.305 2.532 10 5 EFBEMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000823754150 1265424041 /nfs/dbraw/zinc/42/40/41/1265424041.db2.gz SDIKNWSECGULCQ-TXEJJXNPSA-N 1 1 343.305 2.532 10 5 EFBEMO C[C@](CO)([NH2+]Cc1cnn(C2CCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000922306056 1265428139 /nfs/dbraw/zinc/42/81/39/1265428139.db2.gz JXFAYRARZIFRRD-QGZVFWFLSA-N 1 1 330.388 2.514 10 5 EFBEMO C[C@](CO)([NH2+]Cc1ccnn1C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000922308232 1265439037 /nfs/dbraw/zinc/43/90/37/1265439037.db2.gz WKWCXORFUPRYCO-QGZVFWFLSA-N 1 1 330.388 2.514 10 5 EFBEMO CCC[N@H+](CCNC(=O)C1CC=CC1)Cc1ccccc1[N+](=O)[O-] ZINC001691176962 1248509189 /nfs/dbraw/zinc/50/91/89/1248509189.db2.gz GWYHPXDICHPRMJ-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO CCC[N@@H+](CCNC(=O)C1CC=CC1)Cc1ccccc1[N+](=O)[O-] ZINC001691176962 1248509193 /nfs/dbraw/zinc/50/91/93/1248509193.db2.gz GWYHPXDICHPRMJ-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1nocc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001691196325 1248529705 /nfs/dbraw/zinc/52/97/05/1248529705.db2.gz LMNWQZFZEIBUDO-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO COc1cc(C[NH2+][C@@H]2C[C@@H](O)c3ccccc32)c([N+](=O)[O-])cc1O ZINC000850371458 1250452177 /nfs/dbraw/zinc/45/21/77/1250452177.db2.gz JVNZALLKDDDPES-UKRRQHHQSA-N 1 1 330.340 2.577 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[NH2+][C@H]1C[C@H](O)c3ccccc31)OCCO2 ZINC000850371565 1250452571 /nfs/dbraw/zinc/45/25/71/1250452571.db2.gz KUHCRTBVKGPSDA-HOCLYGCPSA-N 1 1 342.351 2.634 10 5 EFBEMO C[C@@H]1[C@@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[N@H+]1C ZINC000922557329 1266253426 /nfs/dbraw/zinc/25/34/26/1266253426.db2.gz OEHUDWNIUGSRKS-ABAIWWIYSA-N 1 1 332.429 2.901 10 5 EFBEMO C[C@@H]1[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCN1C ZINC000922557329 1266253434 /nfs/dbraw/zinc/25/34/34/1266253434.db2.gz OEHUDWNIUGSRKS-ABAIWWIYSA-N 1 1 332.429 2.901 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](O)C[C@H]2[C@H]2CCCOC2)cc1Cl ZINC000824655852 1278221134 /nfs/dbraw/zinc/22/11/34/1278221134.db2.gz ZZFJNYFVYNJYOM-ZENOOKHLSA-N 1 1 340.807 2.610 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)ccc1Cl ZINC000824654286 1278219856 /nfs/dbraw/zinc/21/98/56/1278219856.db2.gz MALFRQAQBDYZLY-UMVBOHGHSA-N 1 1 340.807 2.610 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2C[C@H](O)C[C@H]2[C@H]2CCCOC2)ccc1Cl ZINC000824654283 1278220470 /nfs/dbraw/zinc/22/04/70/1278220470.db2.gz MALFRQAQBDYZLY-GUTXKFCHSA-N 1 1 340.807 2.610 10 5 EFBEMO CCOc1cc(NC(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000823366336 1265317545 /nfs/dbraw/zinc/31/75/45/1265317545.db2.gz HMIYBPCQLKBHDC-NWDGAFQWSA-N 1 1 336.392 2.550 10 5 EFBEMO O=[N+]([O-])c1ccc(Br)cc1N1CC[NH+](C2CC2)CC1 ZINC000741750061 1269685696 /nfs/dbraw/zinc/68/56/96/1269685696.db2.gz AIQNTTAROOBOLA-UHFFFAOYSA-N 1 1 326.194 2.642 10 5 EFBEMO C[C@H]1[C@@H](CO)CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC001169812154 1273178398 /nfs/dbraw/zinc/17/83/98/1273178398.db2.gz QZBKVGDLASFFCL-VHSXEESVSA-N 1 1 329.194 2.560 10 5 EFBEMO C[C@H]1[C@@H](CO)CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC001169812154 1273178401 /nfs/dbraw/zinc/17/84/01/1273178401.db2.gz QZBKVGDLASFFCL-VHSXEESVSA-N 1 1 329.194 2.560 10 5 EFBEMO C[C@@H]1[C@H](CO)CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC001169812156 1273179156 /nfs/dbraw/zinc/17/91/56/1273179156.db2.gz QZBKVGDLASFFCL-ZJUUUORDSA-N 1 1 329.194 2.560 10 5 EFBEMO C[C@@H]1[C@H](CO)CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC001169812156 1273179163 /nfs/dbraw/zinc/17/91/63/1273179163.db2.gz QZBKVGDLASFFCL-ZJUUUORDSA-N 1 1 329.194 2.560 10 5 EFBEMO O=C1O[C@H](C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CN1C1CC1 ZINC000844312678 1278858520 /nfs/dbraw/zinc/85/85/20/1278858520.db2.gz HOJRHIZJONZNSW-MRXNPFEDSA-N 1 1 331.372 2.542 10 5 EFBEMO O=C1O[C@@H](C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CN1C1CC1 ZINC000844312674 1278859065 /nfs/dbraw/zinc/85/90/65/1278859065.db2.gz HOJRHIZJONZNSW-INIZCTEOSA-N 1 1 331.372 2.542 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CC(C)(C)S(C)(=O)=O ZINC000787405175 1275777416 /nfs/dbraw/zinc/77/74/16/1275777416.db2.gz BCTVSISGMHVTHA-UKTHLTGXSA-N 1 1 340.445 2.753 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC(C)(C)S(C)(=O)=O ZINC000787405175 1275777422 /nfs/dbraw/zinc/77/74/22/1275777422.db2.gz BCTVSISGMHVTHA-UKTHLTGXSA-N 1 1 340.445 2.753 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CC[C@]4(C3)CCCOC4)c2)cc1 ZINC000789538966 1276794035 /nfs/dbraw/zinc/79/40/35/1276794035.db2.gz CUXUWGNLWMMTCM-SFHVURJKSA-N 1 1 342.399 2.918 10 5 EFBEMO C/C(=C\C(=O)N1CCC[C@H]2C[N@H+](C)C[C@H]21)c1ccc([N+](=O)[O-])cc1 ZINC000819718882 1276893273 /nfs/dbraw/zinc/89/32/73/1276893273.db2.gz JTQPFFKUHXTNIX-UJDGICINSA-N 1 1 329.400 2.551 10 5 EFBEMO C/C(=C/C(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000844642732 1279163466 /nfs/dbraw/zinc/16/34/66/1279163466.db2.gz KNLSWDBDEPQKED-HQZAUCPKSA-N 1 1 331.416 2.938 10 5 EFBEMO C/C(=C\C(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000844642734 1279163803 /nfs/dbraw/zinc/16/38/03/1279163803.db2.gz KNLSWDBDEPQKED-XUNCZOGOSA-N 1 1 331.416 2.938 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CC[C@@]4(CC4(F)F)C3)n2)cc1 ZINC000844755821 1279224093 /nfs/dbraw/zinc/22/40/93/1279224093.db2.gz HRDZGJVJLNYRPQ-CQSZACIVSA-N 1 1 335.314 2.542 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@@]4(CC4(F)F)C3)n2)cc1 ZINC000844755821 1279224099 /nfs/dbraw/zinc/22/40/99/1279224099.db2.gz HRDZGJVJLNYRPQ-CQSZACIVSA-N 1 1 335.314 2.542 10 5 EFBEMO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCCN2Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000846227184 1280076590 /nfs/dbraw/zinc/07/65/90/1280076590.db2.gz IQKFRPONQJJMAO-OIISXLGYSA-N 1 1 337.395 2.595 10 5 EFBEMO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCCN2Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000846227183 1280077441 /nfs/dbraw/zinc/07/74/41/1280077441.db2.gz IQKFRPONQJJMAO-HYVNUMGLSA-N 1 1 337.395 2.595 10 5 EFBEMO C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H]1CO)c1c(F)cccc1[N+](=O)[O-] ZINC000872035004 1287406589 /nfs/dbraw/zinc/40/65/89/1287406589.db2.gz JMZGIJCDINKCJI-KGLIPLIRSA-N 1 1 339.411 2.621 10 5 EFBEMO C[C@@H](NCCCC[N@@H+]1CCC[C@H]1CO)c1c(F)cccc1[N+](=O)[O-] ZINC000872035004 1287406598 /nfs/dbraw/zinc/40/65/98/1287406598.db2.gz JMZGIJCDINKCJI-KGLIPLIRSA-N 1 1 339.411 2.621 10 5 EFBEMO C[C@@H](NCCCC[N@H+]1CCC[C@H]1CO)c1c(F)cccc1[N+](=O)[O-] ZINC000872035004 1287406604 /nfs/dbraw/zinc/40/66/04/1287406604.db2.gz JMZGIJCDINKCJI-KGLIPLIRSA-N 1 1 339.411 2.621 10 5 EFBEMO C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H]1CO)c1c(F)cccc1[N+](=O)[O-] ZINC000872035005 1287406729 /nfs/dbraw/zinc/40/67/29/1287406729.db2.gz JMZGIJCDINKCJI-UONOGXRCSA-N 1 1 339.411 2.621 10 5 EFBEMO C[C@H](NCCCC[N@@H+]1CCC[C@@H]1CO)c1c(F)cccc1[N+](=O)[O-] ZINC000872035005 1287406733 /nfs/dbraw/zinc/40/67/33/1287406733.db2.gz JMZGIJCDINKCJI-UONOGXRCSA-N 1 1 339.411 2.621 10 5 EFBEMO C[C@H](NCCCC[N@H+]1CCC[C@@H]1CO)c1c(F)cccc1[N+](=O)[O-] ZINC000872035005 1287406737 /nfs/dbraw/zinc/40/67/37/1287406737.db2.gz JMZGIJCDINKCJI-UONOGXRCSA-N 1 1 339.411 2.621 10 5 EFBEMO CCOC(=O)N1CC[C@H]([NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872064357 1287417723 /nfs/dbraw/zinc/41/77/23/1287417723.db2.gz YCYADNODMIPSMZ-QWRGUYRKSA-N 1 1 325.340 2.615 10 5 EFBEMO C[C@@H]([NH2+]C1CCN([C@H]2CCOC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872088406 1287425321 /nfs/dbraw/zinc/42/53/21/1287425321.db2.gz NYAWAZARDQZODC-OCCSQVGLSA-N 1 1 337.395 2.638 10 5 EFBEMO CCCC[N@@H+](C)CCNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001144947780 1280541181 /nfs/dbraw/zinc/54/11/81/1280541181.db2.gz QJDMETHWGHKCNH-UHFFFAOYSA-N 1 1 333.432 2.865 10 5 EFBEMO Cc1ccnc([C@H]2CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000846972656 1280640665 /nfs/dbraw/zinc/64/06/65/1280640665.db2.gz XLZHWWSTGZSPNT-MAUKXSAKSA-N 1 1 327.384 2.821 10 5 EFBEMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H](C3CC3)C2)nc1-c1ccncc1 ZINC000808229446 1281598634 /nfs/dbraw/zinc/59/86/34/1281598634.db2.gz BBQSQIDBGPKKFF-HNNXBMFYSA-N 1 1 327.388 2.933 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@H]1COC(=O)N(C)C ZINC000809709339 1282421564 /nfs/dbraw/zinc/42/15/64/1282421564.db2.gz PYMKHZZFHOIVGU-INIZCTEOSA-N 1 1 335.404 2.956 10 5 EFBEMO CC(C)(O)[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001175973576 1287629251 /nfs/dbraw/zinc/62/92/51/1287629251.db2.gz NUIWYWAGLIWEMM-GFCCVEGCSA-N 1 1 346.387 2.628 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCCc2ccccc2[N+](=O)[O-])C1 ZINC000810630520 1283438352 /nfs/dbraw/zinc/43/83/52/1283438352.db2.gz LBRYONGEPJZFHP-KRWDZBQOSA-N 1 1 338.379 2.893 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCc2csc([N+](=O)[O-])c2)C1 ZINC000811447880 1284325499 /nfs/dbraw/zinc/32/54/99/1284325499.db2.gz QKMYDKQYLWWXHC-AWEZNQCLSA-N 1 1 330.381 2.912 10 5 EFBEMO COC(=O)/C=C\c1ccc(N[C@@H](C)C[N@@H+](C)C(C)C)c([N+](=O)[O-])c1 ZINC000811848665 1284716583 /nfs/dbraw/zinc/71/65/83/1284716583.db2.gz NUCPTBXYNPOOSH-JWJUJFCLSA-N 1 1 335.404 2.922 10 5 EFBEMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000747833252 1285585005 /nfs/dbraw/zinc/58/50/05/1285585005.db2.gz VEOCGIKXNUINLZ-ZIAGYGMSSA-N 1 1 330.388 2.651 10 5 EFBEMO CC[C@H]1CC[C@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)O1 ZINC000813173892 1285704193 /nfs/dbraw/zinc/70/41/93/1285704193.db2.gz LXPULRQPRRKYED-YESZJQIVSA-N 1 1 348.399 2.670 10 5 EFBEMO CC[C@H]1CC[C@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)O1 ZINC000813173892 1285704201 /nfs/dbraw/zinc/70/42/01/1285704201.db2.gz LXPULRQPRRKYED-YESZJQIVSA-N 1 1 348.399 2.670 10 5 EFBEMO COc1cc(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)cc([N+](=O)[O-])c1C ZINC001134280497 1286527473 /nfs/dbraw/zinc/52/74/73/1286527473.db2.gz ZKCZFOOPNUEBOH-HNNXBMFYSA-N 1 1 349.431 2.714 10 5 EFBEMO COc1cc(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)cc([N+](=O)[O-])c1C ZINC001134280497 1286527476 /nfs/dbraw/zinc/52/74/76/1286527476.db2.gz ZKCZFOOPNUEBOH-HNNXBMFYSA-N 1 1 349.431 2.714 10 5 EFBEMO CCOc1cc(C[N@H+]2CCC[C@@H](c3cn(C)nn3)C2)ccc1[N+](=O)[O-] ZINC001176879585 1288159283 /nfs/dbraw/zinc/15/92/83/1288159283.db2.gz LUHLTPQQQURSCN-CQSZACIVSA-N 1 1 345.403 2.502 10 5 EFBEMO COc1ccc(NC(=O)C[NH2+][C@@H](C)c2ncccc2C)c([N+](=O)[O-])c1 ZINC001176897676 1288182388 /nfs/dbraw/zinc/18/23/88/1288182388.db2.gz NDTBGMYZYKXXKS-LBPRGKRZSA-N 1 1 344.371 2.596 10 5 EFBEMO Cc1cccnc1[C@@H](C)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001176899213 1288183585 /nfs/dbraw/zinc/18/35/85/1288183585.db2.gz WUSJCCWXHPPDSY-CYBMUJFWSA-N 1 1 328.372 2.896 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+](C(C)C)C1 ZINC001136452970 1288736757 /nfs/dbraw/zinc/73/67/57/1288736757.db2.gz PBYAFLZZKMJJJY-ZDUSSCGKSA-N 1 1 337.395 2.893 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCC[N@H+](C(C)C)C1 ZINC001136453154 1288736866 /nfs/dbraw/zinc/73/68/66/1288736866.db2.gz VYJCTXGSUMCAOE-AWEZNQCLSA-N 1 1 349.431 2.844 10 5 EFBEMO C[N@H+]1C[C@@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C(C)(C)C1 ZINC001178710236 1288882336 /nfs/dbraw/zinc/88/23/36/1288882336.db2.gz YCPMUUIZUIHZNO-CQSZACIVSA-N 1 1 333.413 2.880 10 5 EFBEMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC001136839418 1289577503 /nfs/dbraw/zinc/57/75/03/1289577503.db2.gz HYSWZJQLEJNPRP-NSHDSACASA-N 1 1 325.796 2.662 10 5 EFBEMO C[N@H+]1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@H]1C(C)(C)C ZINC000880611954 1292556837 /nfs/dbraw/zinc/55/68/37/1292556837.db2.gz BIWZIVLMEWQODA-INIZCTEOSA-N 1 1 344.415 2.878 10 5 EFBEMO C[C@@H](CN1CCOCC1)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001192387440 1292885761 /nfs/dbraw/zinc/88/57/61/1292885761.db2.gz CAYJGCQGBBPSSX-HNNXBMFYSA-N 1 1 333.432 2.528 10 5 EFBEMO CCC[C@@]1(CO)CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001194781678 1293708392 /nfs/dbraw/zinc/70/83/92/1293708392.db2.gz HHVVCBSDZRUOLG-QGZVFWFLSA-N 1 1 346.387 2.629 10 5 EFBEMO CCC[C@@]1(CO)CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001194781678 1293708397 /nfs/dbraw/zinc/70/83/97/1293708397.db2.gz HHVVCBSDZRUOLG-QGZVFWFLSA-N 1 1 346.387 2.629 10 5 EFBEMO COC(=O)C1([N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C2CC2)CCC1 ZINC001195393741 1293918580 /nfs/dbraw/zinc/91/85/80/1293918580.db2.gz NSBBNDKUXUBNEZ-UHFFFAOYSA-N 1 1 348.399 2.924 10 5 EFBEMO COC(=O)C1([N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C2CC2)CCC1 ZINC001195393741 1293918586 /nfs/dbraw/zinc/91/85/86/1293918586.db2.gz NSBBNDKUXUBNEZ-UHFFFAOYSA-N 1 1 348.399 2.924 10 5 EFBEMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@H](CO)Cc1ccccc1 ZINC001196039396 1294118549 /nfs/dbraw/zinc/11/85/49/1294118549.db2.gz MQYORYXQBPAJKY-GOSISDBHSA-N 1 1 344.411 2.899 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1Cc2c[nH]nc2[C@H](C)C1 ZINC001196789822 1294365894 /nfs/dbraw/zinc/36/58/94/1294365894.db2.gz OKKWZLTZFDAUBW-GFCCVEGCSA-N 1 1 343.387 2.574 10 5 EFBEMO Cc1cc([C@H]2CCCC[N@@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC001198130936 1294887505 /nfs/dbraw/zinc/88/75/05/1294887505.db2.gz LJUNUPDMUOELQS-IAGOWNOFSA-N 1 1 330.388 2.887 10 5 EFBEMO Cc1cc([C@H]2CCCC[N@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC001198130936 1294887519 /nfs/dbraw/zinc/88/75/19/1294887519.db2.gz LJUNUPDMUOELQS-IAGOWNOFSA-N 1 1 330.388 2.887 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](c2cn(C)nn2)C1 ZINC001198612302 1295147404 /nfs/dbraw/zinc/14/74/04/1295147404.db2.gz NDSJLMJFIAANLV-ZIAGYGMSSA-N 1 1 329.404 2.972 10 5 EFBEMO C[N@@H+](CCc1ccc2c(c1)OCO2)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000887095485 1295274729 /nfs/dbraw/zinc/27/47/29/1295274729.db2.gz NMLKZSXODPCZFP-INIZCTEOSA-N 1 1 344.367 2.531 10 5 EFBEMO CC1(C(=O)NC/C=C\C[NH2+]Cc2csc([N+](=O)[O-])c2)CC=CC1 ZINC001274333109 1296065941 /nfs/dbraw/zinc/06/59/41/1296065941.db2.gz XABFNFVYCMEHGB-PLNGDYQASA-N 1 1 335.429 2.775 10 5 EFBEMO COc1cc(COC(=O)CC[C@H]2CCCC[N@H+]2C)ccc1[N+](=O)[O-] ZINC000803859473 1313265318 /nfs/dbraw/zinc/26/53/18/1313265318.db2.gz PVUOVRMCGZSCDT-CQSZACIVSA-N 1 1 336.388 2.911 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1COC(=O)CC[C@H]1CCCC[N@H+]1C ZINC000803859049 1313265482 /nfs/dbraw/zinc/26/54/82/1313265482.db2.gz LYVWIYSHXMETBB-CQSZACIVSA-N 1 1 336.388 2.911 10 5 EFBEMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)N[C@H]1CC[N@@H+](C)[C@H]1C ZINC000931627308 1297358512 /nfs/dbraw/zinc/35/85/12/1297358512.db2.gz ZMIYUBZZHAYHGL-ONGXEEELSA-N 1 1 326.784 2.771 10 5 EFBEMO C[C@@H]1CN(Cc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H]1CC[NH3+] ZINC000903976824 1313524898 /nfs/dbraw/zinc/52/48/98/1313524898.db2.gz CHRKTGNHKWIGGO-GHMZBOCLSA-N 1 1 329.347 2.613 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H](c3ccccn3)C2)c1 ZINC000852086962 1299542974 /nfs/dbraw/zinc/54/29/74/1299542974.db2.gz YNLAYWHOICTEEL-CRAIPNDOSA-N 1 1 327.384 2.903 10 5 EFBEMO C[C@H]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)c1cscn1 ZINC000852416769 1299697006 /nfs/dbraw/zinc/69/70/06/1299697006.db2.gz MZFZPFKFDALEGP-VIFPVBQESA-N 1 1 338.364 2.870 10 5 EFBEMO C[C@@]12COC[C@@H]1C[N@H+](Cc1cccc([N+](=O)[O-])c1Br)C2 ZINC000852535556 1299744651 /nfs/dbraw/zinc/74/46/51/1299744651.db2.gz FLCAHAMHTVJKAR-SMDDNHRTSA-N 1 1 341.205 2.826 10 5 EFBEMO C[C@@]12COC[C@@H]1C[N@@H+](Cc1cccc([N+](=O)[O-])c1Br)C2 ZINC000852535556 1299744660 /nfs/dbraw/zinc/74/46/60/1299744660.db2.gz FLCAHAMHTVJKAR-SMDDNHRTSA-N 1 1 341.205 2.826 10 5 EFBEMO CC(C)NC(=O)[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000852698187 1299819108 /nfs/dbraw/zinc/81/91/08/1299819108.db2.gz HJJYWDGEQQZQNL-LBPRGKRZSA-N 1 1 339.823 2.985 10 5 EFBEMO CC(C)NC(=O)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000852698187 1299819114 /nfs/dbraw/zinc/81/91/14/1299819114.db2.gz HJJYWDGEQQZQNL-LBPRGKRZSA-N 1 1 339.823 2.985 10 5 EFBEMO CC(C)NC(=O)[C@@H]1CCC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000852699080 1299820639 /nfs/dbraw/zinc/82/06/39/1299820639.db2.gz ZHAGKUYGKVRQCD-CYBMUJFWSA-N 1 1 339.823 2.985 10 5 EFBEMO CC(C)NC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000852699080 1299820641 /nfs/dbraw/zinc/82/06/41/1299820641.db2.gz ZHAGKUYGKVRQCD-CYBMUJFWSA-N 1 1 339.823 2.985 10 5 EFBEMO Cc1nn(C[N@@H+]2C[C@]3(C)COC[C@]3(C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000853542470 1300157844 /nfs/dbraw/zinc/15/78/44/1300157844.db2.gz AYFABBSRYBHGEB-CALCHBBNSA-N 1 1 330.388 2.569 10 5 EFBEMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCCOCC3)CC2)c(F)c1 ZINC000853688026 1300229955 /nfs/dbraw/zinc/22/99/55/1300229955.db2.gz CRBDJWOARWSMBZ-UHFFFAOYSA-N 1 1 341.358 2.564 10 5 EFBEMO CCN(C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](CC)C1 ZINC000854097234 1300425044 /nfs/dbraw/zinc/42/50/44/1300425044.db2.gz FZTFHZLMTPLGQH-BBRMVZONSA-N 1 1 334.420 2.782 10 5 EFBEMO CCN(C(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](CC)C1 ZINC000855489596 1300979394 /nfs/dbraw/zinc/97/93/94/1300979394.db2.gz AVMQIAMYJQAZPT-ABDJAZHISA-N 1 1 331.416 2.941 10 5 EFBEMO C[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cc3ccccc32)C1 ZINC000859287726 1301418707 /nfs/dbraw/zinc/41/87/07/1301418707.db2.gz ZGEYNORBCYHXMM-ZDUSSCGKSA-N 1 1 327.384 2.820 10 5 EFBEMO C[C@@H]1CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])cc3ccccc32)C1 ZINC000859775604 1301575863 /nfs/dbraw/zinc/57/58/63/1301575863.db2.gz XDGMJPMKCJXEOJ-CYBMUJFWSA-N 1 1 327.384 2.820 10 5 EFBEMO CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000861338782 1302074717 /nfs/dbraw/zinc/07/47/17/1302074717.db2.gz FDIGIGSDAATGMC-IAQYHMDHSA-N 1 1 342.779 2.514 10 5 EFBEMO C/C(=C\C(=O)N1CC[NH+](CCCF)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000862113904 1302288721 /nfs/dbraw/zinc/28/87/21/1302288721.db2.gz WILJOLZCCKQDBK-BUHFOSPRSA-N 1 1 335.379 2.502 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCC[N@H+](C)C1 ZINC000862792609 1302460313 /nfs/dbraw/zinc/46/03/13/1302460313.db2.gz AXDSQFBCQYPRRP-QBOMHBFWSA-N 1 1 331.416 2.846 10 5 EFBEMO O=[N+]([O-])c1ccc(NC(=S)NC[C@H]2CC[N@H+]2C2CCCC2)cc1 ZINC000863231041 1302561357 /nfs/dbraw/zinc/56/13/57/1302561357.db2.gz XVYZVVZJLVDMLT-OAHLLOKOSA-N 1 1 334.445 2.898 10 5 EFBEMO CC(C)(O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000865999343 1303482707 /nfs/dbraw/zinc/48/27/07/1303482707.db2.gz PBPCMPNGCDCTQW-JTQLQIEISA-N 1 1 347.337 2.871 10 5 EFBEMO COc1cc(N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000866207281 1303563161 /nfs/dbraw/zinc/56/31/61/1303563161.db2.gz CDOQLQRHXFUMCU-JQWIXIFHSA-N 1 1 325.796 2.787 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(c3ccc(Br)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000866208564 1303564548 /nfs/dbraw/zinc/56/45/48/1303564548.db2.gz UCGKHVNGYPCHLL-PWSUYJOCSA-N 1 1 340.221 2.888 10 5 EFBEMO CC[C@H](C[C@H](C)O)[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000866632804 1303722461 /nfs/dbraw/zinc/72/24/61/1303722461.db2.gz BTZKGRXLNMCEFX-BJJXKVORSA-N 1 1 332.404 2.557 10 5 EFBEMO CN(CCc1ccc(F)cc1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867954606 1304042472 /nfs/dbraw/zinc/04/24/72/1304042472.db2.gz PFGCBZDWEMNHCG-SFHVURJKSA-N 1 1 345.374 2.609 10 5 EFBEMO C[C@@H]1CC[C@]2(CCN(C(=O)[C@](C)([NH3+])c3cccc([N+](=O)[O-])c3)C2)C1 ZINC000867979422 1304055177 /nfs/dbraw/zinc/05/51/77/1304055177.db2.gz ICJUQDJUGXXRKQ-XWIAVFTESA-N 1 1 331.416 2.807 10 5 EFBEMO Cc1[nH+]ccn1CCCN(C)C(=O)NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000869053788 1304591767 /nfs/dbraw/zinc/59/17/67/1304591767.db2.gz UCFKBJKQYUMRED-UHFFFAOYSA-N 1 1 345.403 2.640 10 5 EFBEMO C/C(=C\C(=O)N1CC[C@]2(CC[N@H+](C)C2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000795128548 1305396340 /nfs/dbraw/zinc/39/63/40/1305396340.db2.gz HFMXPIMSRVWGAZ-BJRSVTDJSA-N 1 1 329.400 2.552 10 5 EFBEMO C/C(=C/C(=O)N1CC[C@]2(CC[N@H+](C)C2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000795128555 1305396938 /nfs/dbraw/zinc/39/69/38/1305396938.db2.gz HFMXPIMSRVWGAZ-RMHQSFGDSA-N 1 1 329.400 2.552 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)cc1[N+](=O)[O-] ZINC000871149909 1305836890 /nfs/dbraw/zinc/83/68/90/1305836890.db2.gz ITXCJXFZIRGYMA-UHFFFAOYSA-N 1 1 335.404 2.550 10 5 EFBEMO COC(=O)/C(C)=C\C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000748823506 1314140193 /nfs/dbraw/zinc/14/01/93/1314140193.db2.gz VQIYZCIAAZXCIW-QPEQYQDCSA-N 1 1 334.372 2.557 10 5 EFBEMO Cn1cc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)n1 ZINC001162597743 1312132389 /nfs/dbraw/zinc/13/23/89/1312132389.db2.gz KDDFIVSYARHARD-SMDDNHRTSA-N 1 1 335.433 2.885 10 5 EFBEMO CC[C@@H](NC(=O)N1CC[C@@H]2[C@H]1CCC[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC001230515620 1312251938 /nfs/dbraw/zinc/25/19/38/1312251938.db2.gz WRZWCLKIFYDPOC-BRWVUGGUSA-N 1 1 346.431 2.924 10 5 EFBEMO C[C@@H]1CN(c2cccc(C(F)(F)F)c2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO ZINC001163312300 1312286864 /nfs/dbraw/zinc/28/68/64/1312286864.db2.gz NWLOWVGAZCFPHA-PHIMTYICSA-N 1 1 347.337 2.505 10 5 EFBEMO Cc1nc(NC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)ncc1[N+](=O)[O-] ZINC001163900997 1312404786 /nfs/dbraw/zinc/40/47/86/1312404786.db2.gz HNGCGBVAASTMCJ-CZUORRHYSA-N 1 1 341.415 2.873 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC001261260145 1316399521 /nfs/dbraw/zinc/39/95/21/1316399521.db2.gz DNGNHUWJURMFQX-ZBFHGGJFSA-N 1 1 337.395 2.523 10 5 EFBEMO COc1cccc([C@@]2(C)CC[N@H+](Cn3cc([N+](=O)[O-])c(C)n3)C2)c1 ZINC001261655269 1316423053 /nfs/dbraw/zinc/42/30/53/1316423053.db2.gz RHUMURUTUZGRAM-KRWDZBQOSA-N 1 1 330.388 2.729 10 5 EFBEMO COc1cccc([C@@]2(C)CC[N@@H+](Cn3cc([N+](=O)[O-])c(C)n3)C2)c1 ZINC001261655269 1316423055 /nfs/dbraw/zinc/42/30/55/1316423055.db2.gz RHUMURUTUZGRAM-KRWDZBQOSA-N 1 1 330.388 2.729 10 5 EFBEMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Nc3ccc([N+](=O)[O-])c(Cl)c3)[C@@H]2C1 ZINC001263637771 1316553051 /nfs/dbraw/zinc/55/30/51/1316553051.db2.gz BFIJMRCNRWFIGY-NDMJEZRESA-N 1 1 338.795 2.710 10 5 EFBEMO CC[N@@H+](CCCNC(=O)[C@H]1C[C@H]2C[C@H]2C1)Cc1ccccc1[N+](=O)[O-] ZINC001265129858 1316729846 /nfs/dbraw/zinc/72/98/46/1316729846.db2.gz YIIOWBCGENJWSI-FVQHAEBGSA-N 1 1 345.443 2.969 10 5 EFBEMO O=C(NCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccoc1 ZINC001265154195 1316741174 /nfs/dbraw/zinc/74/11/74/1316741174.db2.gz WPRPVDJHAPFIHX-UHFFFAOYSA-N 1 1 343.383 2.972 10 5 EFBEMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc([N+](=O)[O-])cc(C)n2)c1 ZINC001292068426 1322033560 /nfs/dbraw/zinc/03/35/60/1322033560.db2.gz JCDVDTBBUXSIKK-UHFFFAOYSA-N 1 1 342.399 2.680 10 5 EFBEMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2N)C1 ZINC001292096633 1322037410 /nfs/dbraw/zinc/03/74/10/1322037410.db2.gz DXDHDDSWOQTLJU-BETUJISGSA-N 1 1 348.447 2.663 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)CC(C)(F)F ZINC001320043127 1329063742 /nfs/dbraw/zinc/06/37/42/1329063742.db2.gz QQVXBNTYLOXVCP-UHFFFAOYSA-N 1 1 329.347 2.530 10 5 EFBEMO Cc1c(C(=O)OCc2csc([N+](=O)[O-])c2)cnn1-c1cc[nH+]cc1 ZINC001320066418 1329068718 /nfs/dbraw/zinc/06/87/18/1329068718.db2.gz CZXGIJSPJDRKEE-UHFFFAOYSA-N 1 1 344.352 2.902 10 5 EFBEMO CC[N@@H+](C)[C@H]1CCN(c2c3cc(OC)ccc3ncc2[N+](=O)[O-])C1 ZINC001307236589 1323369183 /nfs/dbraw/zinc/36/91/83/1323369183.db2.gz ZNZBBOQYEFXPCV-LBPRGKRZSA-N 1 1 330.388 2.682 10 5 EFBEMO C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC001298169796 1323453132 /nfs/dbraw/zinc/45/31/32/1323453132.db2.gz JLOYWOXYDNNBJI-UHFFFAOYSA-N 1 1 331.416 2.614 10 5 EFBEMO Cc1ccccc1C(=O)NCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001492186938 1324371815 /nfs/dbraw/zinc/37/18/15/1324371815.db2.gz PYLZTXDOBYLLTI-UHFFFAOYSA-N 1 1 327.384 2.765 10 5 EFBEMO Cc1ccc(CC(=O)NCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001492323034 1324421262 /nfs/dbraw/zinc/42/12/62/1324421262.db2.gz ZUXZPGZDTQAFTC-UHFFFAOYSA-N 1 1 341.411 2.694 10 5 EFBEMO C[N@@H+](CCCNC(=O)C1(F)CCCC1)Cc1ccccc1[N+](=O)[O-] ZINC001316833148 1324618179 /nfs/dbraw/zinc/61/81/79/1324618179.db2.gz AVYQRQFOHSKKPM-UHFFFAOYSA-N 1 1 337.395 2.815 10 5 EFBEMO C[N@@H+](CCCNC(=O)C1CC2(CC2)C1)Cc1cccc([N+](=O)[O-])c1 ZINC001316847571 1324688362 /nfs/dbraw/zinc/68/83/62/1324688362.db2.gz BSYQVZVYIQWIBH-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO C[N@H+](CCNC(=O)C(C)(C)C(F)(F)F)Cc1cccc([N+](=O)[O-])c1 ZINC001317467645 1324726945 /nfs/dbraw/zinc/72/69/45/1324726945.db2.gz IGZWAZOHHAANID-UHFFFAOYSA-N 1 1 347.337 2.731 10 5 EFBEMO C[N@@H+](CCNC(=O)C(C)(C)C(F)(F)F)Cc1cccc([N+](=O)[O-])c1 ZINC001317467645 1324726949 /nfs/dbraw/zinc/72/69/49/1324726949.db2.gz IGZWAZOHHAANID-UHFFFAOYSA-N 1 1 347.337 2.731 10 5 EFBEMO COc1ccc2c(c1)C[C@H](C[N@@H+]1CCc3ccc([N+](=O)[O-])cc3C1)O2 ZINC001307523878 1324771331 /nfs/dbraw/zinc/77/13/31/1324771331.db2.gz QRMAUXQLRUIGGG-GOSISDBHSA-N 1 1 340.379 2.965 10 5 EFBEMO COc1ccc2c(c1)C[C@H](C[N@H+]1CCc3ccc([N+](=O)[O-])cc3C1)O2 ZINC001307523878 1324771341 /nfs/dbraw/zinc/77/13/41/1324771341.db2.gz QRMAUXQLRUIGGG-GOSISDBHSA-N 1 1 340.379 2.965 10 5 EFBEMO C[C@@H]1[C@H](C)N(Cc2c(Br)cccc2[N+](=O)[O-])CC[N@@H+]1C ZINC001307632497 1324774051 /nfs/dbraw/zinc/77/40/51/1324774051.db2.gz XFJYROFNNYSUKW-MNOVXSKESA-N 1 1 342.237 2.882 10 5 EFBEMO C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001307689125 1324776521 /nfs/dbraw/zinc/77/65/21/1324776521.db2.gz VKNVJPNXXSKSRJ-TYNCELHUSA-N 1 1 346.387 2.626 10 5 EFBEMO C[C@H]1CN(c2cc[nH+]cc2)CCN1CCOc1cccc([N+](=O)[O-])c1 ZINC001308091126 1324793195 /nfs/dbraw/zinc/79/31/95/1324793195.db2.gz XUGJOOCGIOLGLF-HNNXBMFYSA-N 1 1 342.399 2.579 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](c4cnccn4)C3)nc2c1 ZINC001308112718 1324793889 /nfs/dbraw/zinc/79/38/89/1324793889.db2.gz KSKPERJPWVAFAR-LLVKDONJSA-N 1 1 325.328 2.516 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](c4cnccn4)C3)nc2c1 ZINC001308112718 1324793893 /nfs/dbraw/zinc/79/38/93/1324793893.db2.gz KSKPERJPWVAFAR-LLVKDONJSA-N 1 1 325.328 2.516 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](c4cnccn4)C3)nc2c1 ZINC001308112719 1324794495 /nfs/dbraw/zinc/79/44/95/1324794495.db2.gz KSKPERJPWVAFAR-NSHDSACASA-N 1 1 325.328 2.516 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](c4cnccn4)C3)nc2c1 ZINC001308112719 1324794500 /nfs/dbraw/zinc/79/45/00/1324794500.db2.gz KSKPERJPWVAFAR-NSHDSACASA-N 1 1 325.328 2.516 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1 ZINC001308120426 1324794512 /nfs/dbraw/zinc/79/45/12/1324794512.db2.gz JPDQDIRZNAZUGH-QAPCUYQASA-N 1 1 333.432 2.766 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC[C@]34CCOC4)n2)cc1 ZINC001308165795 1324796864 /nfs/dbraw/zinc/79/68/64/1324796864.db2.gz FIOXHUPVTHBLOA-QGZVFWFLSA-N 1 1 344.371 2.790 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCC[C@]34CCOC4)n2)cc1 ZINC001308165795 1324796867 /nfs/dbraw/zinc/79/68/67/1324796867.db2.gz FIOXHUPVTHBLOA-QGZVFWFLSA-N 1 1 344.371 2.790 10 5 EFBEMO CC[N@H+](CCNC(=O)/C=C(\C)C1CC1)Cc1ccccc1[N+](=O)[O-] ZINC001317477455 1324865975 /nfs/dbraw/zinc/86/59/75/1324865975.db2.gz PXUBMMFHJJGAKQ-WYMLVPIESA-N 1 1 331.416 2.889 10 5 EFBEMO CC[N@@H+](CCNC(=O)/C=C(\C)C1CC1)Cc1ccccc1[N+](=O)[O-] ZINC001317477455 1324865979 /nfs/dbraw/zinc/86/59/79/1324865979.db2.gz PXUBMMFHJJGAKQ-WYMLVPIESA-N 1 1 331.416 2.889 10 5 EFBEMO CC(C)(NC(=O)NCC[N@H+]1CCC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC001313401488 1325014593 /nfs/dbraw/zinc/01/45/93/1325014593.db2.gz WVMOOPLELHHOHW-UHFFFAOYSA-N 1 1 348.447 2.861 10 5 EFBEMO O=C(Cc1ccccc1)NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001321120396 1329345211 /nfs/dbraw/zinc/34/52/11/1329345211.db2.gz HZOFLGZEAVVJBP-PLNGDYQASA-N 1 1 345.424 2.661 10 5 EFBEMO Cc1sccc1C(=O)NCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001317442602 1328030655 /nfs/dbraw/zinc/03/06/55/1328030655.db2.gz BPDMJWPUKMVTRP-UHFFFAOYSA-N 1 1 333.413 2.827 10 5 EFBEMO C[N@@H+](CCNC(=O)CCc1cccs1)Cc1ccc([N+](=O)[O-])cc1 ZINC001317470756 1328057713 /nfs/dbraw/zinc/05/77/13/1328057713.db2.gz VKSNSVXDHUGKRL-UHFFFAOYSA-N 1 1 347.440 2.837 10 5 EFBEMO Cc1occc1C(=O)NCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001317547542 1328133193 /nfs/dbraw/zinc/13/31/93/1328133193.db2.gz HVNPGBVUSPQLJM-UHFFFAOYSA-N 1 1 343.383 2.891 10 5 EFBEMO CO[C@H]1C[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001321893657 1329415041 /nfs/dbraw/zinc/41/50/41/1329415041.db2.gz VECIKQAFJBSPFU-TXEJJXNPSA-N 1 1 329.194 2.967 10 5 EFBEMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001321893657 1329415044 /nfs/dbraw/zinc/41/50/44/1329415044.db2.gz VECIKQAFJBSPFU-TXEJJXNPSA-N 1 1 329.194 2.967 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1cc[nH]c1 ZINC001327212171 1330442705 /nfs/dbraw/zinc/44/27/05/1330442705.db2.gz CGXUUNHMWQTRTR-UHFFFAOYSA-N 1 1 330.388 2.517 10 5 EFBEMO CN(CCC[N@@H+](C)CC1CCC(C)(C)CC1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001327212467 1330443193 /nfs/dbraw/zinc/44/31/93/1330443193.db2.gz ICEYLKCMXYSCHH-HZPDHXFCSA-N 1 1 339.480 2.648 10 5 EFBEMO CN(CCC[N@H+](C)CC1CCC(C)(C)CC1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001327212467 1330443198 /nfs/dbraw/zinc/44/31/98/1330443198.db2.gz ICEYLKCMXYSCHH-HZPDHXFCSA-N 1 1 339.480 2.648 10 5 EFBEMO CN(CCC[N@@H+](C)CC1CCC(C)(C)CC1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001327212467 1330443203 /nfs/dbraw/zinc/44/32/03/1330443203.db2.gz ICEYLKCMXYSCHH-HZPDHXFCSA-N 1 1 339.480 2.648 10 5 EFBEMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC001332484138 1330977123 /nfs/dbraw/zinc/97/71/23/1330977123.db2.gz IVTLKYKAUJTNAI-HNNXBMFYSA-N 1 1 343.358 2.829 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[NH+]1CC(CC3CCOCC3)C1)OCCO2 ZINC001332725887 1331010464 /nfs/dbraw/zinc/01/04/64/1331010464.db2.gz XANXCZCOWZABCG-UHFFFAOYSA-N 1 1 348.399 2.615 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001332818529 1331032006 /nfs/dbraw/zinc/03/20/06/1331032006.db2.gz HHUAHMRHKDKPQJ-CYBMUJFWSA-N 1 1 337.395 2.657 10 5 EFBEMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@H](CCF)C2)nc1-c1ccncc1 ZINC001347237017 1332726250 /nfs/dbraw/zinc/72/62/50/1332726250.db2.gz DWCRFNOLEMTVTA-CYBMUJFWSA-N 1 1 333.367 2.882 10 5 EFBEMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H](CCF)C2)nc1-c1ccncc1 ZINC001347237017 1332726253 /nfs/dbraw/zinc/72/62/53/1332726253.db2.gz DWCRFNOLEMTVTA-CYBMUJFWSA-N 1 1 333.367 2.882 10 5 EFBEMO C[C@H](NC(=O)[C@H]1CC[C@H]2C[C@@H](C)C[N@H+]2C1)c1ccccc1[N+](=O)[O-] ZINC001347531137 1332753348 /nfs/dbraw/zinc/75/33/48/1332753348.db2.gz RCODYDOVASYDLR-QPSCCSFWSA-N 1 1 331.416 2.892 10 5 EFBEMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@H]21 ZINC001348127773 1332801847 /nfs/dbraw/zinc/80/18/47/1332801847.db2.gz RNQADTQCZODIPH-YXAMBPQSSA-N 1 1 349.456 2.532 10 5 EFBEMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C3CCCC3)[C@@H](C)C2)c1 ZINC001348349453 1332827618 /nfs/dbraw/zinc/82/76/18/1332827618.db2.gz QHTRKAINPKEEHY-ZDUSSCGKSA-N 1 1 347.415 2.692 10 5 EFBEMO C[C@H]1CCC[N@@H+](CCNC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001351261711 1333203055 /nfs/dbraw/zinc/20/30/55/1333203055.db2.gz SPBCVFRNOISTAC-ZDUSSCGKSA-N 1 1 337.395 2.515 10 5 EFBEMO C[C@@H]1C[C@@H]2CC[C@H](C(=O)N(C)CCc3ccccc3[N+](=O)[O-])C[N@H+]2C1 ZINC001352188958 1333419538 /nfs/dbraw/zinc/41/95/38/1333419538.db2.gz HSAPJTCNYNWJAI-PVAVHDDUSA-N 1 1 345.443 2.716 10 5 EFBEMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2Cc1ccc([N+](=O)[O-])cc1Br ZINC001354870999 1334565927 /nfs/dbraw/zinc/56/59/27/1334565927.db2.gz PRERCHPSHXNJKQ-BETUJISGSA-N 1 1 340.221 2.636 10 5 EFBEMO CC(C)[C@@H]1CCC[N@H+]1CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848475709 1334735094 /nfs/dbraw/zinc/73/50/94/1334735094.db2.gz STEKXDMPUPUAQV-IRXDYDNUSA-N 1 1 331.416 2.989 10 5 EFBEMO C[N@@H+](CC1CCCC1)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848476524 1334736426 /nfs/dbraw/zinc/73/64/26/1334736426.db2.gz ANQYWTNVWJJNSB-QGZVFWFLSA-N 1 1 331.416 2.990 10 5 EFBEMO C[C@H]1CC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCS1 ZINC000848484813 1334741504 /nfs/dbraw/zinc/74/15/04/1334741504.db2.gz FEPFPWYOEGTKDP-XJKSGUPXSA-N 1 1 349.456 2.696 10 5 EFBEMO C[C@H]1CCSCC[N@H+]1CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848485848 1334742433 /nfs/dbraw/zinc/74/24/33/1334742433.db2.gz YWNIFGQQPUEMAI-BBRMVZONSA-N 1 1 349.456 2.696 10 5 EFBEMO CC1=C[C@H](C)C[N@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848487825 1334744614 /nfs/dbraw/zinc/74/46/14/1334744614.db2.gz XRYFRAFCUJJEGQ-GUYCJALGSA-N 1 1 329.400 2.766 10 5 EFBEMO CC1=C[C@H](C)C[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848487825 1334744615 /nfs/dbraw/zinc/74/46/15/1334744615.db2.gz XRYFRAFCUJJEGQ-GUYCJALGSA-N 1 1 329.400 2.766 10 5 EFBEMO CC[N@H+](CCNC(=O)c1ccc(C)nc1)Cc1ccccc1[N+](=O)[O-] ZINC001492913137 1363819687 /nfs/dbraw/zinc/81/96/87/1363819687.db2.gz CXWLNBKYHAEEQK-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ccc(C)nc1)Cc1ccccc1[N+](=O)[O-] ZINC001492913137 1363819690 /nfs/dbraw/zinc/81/96/90/1363819690.db2.gz CXWLNBKYHAEEQK-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO Cc1cc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc(C)[nH+]1 ZINC001457706168 1395300413 /nfs/dbraw/zinc/30/04/13/1395300413.db2.gz VNGQFYGVAWEHQQ-UHFFFAOYSA-N 1 1 327.340 2.630 10 5 EFBEMO CC[N@H+]1CCN(c2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C[C@H]1C ZINC001458264615 1395433832 /nfs/dbraw/zinc/43/38/32/1395433832.db2.gz OGGLUWMYNHZBDF-LLVKDONJSA-N 1 1 345.359 2.582 10 5 EFBEMO CC[N@@H+](C)[C@H]1CCN(c2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C1 ZINC001458721539 1395563240 /nfs/dbraw/zinc/56/32/40/1395563240.db2.gz WPXXGRXMOXGOLN-LBPRGKRZSA-N 1 1 345.359 2.582 10 5 EFBEMO CC(C)[N@H+]1CCCC[C@H]1Cn1nnc(-c2ccccc2[N+](=O)[O-])n1 ZINC001459282516 1395785988 /nfs/dbraw/zinc/78/59/88/1395785988.db2.gz KPXWJVCQRHGTNH-ZDUSSCGKSA-N 1 1 330.392 2.511 10 5 EFBEMO O=C(CC[N@H+]1CC[C@@H]2[C@H](C1)C2(F)F)Nc1cc([N+](=O)[O-])ccc1F ZINC001459791229 1395983628 /nfs/dbraw/zinc/98/36/28/1395983628.db2.gz JPLGMUPXRFPRQX-MNOVXSKESA-N 1 1 343.305 2.650 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@H](CCO)CC2)o1 ZINC001460260057 1396016876 /nfs/dbraw/zinc/01/68/76/1396016876.db2.gz YAPCLHKCNMDYMU-ZDUSSCGKSA-N 1 1 346.387 2.629 10 5 EFBEMO C[C@@H]1Cc2n[nH]cc2C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC001460776240 1396253933 /nfs/dbraw/zinc/25/39/33/1396253933.db2.gz DFZMZHGGOSXDGD-CYBMUJFWSA-N 1 1 330.388 2.781 10 5 EFBEMO CCC(CC)Nc1cc[nH+]cc1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001468497830 1396962678 /nfs/dbraw/zinc/96/26/78/1396962678.db2.gz GKRDLDZCRDELIS-UHFFFAOYSA-N 1 1 344.371 2.970 10 5 EFBEMO Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001471236704 1397152816 /nfs/dbraw/zinc/15/28/16/1397152816.db2.gz WDOUSUOVAPPUBQ-OAHLLOKOSA-N 1 1 346.431 2.704 10 5 EFBEMO C[C@H](CNC(=O)NCC[N@H+]1CCC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC001471464193 1397174511 /nfs/dbraw/zinc/17/45/11/1397174511.db2.gz HGYSPSRIBQNWNM-CQSZACIVSA-N 1 1 348.447 2.729 10 5 EFBEMO C[N@H+]1C[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C(C)(C)C1 ZINC001472025940 1397235929 /nfs/dbraw/zinc/23/59/29/1397235929.db2.gz ITDKOELXLHWTCL-GFCCVEGCSA-N 1 1 345.321 2.684 10 5 EFBEMO O=C(CC[N@@H+]1CCC[C@@H]1c1ncccn1)Nc1ccccc1[N+](=O)[O-] ZINC001473659949 1397319674 /nfs/dbraw/zinc/31/96/74/1397319674.db2.gz LXZIQPIKMJBAFL-OAHLLOKOSA-N 1 1 341.371 2.551 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@@H]1c1ncccn1)Nc1ccccc1[N+](=O)[O-] ZINC001473659949 1397319681 /nfs/dbraw/zinc/31/96/81/1397319681.db2.gz LXZIQPIKMJBAFL-OAHLLOKOSA-N 1 1 341.371 2.551 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@H](O)CC(C)(C)C1 ZINC001473722157 1397324814 /nfs/dbraw/zinc/32/48/14/1397324814.db2.gz LPDZVJKMMAFHAU-BXUZGUMPSA-N 1 1 346.387 2.799 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@H](O)CC(C)(C)C1 ZINC001473722157 1397324817 /nfs/dbraw/zinc/32/48/17/1397324817.db2.gz LPDZVJKMMAFHAU-BXUZGUMPSA-N 1 1 346.387 2.799 10 5 EFBEMO CC(C)[C@H]1CN(C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC001479445822 1397727809 /nfs/dbraw/zinc/72/78/09/1397727809.db2.gz JHACVJNRMAKVED-WMLDXEAASA-N 1 1 348.447 2.680 10 5 EFBEMO C[N@H+](CCCNC(=O)C1(C(F)F)CC1)Cc1csc([N+](=O)[O-])c1 ZINC001479771968 1397834965 /nfs/dbraw/zinc/83/49/65/1397834965.db2.gz JYVRXOKZOVKRIQ-UHFFFAOYSA-N 1 1 347.387 2.640 10 5 EFBEMO C[N@@H+](CCCNC(=O)C1(C(F)F)CC1)Cc1csc([N+](=O)[O-])c1 ZINC001479771968 1397834970 /nfs/dbraw/zinc/83/49/70/1397834970.db2.gz JYVRXOKZOVKRIQ-UHFFFAOYSA-N 1 1 347.387 2.640 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1cc(C)no1)Cc1ccc([N+](=O)[O-])cc1 ZINC001479836942 1397932901 /nfs/dbraw/zinc/93/29/01/1397932901.db2.gz LRTBTVMANUXSBH-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO CCC(=CC(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)CC ZINC001494542794 1399372153 /nfs/dbraw/zinc/37/21/53/1399372153.db2.gz VIRXNDQPJUFFIW-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO CN(CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)/C=C/c1ccco1 ZINC001496654076 1400901776 /nfs/dbraw/zinc/90/17/76/1400901776.db2.gz ZYUGVZULZKCJLL-CMDGGOBGSA-N 1 1 343.383 2.791 10 5 EFBEMO CN(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)/C=C/c1ccco1 ZINC001496654076 1400901780 /nfs/dbraw/zinc/90/17/80/1400901780.db2.gz ZYUGVZULZKCJLL-CMDGGOBGSA-N 1 1 343.383 2.791 10 5 EFBEMO CN(CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)/C=C\c1ccco1 ZINC001496654078 1400901953 /nfs/dbraw/zinc/90/19/53/1400901953.db2.gz ZYUGVZULZKCJLL-HJWRWDBZSA-N 1 1 343.383 2.791 10 5 EFBEMO CN(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)/C=C\c1ccco1 ZINC001496654078 1400901958 /nfs/dbraw/zinc/90/19/58/1400901958.db2.gz ZYUGVZULZKCJLL-HJWRWDBZSA-N 1 1 343.383 2.791 10 5 EFBEMO Cc1nscc1C(=O)N(C)CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001496689441 1400922489 /nfs/dbraw/zinc/92/24/89/1400922489.db2.gz QBVKITOYCDJKEE-UHFFFAOYSA-N 1 1 348.428 2.564 10 5 EFBEMO CCc1occc1C(=O)NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001497567152 1401462070 /nfs/dbraw/zinc/46/20/70/1401462070.db2.gz ASFRZCAGOOLDHB-ONEGZZNKSA-N 1 1 349.412 2.888 10 5 EFBEMO O=C(CCCF)NCC1=CC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001508211873 1407349235 /nfs/dbraw/zinc/34/92/35/1407349235.db2.gz HNBPOOZXZHCNEZ-UHFFFAOYSA-N 1 1 335.379 2.593 10 5 EFBEMO O=C(CCCF)NCC1=CC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001508211873 1407349241 /nfs/dbraw/zinc/34/92/41/1407349241.db2.gz HNBPOOZXZHCNEZ-UHFFFAOYSA-N 1 1 335.379 2.593 10 5 EFBEMO CN(CCC[N@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)C(C)(F)F ZINC001502152857 1404051909 /nfs/dbraw/zinc/05/19/09/1404051909.db2.gz XIBOZSMWLWPXNZ-UHFFFAOYSA-N 1 1 335.376 2.592 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)C(C)(F)F ZINC001502152857 1404051915 /nfs/dbraw/zinc/05/19/15/1404051915.db2.gz XIBOZSMWLWPXNZ-UHFFFAOYSA-N 1 1 335.376 2.592 10 5 EFBEMO CC(C)c1ccccc1C[N@@H+](C)CCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001502192994 1404075124 /nfs/dbraw/zinc/07/51/24/1404075124.db2.gz MYFRSSXXCSLDKK-QZTJIDSGSA-N 1 1 347.459 2.756 10 5 EFBEMO CC(C)c1ccccc1C[N@H+](C)CCCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001502192994 1404075128 /nfs/dbraw/zinc/07/51/28/1404075128.db2.gz MYFRSSXXCSLDKK-QZTJIDSGSA-N 1 1 347.459 2.756 10 5 EFBEMO CC(C)c1ccccc1C[N@@H+](C)CCCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001502192994 1404075135 /nfs/dbraw/zinc/07/51/35/1404075135.db2.gz MYFRSSXXCSLDKK-QZTJIDSGSA-N 1 1 347.459 2.756 10 5 EFBEMO CCn1cc([N+](=O)[O-])c(C(=O)Nc2cccc3c2C[N@H+](C2CC2)C3)n1 ZINC001556070937 1415050932 /nfs/dbraw/zinc/05/09/32/1415050932.db2.gz VFVYMDINHVHVQQ-UHFFFAOYSA-N 1 1 341.371 2.542 10 5 EFBEMO C[N@H+]1C[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C(C)(C)C1 ZINC001558503437 1415183814 /nfs/dbraw/zinc/18/38/14/1415183814.db2.gz JZOHASOFAXQJHQ-SFHVURJKSA-N 1 1 349.434 2.751 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCC[N@H+]1CCCC1(C)C ZINC001559210123 1415230312 /nfs/dbraw/zinc/23/03/12/1415230312.db2.gz CHPZNWCMTGFINC-UHFFFAOYSA-N 1 1 335.404 2.976 10 5 EFBEMO O=[N+]([O-])c1cc(F)ccc1N1CC[NH+](Cc2ccc(O)cc2)CC1 ZINC001559262587 1415234046 /nfs/dbraw/zinc/23/40/46/1415234046.db2.gz NTLLQGBNKGFQLK-UHFFFAOYSA-N 1 1 331.347 2.762 10 5 EFBEMO C[C@H]1CN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[N@H+]1C1CCCC1 ZINC001559280777 1415236283 /nfs/dbraw/zinc/23/62/83/1415236283.db2.gz TWPSFXGCUGDMFM-LBPRGKRZSA-N 1 1 329.404 2.924 10 5 EFBEMO C[C@@H]1CN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[N@H+]1C1CCCC1 ZINC001559280776 1415236393 /nfs/dbraw/zinc/23/63/93/1415236393.db2.gz TWPSFXGCUGDMFM-GFCCVEGCSA-N 1 1 329.404 2.924 10 5 EFBEMO O=c1oc2cccc([N+](=O)[O-])c2n1Cc1cn2cc(Cl)ccc2[nH+]1 ZINC001559407097 1415243273 /nfs/dbraw/zinc/24/32/73/1415243273.db2.gz RFYHVQQXKHPXHR-UHFFFAOYSA-N 1 1 344.714 2.852 10 5 EFBEMO O=C(C[NH+]1CCC(C2CCC2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001559983624 1415259676 /nfs/dbraw/zinc/25/96/76/1415259676.db2.gz WIXUTPBTAQJJGU-UHFFFAOYSA-N 1 1 343.427 2.996 10 5 EFBEMO O=C(C[NH+]1CCC(C2CCC2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001559983027 1415260218 /nfs/dbraw/zinc/26/02/18/1415260218.db2.gz DPAGAPXGGGFPDY-UHFFFAOYSA-N 1 1 343.427 2.996 10 5 EFBEMO Cc1c(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)cccc1[N+](=O)[O-] ZINC001560066433 1415262571 /nfs/dbraw/zinc/26/25/71/1415262571.db2.gz VABINETWVUELSP-QGZVFWFLSA-N 1 1 345.355 2.809 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@@H](c3ncccn3)C2)c([N+](=O)[O-])cc1F ZINC001560176605 1415265520 /nfs/dbraw/zinc/26/55/20/1415265520.db2.gz CIBKFVZBMQLFLT-LLVKDONJSA-N 1 1 332.335 2.522 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@@H](c3ncccn3)C2)c([N+](=O)[O-])cc1F ZINC001560176605 1415265523 /nfs/dbraw/zinc/26/55/23/1415265523.db2.gz CIBKFVZBMQLFLT-LLVKDONJSA-N 1 1 332.335 2.522 10 5 EFBEMO CCOc1cc(C[N@H+]2CC[C@H](c3cnccn3)C2)ccc1[N+](=O)[O-] ZINC001560176745 1415265918 /nfs/dbraw/zinc/26/59/18/1415265918.db2.gz GLJPSWAMPDPXMR-AWEZNQCLSA-N 1 1 328.372 2.773 10 5 EFBEMO Cc1cncc(C(=O)NCCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001566442090 1415547628 /nfs/dbraw/zinc/54/76/28/1415547628.db2.gz OVXVNUNOJPTABH-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1ccns1)Cc1ccc([N+](=O)[O-])cc1 ZINC001566553307 1415637711 /nfs/dbraw/zinc/63/77/11/1415637711.db2.gz ZIZZONSCJIXWIU-UHFFFAOYSA-N 1 1 348.428 2.693 10 5 EFBEMO O=C(NCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccco1 ZINC001567435172 1416137019 /nfs/dbraw/zinc/13/70/19/1416137019.db2.gz DXAOZIMUEXCSAE-UHFFFAOYSA-N 1 1 329.356 2.582 10 5 EFBEMO CCCC1(C(=O)NCC2C[NH+](Cc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001567840448 1416295307 /nfs/dbraw/zinc/29/53/07/1416295307.db2.gz UMYRMNPFWXAQMP-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO CC[C@H](NC(=O)N1CC[N@@H+](CC)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC001685996856 1416785435 /nfs/dbraw/zinc/78/54/35/1416785435.db2.gz ZODPEIWJARHHOH-BBRMVZONSA-N 1 1 334.420 2.782 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1ocnc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001689925684 1417095889 /nfs/dbraw/zinc/09/58/89/1417095889.db2.gz XEOJTKXXVIDBMC-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO CCC(=CC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21)CC ZINC001690511454 1417220004 /nfs/dbraw/zinc/22/00/04/1417220004.db2.gz BLLMMCFMIANEEO-MNZLEMJZSA-N 1 1 343.427 2.888 10 5 EFBEMO C[N@@H+](CCCNC(=O)C(C)(C)C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001712965984 1418303781 /nfs/dbraw/zinc/30/37/81/1418303781.db2.gz OGPFKHVETDOCGE-UHFFFAOYSA-N 1 1 333.432 2.969 10 5 EFBEMO Cc1cocc1C(=O)NCCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001712965335 1418305075 /nfs/dbraw/zinc/30/50/75/1418305075.db2.gz RXKIDMMZUWGMPU-UHFFFAOYSA-N 1 1 331.372 2.748 10 5 EFBEMO C[N@H+](CCNC(=O)c1c[nH]cc1C1CC1)Cc1ccccc1[N+](=O)[O-] ZINC001714569761 1418608544 /nfs/dbraw/zinc/60/85/44/1418608544.db2.gz PVHVUPRVQPFPGV-UHFFFAOYSA-N 1 1 342.399 2.662 10 5 EFBEMO C[N@@H+](CCNC(=O)c1c[nH]cc1C1CC1)Cc1ccccc1[N+](=O)[O-] ZINC001714569761 1418608546 /nfs/dbraw/zinc/60/85/46/1418608546.db2.gz PVHVUPRVQPFPGV-UHFFFAOYSA-N 1 1 342.399 2.662 10 5 EFBEMO O=C(NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccsc1 ZINC001716263389 1418747647 /nfs/dbraw/zinc/74/76/47/1418747647.db2.gz BOYJVZHPVNVCGX-UPHRSURJSA-N 1 1 337.426 2.794 10 5 EFBEMO Cc1cc(C(=O)NC/C=C/C[NH2+]Cc2csc([N+](=O)[O-])c2)co1 ZINC001716287125 1418752354 /nfs/dbraw/zinc/75/23/54/1418752354.db2.gz KZQWRLSISGMASQ-NSCUHMNNSA-N 1 1 335.385 2.634 10 5 EFBEMO CC1([NH2+]CCC2CCCCC2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001724954571 1425162703 /nfs/dbraw/zinc/16/27/03/1425162703.db2.gz OLJGZZXUMVRRCZ-HZPDHXFCSA-N 1 1 337.464 2.593 10 5 EFBEMO CN(CC(C)(C)C[NH2+]CCC1CCCCC1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001725140379 1425329045 /nfs/dbraw/zinc/32/90/45/1425329045.db2.gz QSVDOEOFLCVWPO-HZPDHXFCSA-N 1 1 339.480 2.696 10 5 EFBEMO CC[C@H](NC(=O)NCC[N@H+]1CCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000893449881 715526488 /nfs/dbraw/zinc/52/64/88/715526488.db2.gz KBHAGSFAWMSATR-CJNGLKHVSA-N 1 1 334.420 2.829 10 5 EFBEMO C[C@@H](NC(=O)N1CC[N@@H+](C)C(C)(C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000925246732 724484886 /nfs/dbraw/zinc/48/48/86/724484886.db2.gz GSQRRUGTVDRMDE-CYBMUJFWSA-N 1 1 334.420 2.782 10 5 EFBEMO COC(=O)[C@H]1[C@@H](C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1(F)F ZINC000893945938 720178285 /nfs/dbraw/zinc/17/82/85/720178285.db2.gz OPKIRJDGHYQUCW-ZIAGYGMSSA-N 1 1 340.326 2.614 10 5 EFBEMO COC(=O)[C@H]1[C@@H](C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1(F)F ZINC000893945938 720178288 /nfs/dbraw/zinc/17/82/88/720178288.db2.gz OPKIRJDGHYQUCW-ZIAGYGMSSA-N 1 1 340.326 2.614 10 5 EFBEMO C[C@@H]1C[NH+](Cc2cc([N+](=O)[O-])ccc2Br)C[C@@H](C)C1O ZINC000930997061 720632666 /nfs/dbraw/zinc/63/26/66/720632666.db2.gz WJDKRKRDWBFQNW-NXEZZACHSA-N 1 1 343.221 2.806 10 5 EFBEMO C[NH+]1CCN(c2ccc(Nc3ccncc3[N+](=O)[O-])cc2Cl)CC1 ZINC000727432191 724032816 /nfs/dbraw/zinc/03/28/16/724032816.db2.gz FLAKNFGUCITFDD-UHFFFAOYSA-N 1 1 347.806 2.561 10 5 EFBEMO COCc1ncc2c(n1)CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C2 ZINC000895415144 724124169 /nfs/dbraw/zinc/12/41/69/724124169.db2.gz LOQPSDZDKONNCK-XQRVVYSFSA-N 1 1 340.383 2.603 10 5 EFBEMO CC(=O)c1ccc([N+](=O)[O-])cc1N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12 ZINC000895570962 724198415 /nfs/dbraw/zinc/19/84/15/724198415.db2.gz XSQICZMYIDHWOE-ZBFHGGJFSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1ccc([N+](=O)[O-])cc1N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000895570962 724198418 /nfs/dbraw/zinc/19/84/18/724198418.db2.gz XSQICZMYIDHWOE-ZBFHGGJFSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(C)(C)OC1CC([N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1 ZINC000341627192 724200737 /nfs/dbraw/zinc/20/07/37/724200737.db2.gz PROXSIKGXGITGA-GRTSSRMGSA-N 1 1 334.420 2.822 10 5 EFBEMO CC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCC[N@@H+]2CCSC[C@H]12 ZINC000895569840 724205488 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EFBEMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@]4(CCCOC4)C3)nc2c1 ZINC000444653519 250324189 /nfs/dbraw/zinc/32/41/89/250324189.db2.gz UWTJECPOKFACID-QGZVFWFLSA-N 1 1 330.388 2.864 10 5 EFBEMO CCc1ccc(NC(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000095418295 218357203 /nfs/dbraw/zinc/35/72/03/218357203.db2.gz IONWCFWAQFLRBK-SWLSCSKDSA-N 1 1 334.420 2.961 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1 ZINC000449673628 251110813 /nfs/dbraw/zinc/11/08/13/251110813.db2.gz PKOPVGMRSYRRKP-JOYOIKCWSA-N 1 1 338.713 2.993 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1 ZINC000449673628 251110814 /nfs/dbraw/zinc/11/08/14/251110814.db2.gz PKOPVGMRSYRRKP-JOYOIKCWSA-N 1 1 338.713 2.993 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@]3(CCOC3)C2)c([N+](=O)[O-])cc1OC ZINC000449688199 251116681 /nfs/dbraw/zinc/11/66/81/251116681.db2.gz SZJQNNNITCDYLU-KRWDZBQOSA-N 1 1 336.388 2.615 10 5 EFBEMO COC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000452096656 251784908 /nfs/dbraw/zinc/78/49/08/251784908.db2.gz YKJCEHPMASAFJB-UONOGXRCSA-N 1 1 335.404 2.670 10 5 EFBEMO CCn1cc(C[N@H+]2CCCN(c3ccc([N+](=O)[O-])c(C)c3)CC2)cn1 ZINC000112695473 220375952 /nfs/dbraw/zinc/37/59/52/220375952.db2.gz JEIXGFMRMINNJA-UHFFFAOYSA-N 1 1 343.431 2.832 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H]1C ZINC000345942986 142122041 /nfs/dbraw/zinc/12/20/41/142122041.db2.gz FKJYJXDCHYRNOF-RYUDHWBXSA-N 1 1 330.388 2.631 10 5 EFBEMO C[N@@H+](C[C@@H]1CC=CCC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000344033868 145351020 /nfs/dbraw/zinc/35/10/20/145351020.db2.gz FZGXFZZNIHYTAW-PBHICJAKSA-N 1 1 329.400 2.988 10 5 EFBEMO C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@@H]1CC=CCC1 ZINC000344076923 145362433 /nfs/dbraw/zinc/36/24/33/145362433.db2.gz WFMSIMWSWVNZJU-CQSZACIVSA-N 1 1 329.400 2.772 10 5 EFBEMO COc1ccc(NC(=O)C[N@@H+](C)C[C@H]2CC=CCC2)c([N+](=O)[O-])c1 ZINC000344092522 145366778 /nfs/dbraw/zinc/36/67/78/145366778.db2.gz VTGNJYMQTXYUCC-ZDUSSCGKSA-N 1 1 333.388 2.830 10 5 EFBEMO COc1ccc(F)c(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000351642738 146167185 /nfs/dbraw/zinc/16/71/85/146167185.db2.gz XPGLDFWFPYUPKK-ZDUSSCGKSA-N 1 1 346.362 2.824 10 5 EFBEMO COc1ccc(F)c(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000351642738 146167186 /nfs/dbraw/zinc/16/71/86/146167186.db2.gz XPGLDFWFPYUPKK-ZDUSSCGKSA-N 1 1 346.362 2.824 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[NH2+][C@H](CO)c2ccsc2)cccc1[N+](=O)[O-] ZINC000352033093 146271453 /nfs/dbraw/zinc/27/14/53/146271453.db2.gz QJUZJBSSIJWMAK-SMDDNHRTSA-N 1 1 349.412 2.615 10 5 EFBEMO COC(=O)c1cc(C(C)(C)[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])no1 ZINC000353251050 146431868 /nfs/dbraw/zinc/43/18/68/146431868.db2.gz QDZFZUWMCAZERM-SOFGYWHQSA-N 1 1 345.355 2.908 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@H](C)[C@@H]1C ZINC000355780551 147060589 /nfs/dbraw/zinc/06/05/89/147060589.db2.gz ANHUHAJMJYKTFG-AGIUHOORSA-N 1 1 335.404 2.908 10 5 EFBEMO C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000355791883 147065485 /nfs/dbraw/zinc/06/54/85/147065485.db2.gz XYTFJAUZVKAGKX-GRYCIOLGSA-N 1 1 349.387 2.628 10 5 EFBEMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000355791883 147065487 /nfs/dbraw/zinc/06/54/87/147065487.db2.gz XYTFJAUZVKAGKX-GRYCIOLGSA-N 1 1 349.387 2.628 10 5 EFBEMO C[C@@H]1CC[C@]2(CC[N@@H+](C[C@H](O)COc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000359540595 148115803 /nfs/dbraw/zinc/11/58/03/148115803.db2.gz CNRODHMHJWPBLD-HFTRVMKXSA-N 1 1 334.416 2.847 10 5 EFBEMO C[C@@H]1CC[C@@]2(CC[N@@H+](C[C@@H](O)COc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000359540597 148116324 /nfs/dbraw/zinc/11/63/24/148116324.db2.gz CNRODHMHJWPBLD-QGPMSJSTSA-N 1 1 334.416 2.847 10 5 EFBEMO CN(C)c1cc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc[nH+]1 ZINC000359648804 148151032 /nfs/dbraw/zinc/15/10/32/148151032.db2.gz NGBMRXVCRVLDFQ-UHFFFAOYSA-N 1 1 325.328 2.789 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](Cc3ccncc3)C2)c1 ZINC000360344690 148336337 /nfs/dbraw/zinc/33/63/37/148336337.db2.gz OJAXJCNOEGBGOP-INIZCTEOSA-N 1 1 327.384 2.933 10 5 EFBEMO COC(=O)/C=C/c1ccc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000363155422 148937634 /nfs/dbraw/zinc/93/76/34/148937634.db2.gz NIZNFXTXGMEJOO-IPKOWEFYSA-N 1 1 345.399 2.820 10 5 EFBEMO CC[C@@H](NC(=O)N1CCC[N@H+]2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000363312512 148957301 /nfs/dbraw/zinc/95/73/01/148957301.db2.gz LUOMKWDHGPEPTK-DLBZAZTESA-N 1 1 346.431 2.926 10 5 EFBEMO COc1cc(N2CCC[C@@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1F ZINC000375949223 286228900 /nfs/dbraw/zinc/22/89/00/286228900.db2.gz SJKVPGDTBFOXEF-LLVKDONJSA-N 1 1 334.351 2.860 10 5 EFBEMO O=C1C[C@H]([C@H]2CCCC[N@@H+]2Cc2cc([N+](=O)[O-])ccc2Cl)CN1 ZINC000372859340 151071809 /nfs/dbraw/zinc/07/18/09/151071809.db2.gz QUIDNZWDJJRDNF-XHDPSFHLSA-N 1 1 337.807 2.739 10 5 EFBEMO CC1=C(c2ccco2)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000374539060 151365058 /nfs/dbraw/zinc/36/50/58/151365058.db2.gz UBOMYIDSBIBIPO-UHFFFAOYSA-N 1 1 341.367 2.966 10 5 EFBEMO CCOCC[N@@H+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)C[C@@H]1CC ZINC000122844225 222170406 /nfs/dbraw/zinc/17/04/06/222170406.db2.gz KXRYJMZFVQVFQE-LBPRGKRZSA-N 1 1 342.827 2.580 10 5 EFBEMO CCOCC[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)C[C@@H]1CC ZINC000122844225 222170408 /nfs/dbraw/zinc/17/04/08/222170408.db2.gz KXRYJMZFVQVFQE-LBPRGKRZSA-N 1 1 342.827 2.580 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000123853121 222341777 /nfs/dbraw/zinc/34/17/77/222341777.db2.gz LKIUJNGLRQGUNA-NWDGAFQWSA-N 1 1 337.445 2.871 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000123485703 222286387 /nfs/dbraw/zinc/28/63/87/222286387.db2.gz PHBNQBPSJKOPNO-HUUCEWRRSA-N 1 1 348.447 2.646 10 5 EFBEMO C[C@H]1C(=O)NCCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000189081188 265170870 /nfs/dbraw/zinc/17/08/70/265170870.db2.gz NNUDIKIZZSNIIM-LBPRGKRZSA-N 1 1 329.356 2.565 10 5 EFBEMO C[C@H]1C(=O)NCCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000189081188 265170875 /nfs/dbraw/zinc/17/08/75/265170875.db2.gz NNUDIKIZZSNIIM-LBPRGKRZSA-N 1 1 329.356 2.565 10 5 EFBEMO C[C@@H]1C(=O)NCCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000189081166 265171419 /nfs/dbraw/zinc/17/14/19/265171419.db2.gz NNUDIKIZZSNIIM-GFCCVEGCSA-N 1 1 329.356 2.565 10 5 EFBEMO C[C@@H]1C(=O)NCCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000189081166 265171422 /nfs/dbraw/zinc/17/14/22/265171422.db2.gz NNUDIKIZZSNIIM-GFCCVEGCSA-N 1 1 329.356 2.565 10 5 EFBEMO Cc1cc(NCCCCN2CCOCC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000272790482 266382708 /nfs/dbraw/zinc/38/27/08/266382708.db2.gz CAZMPJYFKDPSPM-UHFFFAOYSA-N 1 1 344.415 2.976 10 5 EFBEMO COc1ccc(NC(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000272848389 266397087 /nfs/dbraw/zinc/39/70/87/266397087.db2.gz PWXFOASJNMPZJI-AAEUAGOBSA-N 1 1 336.392 2.550 10 5 EFBEMO COc1ccc(NC(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000272848392 266397266 /nfs/dbraw/zinc/39/72/66/266397266.db2.gz PWXFOASJNMPZJI-YPMHNXCESA-N 1 1 336.392 2.550 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(=O)NCC(F)(F)F)C1 ZINC000275109630 266753514 /nfs/dbraw/zinc/75/35/14/266753514.db2.gz MVISZJIAZXXUPW-ZYHUDNBSSA-N 1 1 345.321 2.656 10 5 EFBEMO COC(=O)c1cc(N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)cc(C)c1[N+](=O)[O-] ZINC000277042961 267104642 /nfs/dbraw/zinc/10/46/42/267104642.db2.gz PIDOHMQDOAQMBN-CJNGLKHVSA-N 1 1 347.415 2.610 10 5 EFBEMO C[C@@H]1C[N@@H+](CCCNCc2cc([N+](=O)[O-])ccc2Cl)CCCO1 ZINC000278044003 267327938 /nfs/dbraw/zinc/32/79/38/267327938.db2.gz XSBXOOZAWWOCPW-CYBMUJFWSA-N 1 1 341.839 2.839 10 5 EFBEMO COc1cc(CN2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])cc1F ZINC000274350645 273133106 /nfs/dbraw/zinc/13/31/06/273133106.db2.gz WYOGRJDDMSSDSZ-UHFFFAOYSA-N 1 1 334.351 2.845 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)nc1 ZINC000281828065 273473551 /nfs/dbraw/zinc/47/35/51/273473551.db2.gz ICNWVVWBVADWNC-ZDUSSCGKSA-N 1 1 327.388 2.907 10 5 EFBEMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)COCc1ccccc1 ZINC000285453578 274002476 /nfs/dbraw/zinc/00/24/76/274002476.db2.gz YRNIJRZBRKAWIH-SFHVURJKSA-N 1 1 344.411 2.647 10 5 EFBEMO COC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000172123451 274044334 /nfs/dbraw/zinc/04/43/34/274044334.db2.gz SHGKUQYAEIJPMD-QGZVFWFLSA-N 1 1 344.367 2.939 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000286110051 274135569 /nfs/dbraw/zinc/13/55/69/274135569.db2.gz LMVFHTKYIRXEFD-INIZCTEOSA-N 1 1 343.387 2.792 10 5 EFBEMO COc1cccc(N2CC[NH+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000185079905 274148096 /nfs/dbraw/zinc/14/80/96/274148096.db2.gz DFWIJUBQCPQNTA-UHFFFAOYSA-N 1 1 327.384 2.926 10 5 EFBEMO Cc1cc(N2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000253477682 274707678 /nfs/dbraw/zinc/70/76/78/274707678.db2.gz HBDKVJXEKWIYKA-UHFFFAOYSA-N 1 1 347.806 2.982 10 5 EFBEMO O=c1[nH]c2ccccc2cc1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088605486 275042604 /nfs/dbraw/zinc/04/26/04/275042604.db2.gz JHBGRFVGUXVOBN-UHFFFAOYSA-N 1 1 335.363 2.995 10 5 EFBEMO O=c1[nH]c2ccccc2cc1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088605486 275042606 /nfs/dbraw/zinc/04/26/06/275042606.db2.gz JHBGRFVGUXVOBN-UHFFFAOYSA-N 1 1 335.363 2.995 10 5 EFBEMO CC(C)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)cc1[N+](=O)[O-] ZINC000364970698 276053156 /nfs/dbraw/zinc/05/31/56/276053156.db2.gz HREVPNZWPNOFMI-YSVLISHTSA-N 1 1 331.416 2.804 10 5 EFBEMO CC(C)c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)cc1[N+](=O)[O-] ZINC000364970698 276053157 /nfs/dbraw/zinc/05/31/57/276053157.db2.gz HREVPNZWPNOFMI-YSVLISHTSA-N 1 1 331.416 2.804 10 5 EFBEMO CC[N@H+]1CCC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000173088823 276167636 /nfs/dbraw/zinc/16/76/36/276167636.db2.gz QORBHCMHOJMVHU-LLVKDONJSA-N 1 1 345.321 2.828 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H](C)C1 ZINC000079461286 276214089 /nfs/dbraw/zinc/21/40/89/276214089.db2.gz JWHNRUZRJFNWGH-CXAGYDPISA-N 1 1 349.431 2.623 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000348707209 276224411 /nfs/dbraw/zinc/22/44/11/276224411.db2.gz RJEQRHKYOCFJND-GJZGRUSLSA-N 1 1 348.447 2.504 10 5 EFBEMO CC[C@@H]1C[C@@H]([NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000421395447 280537419 /nfs/dbraw/zinc/53/74/19/280537419.db2.gz YKNJVPWLIKSMJP-UAGQMJEPSA-N 1 1 344.415 2.965 10 5 EFBEMO CC[C@@H]1C[C@H]([NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000421395445 280560710 /nfs/dbraw/zinc/56/07/10/280560710.db2.gz YKNJVPWLIKSMJP-DJIMGWMZSA-N 1 1 344.415 2.965 10 5 EFBEMO CC[C@@H]1C[C@H]([NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000421395446 280560934 /nfs/dbraw/zinc/56/09/34/280560934.db2.gz YKNJVPWLIKSMJP-OIISXLGYSA-N 1 1 344.415 2.965 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H](C)[C@H](N2CCOCC2)C1 ZINC000245524386 281022710 /nfs/dbraw/zinc/02/27/10/281022710.db2.gz NMVKYIIXOKHCQF-RVKKMQEKSA-N 1 1 333.432 2.617 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000175048961 281192652 /nfs/dbraw/zinc/19/26/52/281192652.db2.gz HVQLIONIBKLLMG-WCQYABFASA-N 1 1 337.807 2.947 10 5 EFBEMO O=[N+]([O-])c1cc(C[NH+]2CCC(OC[C@@H]3CCOC3)CC2)cs1 ZINC000131896734 293212227 /nfs/dbraw/zinc/21/22/27/293212227.db2.gz IYSUEZQKYGREHI-GFCCVEGCSA-N 1 1 326.418 2.674 10 5 EFBEMO NC(=O)c1ccc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)c([N+](=O)[O-])c1 ZINC000152967695 293355211 /nfs/dbraw/zinc/35/52/11/293355211.db2.gz XUHHXHDTVAGIGY-MRXNPFEDSA-N 1 1 347.415 2.617 10 5 EFBEMO CC[C@H](NC(=O)[C@@H]1CCn2c(C)[nH+]cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000290489062 294100425 /nfs/dbraw/zinc/10/04/25/294100425.db2.gz VYBPZIDMDUBFQN-PBHICJAKSA-N 1 1 342.399 2.930 10 5 EFBEMO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000175136972 294385532 /nfs/dbraw/zinc/38/55/32/294385532.db2.gz PYGFNSROQAFVJN-INIZCTEOSA-N 1 1 342.399 2.759 10 5 EFBEMO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000175136972 294385536 /nfs/dbraw/zinc/38/55/36/294385536.db2.gz PYGFNSROQAFVJN-INIZCTEOSA-N 1 1 342.399 2.759 10 5 EFBEMO Cn1ccnc1[C@H]([NH2+][C@H]1CCC[C@@H](CO)C1)c1cccc([N+](=O)[O-])c1 ZINC000414327071 294429137 /nfs/dbraw/zinc/42/91/37/294429137.db2.gz BCSIDWWLHDRTIP-UKPHBRMFSA-N 1 1 344.415 2.558 10 5 EFBEMO CC[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000293932779 295081873 /nfs/dbraw/zinc/08/18/73/295081873.db2.gz YXIADFIXJIFYFQ-SNVBAGLBSA-N 1 1 345.321 2.685 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1 ZINC000294092989 295109444 /nfs/dbraw/zinc/10/94/44/295109444.db2.gz XQWHYRMSVNZJKH-PHIMTYICSA-N 1 1 325.796 2.721 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1C[C@@H](C)[N@@H+](C)[C@@H](C)C1 ZINC000294092989 295109445 /nfs/dbraw/zinc/10/94/45/295109445.db2.gz XQWHYRMSVNZJKH-PHIMTYICSA-N 1 1 325.796 2.721 10 5 EFBEMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@](C)(F)C2)c([N+](=O)[O-])c1 ZINC000295570173 295342604 /nfs/dbraw/zinc/34/26/04/295342604.db2.gz YSCDHPPCTUXFLP-INIZCTEOSA-N 1 1 339.367 2.756 10 5 EFBEMO C[C@H]1CC[N@H+](CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000299677471 311109983 /nfs/dbraw/zinc/10/99/83/311109983.db2.gz UPJFGZSPHNYESA-NSHDSACASA-N 1 1 346.412 2.999 10 5 EFBEMO C[C@H]1CC[N@@H+](CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000299677471 311109985 /nfs/dbraw/zinc/10/99/85/311109985.db2.gz UPJFGZSPHNYESA-NSHDSACASA-N 1 1 346.412 2.999 10 5 EFBEMO Cc1cc([N+](=O)[O-])cnc1NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000301181097 311122982 /nfs/dbraw/zinc/12/29/82/311122982.db2.gz ZJAIQCXDEPKQQZ-UHFFFAOYSA-N 1 1 342.399 2.743 10 5 EFBEMO COc1cc(F)c([N+](=O)[O-])c(NC[C@@H](C(C)C)[NH+]2CCOCC2)c1 ZINC000301361358 311133592 /nfs/dbraw/zinc/13/35/92/311133592.db2.gz QIEXIFKMZCGYPJ-HNNXBMFYSA-N 1 1 341.383 2.511 10 5 EFBEMO COC(=O)c1cc(N[C@@H]2CC[N@H+](C3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000301405760 311135782 /nfs/dbraw/zinc/13/57/82/311135782.db2.gz ULNYSXTULDMTMQ-CYBMUJFWSA-N 1 1 333.388 2.810 10 5 EFBEMO COC(=O)c1cc(N[C@H]2CC[N@H+](C3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000301405761 311135884 /nfs/dbraw/zinc/13/58/84/311135884.db2.gz ULNYSXTULDMTMQ-ZDUSSCGKSA-N 1 1 333.388 2.810 10 5 EFBEMO COc1cc(NC[C@@H]2C[N@@H+](CC(C)C)CCO2)c([N+](=O)[O-])cc1F ZINC000301608693 311147426 /nfs/dbraw/zinc/14/74/26/311147426.db2.gz ACTHVJQKIVHNGX-GFCCVEGCSA-N 1 1 341.383 2.511 10 5 EFBEMO Cc1nc(NCc2ccc(C[NH+]3CCOCC3)cc2)ccc1[N+](=O)[O-] ZINC000301628586 311148343 /nfs/dbraw/zinc/14/83/43/311148343.db2.gz ICHWWNDLUGDECF-UHFFFAOYSA-N 1 1 342.399 2.743 10 5 EFBEMO COc1cc(NC[C@@H](C(C)C)[NH+]2CCOCC2)c([N+](=O)[O-])cc1F ZINC000301625879 311148538 /nfs/dbraw/zinc/14/85/38/311148538.db2.gz PYHHVUGMKCUEON-HNNXBMFYSA-N 1 1 341.383 2.511 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1N1CCC[C@H]1C[N@@H+]1CCC[C@H]1CO ZINC000301728105 311155063 /nfs/dbraw/zinc/15/50/63/311155063.db2.gz RATMFQXIHOHMCH-KBPBESRZSA-N 1 1 339.823 2.674 10 5 EFBEMO C[C@H]1CCC[N@@H+](CCCCNc2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC000301923114 311166946 /nfs/dbraw/zinc/16/69/46/311166946.db2.gz LNRIBLDJDVQAER-ZDUSSCGKSA-N 1 1 332.408 2.562 10 5 EFBEMO C[N@@H+](CCCNc1ccc2ncc([N+](=O)[O-])n2n1)C1CCCCC1 ZINC000301938717 311167761 /nfs/dbraw/zinc/16/77/61/311167761.db2.gz SPEPXYYDRPZPFJ-UHFFFAOYSA-N 1 1 332.408 2.704 10 5 EFBEMO O=[N+]([O-])c1ccc(CO)cc1N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000302065812 311175827 /nfs/dbraw/zinc/17/58/27/311175827.db2.gz UIJPVKFFHUPWCN-GOEBONIOSA-N 1 1 331.416 2.540 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1N1CCCC[C@@H]1C[NH+]1CCOCC1 ZINC000302774147 311200317 /nfs/dbraw/zinc/20/03/17/311200317.db2.gz NZJYIJQAFNCRKP-CQSZACIVSA-N 1 1 339.823 2.939 10 5 EFBEMO O=[N+]([O-])c1ccc(F)cc1NC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000302823481 311202837 /nfs/dbraw/zinc/20/28/37/311202837.db2.gz UXMAGQOKIAVVEY-MRXNPFEDSA-N 1 1 345.374 2.565 10 5 EFBEMO C[C@@H](C[NH+]1CCOCC1)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000330623149 311325180 /nfs/dbraw/zinc/32/51/80/311325180.db2.gz DMAOLBDAIDYUTK-ZDUSSCGKSA-N 1 1 349.431 2.799 10 5 EFBEMO CC(C)(C)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1O ZINC000330832087 311337599 /nfs/dbraw/zinc/33/75/99/311337599.db2.gz HJAHQZLUAFKCFR-CVEARBPZSA-N 1 1 349.431 2.652 10 5 EFBEMO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@H]([NH3+])c1ccccc1 ZINC000414826327 312054919 /nfs/dbraw/zinc/05/49/19/312054919.db2.gz FMMOPTYJCXUMDA-DYVFJYSZSA-N 1 1 342.399 2.602 10 5 EFBEMO CCn1nncc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000418032905 312312971 /nfs/dbraw/zinc/31/29/71/312312971.db2.gz MQSGULXLEZHSJR-UHFFFAOYSA-N 1 1 329.282 2.515 10 5 EFBEMO CCOc1cc(C[NH2+][C@@](C)(CO)c2cccc(O)c2)ccc1[N+](=O)[O-] ZINC000451044041 312804756 /nfs/dbraw/zinc/80/47/56/312804756.db2.gz UOMJLPHCRJJKIJ-SFHVURJKSA-N 1 1 346.383 2.696 10 5 EFBEMO CC[C@H]([NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(=O)NC ZINC000453421323 312902223 /nfs/dbraw/zinc/90/22/23/312902223.db2.gz WMWPHNKLQMXGGX-DLBZAZTESA-N 1 1 327.384 2.798 10 5 EFBEMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cn2)C1 ZINC000531627858 317293285 /nfs/dbraw/zinc/29/32/85/317293285.db2.gz RAAUUWVIBPZGQM-CYBMUJFWSA-N 1 1 334.420 2.620 10 5 EFBEMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000548125645 318076250 /nfs/dbraw/zinc/07/62/50/318076250.db2.gz ARPREAONFNRUBZ-HNNXBMFYSA-N 1 1 348.447 2.730 10 5 EFBEMO O=C(c1ccc([N+](=O)[O-])s1)N1CC[NH+](CC23CCC(CC2)C3)CC1 ZINC000578593886 320219027 /nfs/dbraw/zinc/21/90/27/320219027.db2.gz CKVKTWSPGXAWGL-UHFFFAOYSA-N 1 1 349.456 2.994 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H](Nc2ncccn2)C1 ZINC000580312856 324139511 /nfs/dbraw/zinc/13/95/11/324139511.db2.gz JFLQTDRTUYGEBC-OMVNSRBRSA-N 1 1 325.372 2.584 10 5 EFBEMO Cc1nc(N[C@@H]2CC[N@H+](C[C@@H]3CCCO3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000095966042 473233007 /nfs/dbraw/zinc/23/30/07/473233007.db2.gz OWSOHGRCOGBKKM-AEGPPILISA-N 1 1 334.420 2.600 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000184877572 473261431 /nfs/dbraw/zinc/26/14/31/473261431.db2.gz KCLYPPAFFGTAII-WQGACYEGSA-N 1 1 337.395 2.682 10 5 EFBEMO C[N@H+](Cc1cccnc1)C[C@@H]1CCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000190488863 473292489 /nfs/dbraw/zinc/29/24/89/473292489.db2.gz JDUHELZMFSUSRK-KRWDZBQOSA-N 1 1 340.427 2.944 10 5 EFBEMO CCn1cc(C[N@@H+]2CCCN(c3cccc(F)c3[N+](=O)[O-])CC2)cn1 ZINC000112695487 473294784 /nfs/dbraw/zinc/29/47/84/473294784.db2.gz NHEALAKXGNKMFF-UHFFFAOYSA-N 1 1 347.394 2.663 10 5 EFBEMO CCn1cc(C[N@H+]2CCCN(c3cccc(F)c3[N+](=O)[O-])CC2)cn1 ZINC000112695487 473294789 /nfs/dbraw/zinc/29/47/89/473294789.db2.gz NHEALAKXGNKMFF-UHFFFAOYSA-N 1 1 347.394 2.663 10 5 EFBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000177138095 473314744 /nfs/dbraw/zinc/31/47/44/473314744.db2.gz KWCDCNKUUDHFJU-CYBMUJFWSA-N 1 1 332.335 2.544 10 5 EFBEMO CC[N@H+]1CCC[C@@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)C1 ZINC000171430808 473385432 /nfs/dbraw/zinc/38/54/32/473385432.db2.gz YTJBLEODUUXDAR-MRXNPFEDSA-N 1 1 348.447 2.999 10 5 EFBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NCCC[N@H+](C)Cc1ccccc1 ZINC000053639334 472026434 /nfs/dbraw/zinc/02/64/34/472026434.db2.gz NQMDMGYUXQTNQV-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000068203188 472149044 /nfs/dbraw/zinc/14/90/44/472149044.db2.gz NUGHSCDBFLZFDZ-CQSZACIVSA-N 1 1 344.415 2.540 10 5 EFBEMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCN(C[C@H]2CCCC[N@H+]2C)CC1 ZINC000075718688 472188630 /nfs/dbraw/zinc/18/86/30/472188630.db2.gz BFKBLJBTCJFVLQ-IAGOWNOFSA-N 1 1 346.475 2.758 10 5 EFBEMO Cc1sc(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000043086147 472198130 /nfs/dbraw/zinc/19/81/30/472198130.db2.gz GELWEBHXRVFLIN-WDEREUQCSA-N 1 1 325.434 2.957 10 5 EFBEMO COCC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000068911200 472263805 /nfs/dbraw/zinc/26/38/05/472263805.db2.gz YZVKZBKNHVJWFM-ZDUSSCGKSA-N 1 1 330.388 2.666 10 5 EFBEMO CCNC(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000069528597 472364435 /nfs/dbraw/zinc/36/44/35/472364435.db2.gz RMIRAVMPGYJVTD-UHFFFAOYSA-N 1 1 349.431 2.730 10 5 EFBEMO Cc1cc(NCCc2c[nH+]cn2C)nc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000097108367 472449674 /nfs/dbraw/zinc/44/96/74/472449674.db2.gz PJUGYUMSTQQDQF-UHFFFAOYSA-N 1 1 338.371 2.748 10 5 EFBEMO CCC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000097162498 472469931 /nfs/dbraw/zinc/46/99/31/472469931.db2.gz QGHVMWIUMBROHW-UHFFFAOYSA-N 1 1 325.796 2.806 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@H]2C)c1 ZINC000155614546 472581541 /nfs/dbraw/zinc/58/15/41/472581541.db2.gz OGNYNRNUALONIR-RISCZKNCSA-N 1 1 337.445 2.775 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000155677020 472593237 /nfs/dbraw/zinc/59/32/37/472593237.db2.gz KSSNUYPTNQRDDY-WBMJQRKESA-N 1 1 346.431 2.628 10 5 EFBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NCCCC[N@@H+]1CCC[C@H](C)C1 ZINC000046991593 472636916 /nfs/dbraw/zinc/63/69/16/472636916.db2.gz YPTVQWICLFGSNV-ZDUSSCGKSA-N 1 1 334.420 2.540 10 5 EFBEMO CC[C@H](NC(=O)NC[C@@H]1CCC[N@H+]1CC)c1cccc([N+](=O)[O-])c1 ZINC000090591906 472641332 /nfs/dbraw/zinc/64/13/32/472641332.db2.gz KERKIAVSPRILCG-HOTGVXAUSA-N 1 1 334.420 2.829 10 5 EFBEMO O=C(C[N@@H+](C[C@H]1CCCO1)C1CCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000072716340 472705391 /nfs/dbraw/zinc/70/53/91/472705391.db2.gz ZDLBVQSBLGXSCW-OAHLLOKOSA-N 1 1 347.415 2.957 10 5 EFBEMO Cc1cnc(NCC2(N3CCCCC3)CC[NH+](C)CC2)c([N+](=O)[O-])c1 ZINC000078669919 472751339 /nfs/dbraw/zinc/75/13/39/472751339.db2.gz WPKFRTIAVVNYGD-UHFFFAOYSA-N 1 1 347.463 2.660 10 5 EFBEMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(c2cccnn2)C1 ZINC000105803860 472778549 /nfs/dbraw/zinc/77/85/49/472778549.db2.gz JRFXMFQVSUFZSE-KRWDZBQOSA-N 1 1 341.415 2.528 10 5 EFBEMO CC[N@H+](CCc1nccs1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000121032738 472786801 /nfs/dbraw/zinc/78/68/01/472786801.db2.gz JECUNRFPPFBKFL-GFCCVEGCSA-N 1 1 348.428 2.943 10 5 EFBEMO CC[N@@H+](CCc1nccs1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000121032738 472786803 /nfs/dbraw/zinc/78/68/03/472786803.db2.gz JECUNRFPPFBKFL-GFCCVEGCSA-N 1 1 348.428 2.943 10 5 EFBEMO Cc1nc(C)n(C[C@H]2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000105884802 472796414 /nfs/dbraw/zinc/79/64/14/472796414.db2.gz RGQRIWXRLDBPRD-INIZCTEOSA-N 1 1 329.404 2.715 10 5 EFBEMO CCn1cnnc1C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000105930057 472811111 /nfs/dbraw/zinc/81/11/11/472811111.db2.gz HYDZGVGHJLGQPO-UHFFFAOYSA-N 1 1 345.403 2.594 10 5 EFBEMO COC(=O)/C=C/c1ccc(N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000133534387 472815452 /nfs/dbraw/zinc/81/54/52/472815452.db2.gz OJVWFEQSXABDOP-MXCDDWKTSA-N 1 1 345.399 2.818 10 5 EFBEMO CCOCC[N@H+]1CCN(Cc2csc([N+](=O)[O-])c2)C[C@@H]1CC ZINC000106116963 472829450 /nfs/dbraw/zinc/82/94/50/472829450.db2.gz VMQDLCDENPUENN-AWEZNQCLSA-N 1 1 327.450 2.589 10 5 EFBEMO CCOc1cc(N2CCCC[C@@H]2C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000092652991 472952215 /nfs/dbraw/zinc/95/22/15/472952215.db2.gz IWDKJKBNVFDSPZ-MRXNPFEDSA-N 1 1 349.431 2.685 10 5 EFBEMO Cc1ccc(N2CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)nn1 ZINC000107497086 472959596 /nfs/dbraw/zinc/95/95/96/472959596.db2.gz QNTHNVZFQZTPGF-OAHLLOKOSA-N 1 1 341.415 2.967 10 5 EFBEMO CCNc1ccc(C(=O)N(C)[C@H]2CC[N@@H+](CC)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000122179154 472985422 /nfs/dbraw/zinc/98/54/22/472985422.db2.gz QRAYJVYIWAQJDI-BBRMVZONSA-N 1 1 348.447 2.829 10 5 EFBEMO C[C@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000159566509 473040042 /nfs/dbraw/zinc/04/00/42/473040042.db2.gz DNJJNYNDOGQESE-JSGCOSHPSA-N 1 1 343.383 2.941 10 5 EFBEMO C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 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1 339.395 2.699 10 5 EFBEMO CCc1ccc(C(=O)N(C)[C@H]2CC[N@H+](CC)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000173464931 473846507 /nfs/dbraw/zinc/84/65/07/473846507.db2.gz HBMCNYGUZXICCH-BBRMVZONSA-N 1 1 333.432 2.960 10 5 EFBEMO COc1ccc(OCC[N@H+]2CCC[C@@H]2c2cnn(C)c2)c([N+](=O)[O-])c1 ZINC000173655822 473906311 /nfs/dbraw/zinc/90/63/11/473906311.db2.gz PRMXZLHZXYJULM-OAHLLOKOSA-N 1 1 346.387 2.553 10 5 EFBEMO Cc1nn(C)c(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c1[N+](=O)[O-] ZINC000282058747 473933913 /nfs/dbraw/zinc/93/39/13/473933913.db2.gz YGFHVFHTNYCNBU-CYBMUJFWSA-N 1 1 344.419 2.554 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2COc3ccccc3[C@@H]2O)c1 ZINC000288459985 473949603 /nfs/dbraw/zinc/94/96/03/473949603.db2.gz DTSBGIVNJUDVRW-HOCLYGCPSA-N 1 1 334.759 2.832 10 5 EFBEMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000246755687 473953838 /nfs/dbraw/zinc/95/38/38/473953838.db2.gz BNTVPERQSROUCE-WMLDXEAASA-N 1 1 348.447 2.632 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000246854817 473983551 /nfs/dbraw/zinc/98/35/51/473983551.db2.gz CQYDMNWPGZHISQ-OCCSQVGLSA-N 1 1 342.399 2.775 10 5 EFBEMO CCOc1ccc(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2CC)cc1[N+](=O)[O-] ZINC000246955510 474016088 /nfs/dbraw/zinc/01/60/88/474016088.db2.gz MHEASXCMXGIACK-GJZGRUSLSA-N 1 1 347.415 2.692 10 5 EFBEMO CC(C)[N@H+]1C[C@H](C)[C@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000246981061 474024353 /nfs/dbraw/zinc/02/43/53/474024353.db2.gz GIDBOTILOIMKEC-XHDPSFHLSA-N 1 1 332.404 2.620 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000247037849 474043430 /nfs/dbraw/zinc/04/34/30/474043430.db2.gz UZQVYBIQEWRFMP-OLZOCXBDSA-N 1 1 337.807 2.947 10 5 EFBEMO COc1cc(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc([N+](=O)[O-])c1C ZINC000188293283 474047598 /nfs/dbraw/zinc/04/75/98/474047598.db2.gz OLLRHXOGUOWMEW-GOOCMWNKSA-N 1 1 347.415 2.657 10 5 EFBEMO CC[N@H+]1CC[C@@H](CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000247157967 474077527 /nfs/dbraw/zinc/07/75/27/474077527.db2.gz NXDXQGXDHQDOMM-STQMWFEESA-N 1 1 337.445 2.533 10 5 EFBEMO CN(C)C(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182006804 474078962 /nfs/dbraw/zinc/07/89/62/474078962.db2.gz MXLZJILTDJFFCH-UHFFFAOYSA-N 1 1 325.796 2.548 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCNc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000247426477 474144827 /nfs/dbraw/zinc/14/48/27/474144827.db2.gz OIPFCRZJCWKAKF-GOEBONIOSA-N 1 1 348.447 2.586 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2C[N@@H+](C(C)C)C[C@H]2C)c1 ZINC000247440036 474148153 /nfs/dbraw/zinc/14/81/53/474148153.db2.gz RXUXPRRYEHLRSW-CABCVRRESA-N 1 1 349.431 2.517 10 5 EFBEMO C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000265017037 474164080 /nfs/dbraw/zinc/16/40/80/474164080.db2.gz XULFHWKFMQCHCR-FZMZJTMJSA-N 1 1 329.356 2.650 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000175361677 474197887 /nfs/dbraw/zinc/19/78/87/474197887.db2.gz ICEKBHAKROOAAI-HNNXBMFYSA-N 1 1 345.403 2.561 10 5 EFBEMO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)o1 ZINC000182588535 474212478 /nfs/dbraw/zinc/21/24/78/474212478.db2.gz UXDVHXIHNCKQLB-WFASDCNBSA-N 1 1 329.356 2.952 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000247976436 474237901 /nfs/dbraw/zinc/23/79/01/474237901.db2.gz GMGGGULPMSXVNC-PKOBYXMFSA-N 1 1 339.395 2.699 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)[C@H]1c1ccccc1 ZINC000247975550 474238012 /nfs/dbraw/zinc/23/80/12/474238012.db2.gz GJFJDJRYQUCOMM-IAGOWNOFSA-N 1 1 343.358 2.909 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)[C@H]1CCN(CC(F)(F)F)C1=O ZINC000248028088 474248928 /nfs/dbraw/zinc/24/89/28/474248928.db2.gz HDCXRACGNUECSA-GWCFXTLKSA-N 1 1 345.321 2.751 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)[C@H]1CCN(CC(F)(F)F)C1=O ZINC000248028088 474248932 /nfs/dbraw/zinc/24/89/32/474248932.db2.gz HDCXRACGNUECSA-GWCFXTLKSA-N 1 1 345.321 2.751 10 5 EFBEMO C[C@@H](NC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000289413782 474260932 /nfs/dbraw/zinc/26/09/32/474260932.db2.gz AMHQBLUIMOGWTJ-SJKOYZFVSA-N 1 1 337.395 2.985 10 5 EFBEMO C[N@H+]1CCC[C@H]2CN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)CC[C@H]21 ZINC000248169031 474276170 /nfs/dbraw/zinc/27/61/70/474276170.db2.gz UJJMLNCEDCJCSC-YVEFUNNKSA-N 1 1 342.399 2.632 10 5 EFBEMO CC[C@@H](NC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000175846170 474323245 /nfs/dbraw/zinc/32/32/45/474323245.db2.gz HEKYHIJCLCFZMP-SUMWQHHRSA-N 1 1 346.431 2.829 10 5 EFBEMO CNC(=O)c1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000183243217 474357885 /nfs/dbraw/zinc/35/78/85/474357885.db2.gz STTIYDILDAHELC-UHFFFAOYSA-N 1 1 327.384 2.895 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C(=O)NCC2CC2)C1 ZINC000183267673 474362748 /nfs/dbraw/zinc/36/27/48/474362748.db2.gz DKAIZDRWUGSCAA-MRXNPFEDSA-N 1 1 331.416 2.641 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]([C@@H](O)c2nccn2C)C1 ZINC000248572982 474363417 /nfs/dbraw/zinc/36/34/17/474363417.db2.gz CYVQAPWVOVJUOW-NVXWUHKLSA-N 1 1 344.415 2.582 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1C[C@@H]2CCC[N@@H+]2C[C@H]1C ZINC000248649243 474394024 /nfs/dbraw/zinc/39/40/24/474394024.db2.gz RGJGXCQLSVHNLC-KGLIPLIRSA-N 1 1 332.404 2.912 10 5 EFBEMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)c1 ZINC000176197309 474406711 /nfs/dbraw/zinc/40/67/11/474406711.db2.gz RNQNKSMPLRKMBQ-HNNXBMFYSA-N 1 1 346.387 2.646 10 5 EFBEMO COc1ccccc1C[C@@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000176220664 474414079 /nfs/dbraw/zinc/41/40/79/474414079.db2.gz BYYLRARJJKISFC-HNNXBMFYSA-N 1 1 330.388 2.507 10 5 EFBEMO COc1ccccc1C[C@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000176220684 474414232 /nfs/dbraw/zinc/41/42/32/474414232.db2.gz BYYLRARJJKISFC-OAHLLOKOSA-N 1 1 330.388 2.507 10 5 EFBEMO C[N@H+]1CC[C@@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000248722671 474415336 /nfs/dbraw/zinc/41/53/36/474415336.db2.gz GFHSFFFAEQDJFH-NVXWUHKLSA-N 1 1 340.383 2.551 10 5 EFBEMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000176237739 474419014 /nfs/dbraw/zinc/41/90/14/474419014.db2.gz KLVSPTIEPZUDAJ-AWEZNQCLSA-N 1 1 332.404 2.753 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@H+](C)C[C@@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000266692340 474450468 /nfs/dbraw/zinc/45/04/68/474450468.db2.gz DVTPSNDLLJZZEX-KBPBESRZSA-N 1 1 335.404 2.731 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)C[C@@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000266692340 474450474 /nfs/dbraw/zinc/45/04/74/474450474.db2.gz DVTPSNDLLJZZEX-KBPBESRZSA-N 1 1 335.404 2.731 10 5 EFBEMO CC(C)[N@@H+]1C[C@H](NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000176494012 474487209 /nfs/dbraw/zinc/48/72/09/474487209.db2.gz VFYYAUDASOQLQY-XEZPLFJOSA-N 1 1 334.420 2.684 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@H](Oc3cccnc3)C2)c([N+](=O)[O-])cc1F ZINC000184238906 474488809 /nfs/dbraw/zinc/48/88/09/474488809.db2.gz BZLVCMAHDKWXCL-AWEZNQCLSA-N 1 1 347.346 2.791 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@H](Oc3cccnc3)C2)c([N+](=O)[O-])cc1F ZINC000184238906 474488818 /nfs/dbraw/zinc/48/88/18/474488818.db2.gz BZLVCMAHDKWXCL-AWEZNQCLSA-N 1 1 347.346 2.791 10 5 EFBEMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)CC1CCS(=O)(=O)CC1 ZINC000271328396 474493849 /nfs/dbraw/zinc/49/38/49/474493849.db2.gz VEAHJVASGFBTHZ-UHFFFAOYSA-N 1 1 340.445 2.630 10 5 EFBEMO NC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000271390917 474523218 /nfs/dbraw/zinc/52/32/18/474523218.db2.gz TYAXQLCBMLLEMY-GFCCVEGCSA-N 1 1 346.412 2.566 10 5 EFBEMO CSc1cccc(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-] ZINC000249131822 474535009 /nfs/dbraw/zinc/53/50/09/474535009.db2.gz LZNBQBRWBRGJMM-NEPJUHHUSA-N 1 1 335.429 2.625 10 5 EFBEMO C[N@H+]1CC[C@H](CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000277689709 474592838 /nfs/dbraw/zinc/59/28/38/474592838.db2.gz GNWNOFNINXDLTH-CYBMUJFWSA-N 1 1 335.407 2.775 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000249627382 474600655 /nfs/dbraw/zinc/60/06/55/474600655.db2.gz QISSFRRUYKOQCL-CABCVRRESA-N 1 1 347.415 2.611 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCC[N@@H+](CC)C1 ZINC000184763983 474602733 /nfs/dbraw/zinc/60/27/33/474602733.db2.gz RAMCVHHZOMEUCF-HOTGVXAUSA-N 1 1 333.432 2.764 10 5 EFBEMO CO[C@@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@@H]1C ZINC000251505682 474637898 /nfs/dbraw/zinc/63/78/98/474637898.db2.gz BWFUKSRFATYKSH-SMDDNHRTSA-N 1 1 332.360 2.502 10 5 EFBEMO CO[C@@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@@H]1C ZINC000251505682 474637901 /nfs/dbraw/zinc/63/79/01/474637901.db2.gz BWFUKSRFATYKSH-SMDDNHRTSA-N 1 1 332.360 2.502 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000252477186 474662487 /nfs/dbraw/zinc/66/24/87/474662487.db2.gz JUMDISCTDFHLDB-NVXWUHKLSA-N 1 1 343.358 2.909 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000252477186 474662496 /nfs/dbraw/zinc/66/24/96/474662496.db2.gz JUMDISCTDFHLDB-NVXWUHKLSA-N 1 1 343.358 2.909 10 5 EFBEMO CC(C)[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCOC1 ZINC000291743518 474665182 /nfs/dbraw/zinc/66/51/82/474665182.db2.gz KCNQTHIAOWTVLQ-GFCCVEGCSA-N 1 1 341.795 2.686 10 5 EFBEMO CC(C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCOC1 ZINC000291743518 474665185 /nfs/dbraw/zinc/66/51/85/474665185.db2.gz KCNQTHIAOWTVLQ-GFCCVEGCSA-N 1 1 341.795 2.686 10 5 EFBEMO Cc1nc(N[C@@H]2CC[N@H+](C[C@H]3CCCO3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000252512292 474691071 /nfs/dbraw/zinc/69/10/71/474691071.db2.gz OWSOHGRCOGBKKM-BPLDGKMQSA-N 1 1 334.420 2.600 10 5 EFBEMO C[C@H]1C[N@H+](Cc2cccc(CNc3ccc([N+](=O)[O-])nc3)c2)CCO1 ZINC000344414877 474733561 /nfs/dbraw/zinc/73/35/61/474733561.db2.gz GYQXZVZVDGJBTP-AWEZNQCLSA-N 1 1 342.399 2.823 10 5 EFBEMO C[C@H]1C[N@@H+](Cc2cccc(CNc3ccc([N+](=O)[O-])nc3)c2)CCO1 ZINC000344414877 474733566 /nfs/dbraw/zinc/73/35/66/474733566.db2.gz GYQXZVZVDGJBTP-AWEZNQCLSA-N 1 1 342.399 2.823 10 5 EFBEMO Cc1nc(C[NH+]2CCC(CNc3ccc([N+](=O)[O-])nc3)CC2)oc1C ZINC000344425741 474745591 /nfs/dbraw/zinc/74/55/91/474745591.db2.gz WEUUFMISSGNHJZ-UHFFFAOYSA-N 1 1 345.403 2.919 10 5 EFBEMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@H](CC(F)(F)F)C2)c1 ZINC000278659416 474761749 /nfs/dbraw/zinc/76/17/49/474761749.db2.gz HRQZSHWLDXIZJA-AAEUAGOBSA-N 1 1 348.321 2.609 10 5 EFBEMO O=[N+]([O-])c1cnccc1NCC[N@@H+]1CCc2c(Cl)cccc2C1 ZINC000340930361 474787442 /nfs/dbraw/zinc/78/74/42/474787442.db2.gz SAWQGSFJHCVCRY-UHFFFAOYSA-N 1 1 332.791 2.535 10 5 EFBEMO O=[N+]([O-])c1cnccc1NCC[N@H+]1CCc2c(Cl)cccc2C1 ZINC000340930361 474787450 /nfs/dbraw/zinc/78/74/50/474787450.db2.gz SAWQGSFJHCVCRY-UHFFFAOYSA-N 1 1 332.791 2.535 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278730583 474800878 /nfs/dbraw/zinc/80/08/78/474800878.db2.gz LDWCRXYYWJRJOY-NEPJUHHUSA-N 1 1 348.321 2.609 10 5 EFBEMO CCN(CC)C(=O)[C@@H]1CCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255405212 474851026 /nfs/dbraw/zinc/85/10/26/474851026.db2.gz OCVXZRZJHSWPPI-JEZWAEDTSA-N 1 1 331.416 2.941 10 5 EFBEMO CCN(CC)C(=O)[C@@H]1CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255405212 474851035 /nfs/dbraw/zinc/85/10/35/474851035.db2.gz OCVXZRZJHSWPPI-JEZWAEDTSA-N 1 1 331.416 2.941 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@]2(CC[N@H+](C)C2)C1 ZINC000292163550 474881993 /nfs/dbraw/zinc/88/19/93/474881993.db2.gz JIZMGLRJZBCBAG-BJRSVTDJSA-N 1 1 329.400 2.552 10 5 EFBEMO C[N@H+]1CCC[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000613860534 480134097 /nfs/dbraw/zinc/13/40/97/480134097.db2.gz OBLBWENPPKFRGC-SNVBAGLBSA-N 1 1 346.309 2.829 10 5 EFBEMO C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339149536 474977107 /nfs/dbraw/zinc/97/71/07/474977107.db2.gz SBKLGVZYASPWDD-HZMBPMFUSA-N 1 1 348.321 2.585 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000341124716 475000294 /nfs/dbraw/zinc/00/02/94/475000294.db2.gz OVBVJHMXSSAXPD-GASCZTMLSA-N 1 1 348.447 2.699 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1ccc(S(C)(=O)=O)s1 ZINC000345468649 475208090 /nfs/dbraw/zinc/20/80/90/475208090.db2.gz SLXNBKSHEFXZKT-UHFFFAOYSA-N 1 1 340.426 2.658 10 5 EFBEMO CN1C[C@@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1=O ZINC000352568449 475419664 /nfs/dbraw/zinc/41/96/64/475419664.db2.gz ZOGSCDNPWLZRDQ-MAUKXSAKSA-N 1 1 325.368 2.505 10 5 EFBEMO CN1C[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1=O ZINC000352568451 475419794 /nfs/dbraw/zinc/41/97/94/475419794.db2.gz ZOGSCDNPWLZRDQ-YJBOKZPZSA-N 1 1 325.368 2.505 10 5 EFBEMO CC[C@H](NC(=O)NCC[N@@H+]1CC=C(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000358162330 475451632 /nfs/dbraw/zinc/45/16/32/475451632.db2.gz HFDBRMAHUHUXMA-KRWDZBQOSA-N 1 1 346.431 2.997 10 5 EFBEMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000358226151 475507088 /nfs/dbraw/zinc/50/70/88/475507088.db2.gz CUXSHSKMEIXSHS-MRXNPFEDSA-N 1 1 330.388 2.809 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@]3(C2)CCCOC3)cccc1[N+](=O)[O-] ZINC000342024829 475514283 /nfs/dbraw/zinc/51/42/83/475514283.db2.gz ULGQHZVABYIHPN-RDTXWAMCSA-N 1 1 347.415 2.733 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H](CO)C2)ccc1[N+](=O)[O-] ZINC000352687283 475530853 /nfs/dbraw/zinc/53/08/53/475530853.db2.gz VNQSNORXIWGONY-NWDGAFQWSA-N 1 1 348.321 2.596 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H](CO)C2)ccc1[N+](=O)[O-] ZINC000352687283 475530858 /nfs/dbraw/zinc/53/08/58/475530858.db2.gz VNQSNORXIWGONY-NWDGAFQWSA-N 1 1 348.321 2.596 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)ccc1[N+](=O)[O-] ZINC000352776297 475612032 /nfs/dbraw/zinc/61/20/32/475612032.db2.gz BPAIOZUMTDNHCQ-CZUORRHYSA-N 1 1 330.388 2.883 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)cc1 ZINC000361683368 475661255 /nfs/dbraw/zinc/66/12/55/475661255.db2.gz AZTFHRPNDQSZGT-SJORKVTESA-N 1 1 343.358 2.909 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)cc1 ZINC000361683368 475661260 /nfs/dbraw/zinc/66/12/60/475661260.db2.gz AZTFHRPNDQSZGT-SJORKVTESA-N 1 1 343.358 2.909 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC[N@@H+]1CC=C(C)CC1 ZINC000358458258 475692947 /nfs/dbraw/zinc/69/29/47/475692947.db2.gz NDSOYBUKVLFJKA-UHFFFAOYSA-N 1 1 332.404 2.985 10 5 EFBEMO O=[N+]([O-])c1cnccc1NC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000340153038 475806517 /nfs/dbraw/zinc/80/65/17/475806517.db2.gz VRGZBWGDUCSVMX-MRXNPFEDSA-N 1 1 326.400 2.878 10 5 EFBEMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nc(-c2ccoc2)no1 ZINC000338360122 475823374 /nfs/dbraw/zinc/82/33/74/475823374.db2.gz OVZXEGBAVCWBFV-UHFFFAOYSA-N 1 1 328.328 2.912 10 5 EFBEMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nc(-c2ccoc2)no1 ZINC000338360122 475823383 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328.372 2.626 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC=C(c2ccnn2C)CC1 ZINC000375622796 476923635 /nfs/dbraw/zinc/92/36/35/476923635.db2.gz GNVVRUQJUPMKCF-UHFFFAOYSA-N 1 1 328.372 2.626 10 5 EFBEMO C[N@H+]1CCCC[C@H]1CCC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000431823608 477102288 /nfs/dbraw/zinc/10/22/88/477102288.db2.gz RBERYZBPMIGYTB-NSHDSACASA-N 1 1 331.376 2.674 10 5 EFBEMO C[N@H+]1CCCC[C@@H]1CCC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000431823607 477102389 /nfs/dbraw/zinc/10/23/89/477102389.db2.gz RBERYZBPMIGYTB-LLVKDONJSA-N 1 1 331.376 2.674 10 5 EFBEMO CCN1CC[C@@H]([N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000411379713 477211337 /nfs/dbraw/zinc/21/13/37/477211337.db2.gz BQMDAKOBZPJGQM-RHSMWYFYSA-N 1 1 348.447 2.586 10 5 EFBEMO CCN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000411379713 477211344 /nfs/dbraw/zinc/21/13/44/477211344.db2.gz BQMDAKOBZPJGQM-RHSMWYFYSA-N 1 1 348.447 2.586 10 5 EFBEMO 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ZINC000372283844 477734665 /nfs/dbraw/zinc/73/46/65/477734665.db2.gz VFFMAFACKRHZOM-BWVNKGDMSA-N 1 1 348.399 2.651 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])cc1C)CCC(F)(F)F ZINC000427212183 477767492 /nfs/dbraw/zinc/76/74/92/477767492.db2.gz JQGVEPWESPOUSD-UHFFFAOYSA-N 1 1 347.337 2.907 10 5 EFBEMO CCOC(=O)c1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)nc1 ZINC000450941922 477768737 /nfs/dbraw/zinc/76/87/37/477768737.db2.gz QBTLUGRWSIHYJE-UHFFFAOYSA-N 1 1 343.383 2.841 10 5 EFBEMO C[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)CCC[N@H+]1Cc1ccccc1 ZINC000427979332 477797833 /nfs/dbraw/zinc/79/78/33/477797833.db2.gz HWYUWGNHSXEXFY-SFHVURJKSA-N 1 1 342.399 2.707 10 5 EFBEMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000438494238 477851697 /nfs/dbraw/zinc/85/16/97/477851697.db2.gz NDQQGQYCIIUCOX-CYBMUJFWSA-N 1 1 335.404 2.910 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](O)CC12CCC2 ZINC000420998844 477887316 /nfs/dbraw/zinc/88/73/16/477887316.db2.gz UIDYFVNOQRFSGW-OAHLLOKOSA-N 1 1 347.415 2.611 10 5 EFBEMO CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000451249816 477903025 /nfs/dbraw/zinc/90/30/25/477903025.db2.gz CJAJSBIUEJVBOM-CZUORRHYSA-N 1 1 331.372 2.843 10 5 EFBEMO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000451249814 477903518 /nfs/dbraw/zinc/90/35/18/477903518.db2.gz CJAJSBIUEJVBOM-BBRMVZONSA-N 1 1 331.372 2.843 10 5 EFBEMO COc1ccc(-c2ccc(C[NH+]3CC(C)(CO)C3)o2)c([N+](=O)[O-])c1 ZINC000459619953 478013714 /nfs/dbraw/zinc/01/37/14/478013714.db2.gz JWJBQVBOWPENQP-UHFFFAOYSA-N 1 1 332.356 2.678 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@@H+]1CC=C(C)CC1 ZINC000439884871 478043634 /nfs/dbraw/zinc/04/36/34/478043634.db2.gz XHAGDFRNHNZKSE-UHFFFAOYSA-N 1 1 348.403 2.767 10 5 EFBEMO COc1cc(CN2CC[N@H+](C3CCC3)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000429383622 478125447 /nfs/dbraw/zinc/12/54/47/478125447.db2.gz HYJGJBGITHPUQX-AWEZNQCLSA-N 1 1 333.432 2.910 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1CN1CCC(C)([NH+]2CCOCC2)CC1 ZINC000600201798 478278803 /nfs/dbraw/zinc/27/88/03/478278803.db2.gz XQICFVWWULUBGU-UHFFFAOYSA-N 1 1 333.432 2.590 10 5 EFBEMO CC(C)c1n[nH]c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000600228966 478299147 /nfs/dbraw/zinc/29/91/47/478299147.db2.gz IHSVBGLATSMGHX-ZDUSSCGKSA-N 1 1 349.435 2.578 10 5 EFBEMO COc1cccc(C(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000600230349 478300893 /nfs/dbraw/zinc/30/08/93/478300893.db2.gz RFCCPNDMVRDGGX-CQSZACIVSA-N 1 1 347.415 2.740 10 5 EFBEMO C[N@H+]1CCCC[C@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000600312312 478334992 /nfs/dbraw/zinc/33/49/92/478334992.db2.gz DSYJJKHSGOAAJL-GFCCVEGCSA-N 1 1 330.388 2.538 10 5 EFBEMO O=C([C@H]1CCc2[nH]cnc2C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000597468410 478366102 /nfs/dbraw/zinc/36/61/02/478366102.db2.gz QHPYYUQJWZGOKJ-ZDUSSCGKSA-N 1 1 340.383 2.614 10 5 EFBEMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000594417193 478374429 /nfs/dbraw/zinc/37/44/29/478374429.db2.gz AXOZHQNFEIVFGW-IAGOWNOFSA-N 1 1 342.399 2.823 10 5 EFBEMO O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600470055 478382045 /nfs/dbraw/zinc/38/20/45/478382045.db2.gz DZPDNVJMNAZZJH-HNNXBMFYSA-N 1 1 349.456 2.820 10 5 EFBEMO C[C@@H](C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000600472484 478382422 /nfs/dbraw/zinc/38/24/22/478382422.db2.gz ZNYSRDLASZDAAT-DYVFJYSZSA-N 1 1 331.416 2.831 10 5 EFBEMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000600469414 478383096 /nfs/dbraw/zinc/38/30/96/478383096.db2.gz BABPMEKTOLTMQM-CYBMUJFWSA-N 1 1 337.807 2.995 10 5 EFBEMO C[C@H](C(=O)NC[C@H]1CC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000600472486 478383849 /nfs/dbraw/zinc/38/38/49/478383849.db2.gz ZNYSRDLASZDAAT-SUMWQHHRSA-N 1 1 331.416 2.831 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000600473181 478384268 /nfs/dbraw/zinc/38/42/68/478384268.db2.gz SUCYOWPCJKTLSQ-AWEZNQCLSA-N 1 1 337.807 2.995 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000600474065 478384668 /nfs/dbraw/zinc/38/46/68/478384668.db2.gz WNQDKRZLCCZJCK-AWEZNQCLSA-N 1 1 342.399 2.823 10 5 EFBEMO CC[C@@H](NC(=O)N1CC[N@@H+](C)C[C@H]1CC)c1cccc([N+](=O)[O-])c1 ZINC000590928049 478402202 /nfs/dbraw/zinc/40/22/02/478402202.db2.gz OZRKNBQAZPHNFC-GDBMZVCRSA-N 1 1 334.420 2.782 10 5 EFBEMO O=c1[nH]c(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)nc2ccc([N+](=O)[O-])cc21 ZINC000594597579 478457125 /nfs/dbraw/zinc/45/71/25/478457125.db2.gz DATVULJVPDKVSQ-CABCVRRESA-N 1 1 343.387 2.672 10 5 EFBEMO C[N@@H+]1CCO[C@H](CSc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000582000598 478486970 /nfs/dbraw/zinc/48/69/70/478486970.db2.gz SOWZOFIMBNPEQJ-VIFPVBQESA-N 1 1 334.344 2.619 10 5 EFBEMO C[N@H+]1CCO[C@H](CSc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000582000598 478486977 /nfs/dbraw/zinc/48/69/77/478486977.db2.gz SOWZOFIMBNPEQJ-VIFPVBQESA-N 1 1 334.344 2.619 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)n1 ZINC000541005209 478528174 /nfs/dbraw/zinc/52/81/74/478528174.db2.gz KKRIHCJMDXDRSM-GJZGRUSLSA-N 1 1 334.420 2.662 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)n1 ZINC000541005212 478528612 /nfs/dbraw/zinc/52/86/12/478528612.db2.gz KKRIHCJMDXDRSM-LSDHHAIUSA-N 1 1 334.420 2.662 10 5 EFBEMO Cc1sc(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000597855435 478542460 /nfs/dbraw/zinc/54/24/60/478542460.db2.gz QOQNDFJAHAJZEJ-LLVKDONJSA-N 1 1 325.434 2.815 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000597856825 478543053 /nfs/dbraw/zinc/54/30/53/478543053.db2.gz AUWNKCBLMJOHPG-AWEZNQCLSA-N 1 1 344.415 2.608 10 5 EFBEMO Cc1cccc2[nH+]c(Cn3c(=O)c([N+](=O)[O-])cc4c3CCCC4)cn21 ZINC000571207132 478543165 /nfs/dbraw/zinc/54/31/65/478543165.db2.gz OKPSYLQLSNCQRE-UHFFFAOYSA-N 1 1 338.367 2.640 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000597858099 478544691 /nfs/dbraw/zinc/54/46/91/478544691.db2.gz JJAHMAZSZKVXKI-JTQLQIEISA-N 1 1 325.796 2.851 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000597857296 478544922 /nfs/dbraw/zinc/54/49/22/478544922.db2.gz CPSCEKMBZVDSHT-CYBMUJFWSA-N 1 1 331.372 2.944 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000597859950 478546120 /nfs/dbraw/zinc/54/61/20/478546120.db2.gz IQZLFBUBWZORNH-OAHLLOKOSA-N 1 1 347.415 2.547 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000597860203 478547035 /nfs/dbraw/zinc/54/70/35/478547035.db2.gz LVJUCRPAYPOROL-CYBMUJFWSA-N 1 1 333.432 2.861 10 5 EFBEMO COc1cc(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc([N+](=O)[O-])c1C ZINC000597861745 478548200 /nfs/dbraw/zinc/54/82/00/478548200.db2.gz WRFCQAUKRPNVIW-ZDUSSCGKSA-N 1 1 335.404 2.514 10 5 EFBEMO CCN(C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](C)C1 ZINC000597947171 478590157 /nfs/dbraw/zinc/59/01/57/478590157.db2.gz UQYNJUACXPDSGZ-OCCSQVGLSA-N 1 1 337.445 2.628 10 5 EFBEMO CCN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@H]1CC[N@@H+](C)C1 ZINC000597946633 478591163 /nfs/dbraw/zinc/59/11/63/478591163.db2.gz QYABGZLGCRLBPQ-ZDUSSCGKSA-N 1 1 333.413 2.976 10 5 EFBEMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000600999478 478605716 /nfs/dbraw/zinc/60/57/16/478605716.db2.gz CIJJEYKVYPKDSP-WBVHZDCISA-N 1 1 343.427 2.760 10 5 EFBEMO CC[N@@H+](CCNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1)C1CC1 ZINC000601035813 478624978 /nfs/dbraw/zinc/62/49/78/478624978.db2.gz MRDPBKIUWHTTJA-UHFFFAOYSA-N 1 1 331.416 2.617 10 5 EFBEMO CCN(C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598044186 478630146 /nfs/dbraw/zinc/63/01/46/478630146.db2.gz ZJBFCBARTWSLHV-CYBMUJFWSA-N 1 1 330.388 2.632 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000571580888 478630491 /nfs/dbraw/zinc/63/04/91/478630491.db2.gz CLXDWOUBELFHKL-QGZVFWFLSA-N 1 1 333.432 2.590 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1CNc1cc(N2CCN(C)CC2)cc[nH+]1 ZINC000601069724 478641784 /nfs/dbraw/zinc/64/17/84/478641784.db2.gz VVQRGFZUBNJUGK-UHFFFAOYSA-N 1 1 341.415 2.662 10 5 EFBEMO COC1CC(CC[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000595050647 478641894 /nfs/dbraw/zinc/64/18/94/478641894.db2.gz TVLOGUICLGULER-IMRCBTMISA-N 1 1 344.415 2.822 10 5 EFBEMO Cc1nn(C)c(C)c1CCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000601104430 478658631 /nfs/dbraw/zinc/65/86/31/478658631.db2.gz WYHGWLDXDPEEFL-UHFFFAOYSA-N 1 1 325.372 2.570 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@@](O)(C(F)(F)F)C3)c2c1 ZINC000601121407 478668940 /nfs/dbraw/zinc/66/89/40/478668940.db2.gz NVSJTGICGOPURW-ZDUSSCGKSA-N 1 1 327.262 2.647 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C[C@@H]1C ZINC000601122405 478670680 /nfs/dbraw/zinc/67/06/80/478670680.db2.gz VVRPUFPAKDMPRD-UWVGGRQHSA-N 1 1 349.357 2.656 10 5 EFBEMO Cc1cccn2c(C[NH2+][C@@](C)(CO)c3cccc([N+](=O)[O-])c3)cnc12 ZINC000601149501 478688919 /nfs/dbraw/zinc/68/89/19/478688919.db2.gz MYZWDYYXAJOELH-SFHVURJKSA-N 1 1 340.383 2.548 10 5 EFBEMO COc1cccc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c1OC ZINC000601150048 478689057 /nfs/dbraw/zinc/68/90/57/478689057.db2.gz SUSQFRSPWSAQDR-SFHVURJKSA-N 1 1 346.383 2.609 10 5 EFBEMO COc1ccc(C)cc1C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC000601148891 478689595 /nfs/dbraw/zinc/68/95/95/478689595.db2.gz HJCVLAUCFOJIHX-SFHVURJKSA-N 1 1 330.384 2.909 10 5 EFBEMO CO[C@@H](CCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12)C(F)(F)F ZINC000601152378 478691744 /nfs/dbraw/zinc/69/17/44/478691744.db2.gz CZSQFTITWWLHPU-ZDUSSCGKSA-N 1 1 329.278 2.944 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CCOC[C@H]2C)CC1 ZINC000564156512 478700317 /nfs/dbraw/zinc/70/03/17/478700317.db2.gz WWLVPAKABJYGOV-HUUCEWRRSA-N 1 1 333.432 2.841 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(N2CCOC[C@H]2C)CC1 ZINC000564156512 478700322 /nfs/dbraw/zinc/70/03/22/478700322.db2.gz WWLVPAKABJYGOV-HUUCEWRRSA-N 1 1 333.432 2.841 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NCCCC[N@@H+](C)C1CC1 ZINC000601172837 478704070 /nfs/dbraw/zinc/70/40/70/478704070.db2.gz IJWDHCVCOYRRHT-UHFFFAOYSA-N 1 1 335.330 2.633 10 5 EFBEMO C[C@H]1C[N@@H+](CCCNc2nc3c(cc2[N+](=O)[O-])CCCC3)CCCO1 ZINC000591936745 478715863 /nfs/dbraw/zinc/71/58/63/478715863.db2.gz LVVRDUKCOXGNFP-AWEZNQCLSA-N 1 1 348.447 2.781 10 5 EFBEMO COc1cc2c(cc1OC)CC[NH+](Cc1onc(C)c1[N+](=O)[O-])CC2 ZINC000595293490 478717982 /nfs/dbraw/zinc/71/79/82/478717982.db2.gz AHVIUAWBFKMVAI-UHFFFAOYSA-N 1 1 347.371 2.509 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(NCC3(O)CCC(F)(F)CC3)c2c1 ZINC000601196394 478719211 /nfs/dbraw/zinc/71/92/11/478719211.db2.gz JIHPFTGJVAXOJX-UHFFFAOYSA-N 1 1 337.326 2.917 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H]1CCCO1)[C@H]1CC[C@H](O)CC1 ZINC000592131007 478788778 /nfs/dbraw/zinc/78/87/78/478788778.db2.gz PDKBWAQRCJZWDI-BRWVUGGUSA-N 1 1 334.416 2.879 10 5 EFBEMO CC(C)(O)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131269 478789537 /nfs/dbraw/zinc/78/95/37/478789537.db2.gz VUGKUMTTZYIQPB-WKILWMFISA-N 1 1 336.432 2.861 10 5 EFBEMO Cc1noc(C[N@@H+]2CCC[C@@H]2COc2cccnc2C)c1[N+](=O)[O-] ZINC000595549383 478849355 /nfs/dbraw/zinc/84/93/55/478849355.db2.gz DOZVAWKCLLHARI-CYBMUJFWSA-N 1 1 332.360 2.638 10 5 EFBEMO Cc1noc(C[N@H+]2CCC[C@@H]2COc2cccnc2C)c1[N+](=O)[O-] ZINC000595549383 478849362 /nfs/dbraw/zinc/84/93/62/478849362.db2.gz DOZVAWKCLLHARI-CYBMUJFWSA-N 1 1 332.360 2.638 10 5 EFBEMO COCC1(CC[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000564965839 478871427 /nfs/dbraw/zinc/87/14/27/478871427.db2.gz KTUWLTYOOVGCRH-INIZCTEOSA-N 1 1 344.415 2.824 10 5 EFBEMO CC1(C)C[C@@H]([N@@H+](CCn2ccc([N+](=O)[O-])n2)Cc2ccccc2)CO1 ZINC000595634617 478904764 /nfs/dbraw/zinc/90/47/64/478904764.db2.gz DDHBWLSSROMZMH-MRXNPFEDSA-N 1 1 344.415 2.861 10 5 EFBEMO CN(C[C@H]1CCC[N@H+]1C)C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601644322 478923472 /nfs/dbraw/zinc/92/34/72/478923472.db2.gz OBKZHOOTAYHHFL-MRXNPFEDSA-N 1 1 331.416 2.569 10 5 EFBEMO C[N@H+]1C[C@@H]2CCCN(C(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)[C@@H]2C1 ZINC000601647182 478924817 /nfs/dbraw/zinc/92/48/17/478924817.db2.gz NZALLRSWBISOOG-WMLDXEAASA-N 1 1 343.427 2.569 10 5 EFBEMO C[C@@H]1COC2(CCC2)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000595680948 478931768 /nfs/dbraw/zinc/93/17/68/478931768.db2.gz JAVGWWIQYZWMIA-CYBMUJFWSA-N 1 1 333.388 2.567 10 5 EFBEMO COc1ccc(OCC[N@@H+]2CC3(CCC3)OC[C@H]2C)c([N+](=O)[O-])c1 ZINC000595682802 478933562 /nfs/dbraw/zinc/93/35/62/478933562.db2.gz RPVTUIMJXZYWQD-CYBMUJFWSA-N 1 1 336.388 2.626 10 5 EFBEMO COc1ccc(OCC[N@H+]2CC3(CCC3)OC[C@H]2C)c([N+](=O)[O-])c1 ZINC000595682802 478933566 /nfs/dbraw/zinc/93/35/66/478933566.db2.gz RPVTUIMJXZYWQD-CYBMUJFWSA-N 1 1 336.388 2.626 10 5 EFBEMO COc1ccc(OCC[N@@H+]2CC3(CCC3)OC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000595682803 478933876 /nfs/dbraw/zinc/93/38/76/478933876.db2.gz RPVTUIMJXZYWQD-ZDUSSCGKSA-N 1 1 336.388 2.626 10 5 EFBEMO COc1ccc(OCC[N@H+]2CC3(CCC3)OC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000595682803 478933888 /nfs/dbraw/zinc/93/38/88/478933888.db2.gz RPVTUIMJXZYWQD-ZDUSSCGKSA-N 1 1 336.388 2.626 10 5 EFBEMO C[C@@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](C)[C@H]1O ZINC000595743552 478970288 /nfs/dbraw/zinc/97/02/88/478970288.db2.gz OEKKFBDACPSZEG-ATCWAGBWSA-N 1 1 331.372 2.699 10 5 EFBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1 ZINC000595742798 478970691 /nfs/dbraw/zinc/97/06/91/478970691.db2.gz HUGKCYHQCZHVJA-OZTPJHRESA-N 1 1 346.387 2.655 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@](O)(C4CC4)C3)co2)cc1 ZINC000595749342 478973872 /nfs/dbraw/zinc/97/38/72/478973872.db2.gz FHQFADXBWABNLH-GOSISDBHSA-N 1 1 343.383 2.987 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](CCF)C1 ZINC000595756638 478977385 /nfs/dbraw/zinc/97/73/85/478977385.db2.gz VESCRHGTWIVILV-LBPRGKRZSA-N 1 1 339.367 2.614 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](CCF)C1 ZINC000595756638 478977395 /nfs/dbraw/zinc/97/73/95/478977395.db2.gz VESCRHGTWIVILV-LBPRGKRZSA-N 1 1 339.367 2.614 10 5 EFBEMO O=C(N[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000573067147 478982850 /nfs/dbraw/zinc/98/28/50/478982850.db2.gz COACEJDLSORLAR-CYBMUJFWSA-N 1 1 347.418 2.648 10 5 EFBEMO O=C(N[C@@H]1CC[N@H+](C2CC2)C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000573067147 478982860 /nfs/dbraw/zinc/98/28/60/478982860.db2.gz COACEJDLSORLAR-CYBMUJFWSA-N 1 1 347.418 2.648 10 5 EFBEMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000595779408 478991498 /nfs/dbraw/zinc/99/14/98/478991498.db2.gz AATAFATWMADRDQ-OLZOCXBDSA-N 1 1 335.404 2.731 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](C)O[C@@H](C)C1 ZINC000595781073 478994242 /nfs/dbraw/zinc/99/42/42/478994242.db2.gz QQIWIMAILJPUQJ-KGLIPLIRSA-N 1 1 335.404 2.731 10 5 EFBEMO C[C@H]([NH2+][C@@H]1C[C@@H](O)C12CCC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000595783070 478995753 /nfs/dbraw/zinc/99/57/53/478995753.db2.gz QAZDPUQRETZVPD-ZLKJLUDKSA-N 1 1 344.371 2.599 10 5 EFBEMO CCC[N@H+]1CC[C@H](NC(=O)N[C@@H](CC)c2cccc([N+](=O)[O-])c2)C1 ZINC000595808787 479010242 /nfs/dbraw/zinc/01/02/42/479010242.db2.gz WJZZZSVZTLEKIN-HOCLYGCPSA-N 1 1 334.420 2.829 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](N(C)C(=O)N(C)C)C1 ZINC000595823783 479017072 /nfs/dbraw/zinc/01/70/72/479017072.db2.gz QYEOHHVYDLKTEF-UKRRQHHQSA-N 1 1 334.420 2.652 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H]2COC[C@H]2C1 ZINC000595826967 479020665 /nfs/dbraw/zinc/02/06/65/479020665.db2.gz BMKKQIPVDUBGNC-MRVWCRGKSA-N 1 1 344.371 2.674 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000592751570 479025489 /nfs/dbraw/zinc/02/54/89/479025489.db2.gz ZMTQZVWAXHBCMP-LBPRGKRZSA-N 1 1 346.387 2.630 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000592780275 479040901 /nfs/dbraw/zinc/04/09/01/479040901.db2.gz ZQCZOCADTPRAMZ-CYBMUJFWSA-N 1 1 330.388 2.664 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)[C@@H](C)[C@H]1C ZINC000584180092 479044716 /nfs/dbraw/zinc/04/47/16/479044716.db2.gz QUYQBMTYYOITST-WDEREUQCSA-N 1 1 325.796 2.721 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C)[C@@H](C)[C@H]1C ZINC000584180092 479044723 /nfs/dbraw/zinc/04/47/23/479044723.db2.gz QUYQBMTYYOITST-WDEREUQCSA-N 1 1 325.796 2.721 10 5 EFBEMO C[C@@H]1[C@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000592797917 479048789 /nfs/dbraw/zinc/04/87/89/479048789.db2.gz MOXICSUMBAWQSV-PRHODGIISA-N 1 1 342.193 2.636 10 5 EFBEMO CN1c2ccccc2C[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC1=O ZINC000598947694 479096814 /nfs/dbraw/zinc/09/68/14/479096814.db2.gz PLCNUJFCFSZPKC-UHFFFAOYSA-N 1 1 325.368 2.616 10 5 EFBEMO CN1c2ccccc2C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1=O ZINC000598947694 479096819 /nfs/dbraw/zinc/09/68/19/479096819.db2.gz PLCNUJFCFSZPKC-UHFFFAOYSA-N 1 1 325.368 2.616 10 5 EFBEMO C[C@@H](NC(=O)NC[C@H]1CC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000598971946 479107400 /nfs/dbraw/zinc/10/74/00/479107400.db2.gz JREVHGJBXUCKJW-CXAGYDPISA-N 1 1 346.431 2.972 10 5 EFBEMO C[C@@H](NC(=O)NC[C@@H]1CC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000598971947 479107585 /nfs/dbraw/zinc/10/75/85/479107585.db2.gz JREVHGJBXUCKJW-DYVFJYSZSA-N 1 1 346.431 2.972 10 5 EFBEMO COC[C@@H]([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1ccccc1 ZINC000593019670 479129260 /nfs/dbraw/zinc/12/92/60/479129260.db2.gz IKUWVBCCUHNENI-MRXNPFEDSA-N 1 1 344.367 2.859 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC12CCCC2 ZINC000593038629 479137450 /nfs/dbraw/zinc/13/74/50/479137450.db2.gz KCZGRFCTPXEEIL-UHFFFAOYSA-N 1 1 333.388 2.951 10 5 EFBEMO COC(=O)c1c(Cl)c(NCC[N@@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC000596109126 479143434 /nfs/dbraw/zinc/14/34/34/479143434.db2.gz GBXVHYDPMICZMG-UHFFFAOYSA-N 1 1 329.784 2.787 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](OC(C)C)C2)c1 ZINC000593054662 479147083 /nfs/dbraw/zinc/14/70/83/479147083.db2.gz YPXVMVCGSHVLSP-OAHLLOKOSA-N 1 1 336.388 2.771 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](OC(C)C)C2)c1 ZINC000593054662 479147088 /nfs/dbraw/zinc/14/70/88/479147088.db2.gz YPXVMVCGSHVLSP-OAHLLOKOSA-N 1 1 336.388 2.771 10 5 EFBEMO COc1cc(NC2CC([NH+]3CCOCC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000599092474 479158146 /nfs/dbraw/zinc/15/81/46/479158146.db2.gz IJGPUSWLLAEGOC-UHFFFAOYSA-N 1 1 341.795 2.532 10 5 EFBEMO C[C@H]1C[N@H+](CCNc2ccc3cnccc3c2[N+](=O)[O-])[C@@H](C)CO1 ZINC000599105544 479162785 /nfs/dbraw/zinc/16/27/85/479162785.db2.gz YQDGGZRWJAVOCM-STQMWFEESA-N 1 1 330.388 2.664 10 5 EFBEMO C[C@H]1C[N@@H+](CCNc2ccc3cnccc3c2[N+](=O)[O-])[C@@H](C)CO1 ZINC000599105544 479162786 /nfs/dbraw/zinc/16/27/86/479162786.db2.gz YQDGGZRWJAVOCM-STQMWFEESA-N 1 1 330.388 2.664 10 5 EFBEMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)OCC23CCC3)cccc1[N+](=O)[O-] ZINC000593092042 479168531 /nfs/dbraw/zinc/16/85/31/479168531.db2.gz MEAOCXYSAZZPDO-ZDUSSCGKSA-N 1 1 347.415 2.875 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CC[N@H+]2C2CCCCC2)n1 ZINC000599127089 479170708 /nfs/dbraw/zinc/17/07/08/479170708.db2.gz NQCLVQVJGAOFSW-ZDUSSCGKSA-N 1 1 348.403 2.595 10 5 EFBEMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(c2cc[nH]c(=O)c2[N+](=O)[O-])CC1 ZINC000596178320 479182724 /nfs/dbraw/zinc/18/27/24/479182724.db2.gz IIZGIRYTPCZNEU-LBPRGKRZSA-N 1 1 346.362 2.718 10 5 EFBEMO COC(=O)c1c(Cl)c(N2C[C@H](C)[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000596180038 479183840 /nfs/dbraw/zinc/18/38/40/479183840.db2.gz WSAPUXZSDLQIQH-UWVGGRQHSA-N 1 1 341.795 2.564 10 5 EFBEMO COC(=O)c1c(Cl)c(N2C[C@H](C)[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000596180038 479183848 /nfs/dbraw/zinc/18/38/48/479183848.db2.gz WSAPUXZSDLQIQH-UWVGGRQHSA-N 1 1 341.795 2.564 10 5 EFBEMO O=C(CC[N@H+]1CC[C@]2(CC2(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000593115248 479184691 /nfs/dbraw/zinc/18/46/91/479184691.db2.gz BMSJHSYOQSONTR-AWEZNQCLSA-N 1 1 325.315 2.655 10 5 EFBEMO COC(=O)c1c(Cl)c(N(C)CC[N@@H+](C)C2CC2)ccc1[N+](=O)[O-] ZINC000596193147 479190610 /nfs/dbraw/zinc/19/06/10/479190610.db2.gz CFMOGIZZQSJBQU-UHFFFAOYSA-N 1 1 341.795 2.565 10 5 EFBEMO Cc1ccc(OC[C@@H](O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000556831219 479217850 /nfs/dbraw/zinc/21/78/50/479217850.db2.gz GRXHAXCXGPLKKK-KRWDZBQOSA-N 1 1 344.411 2.817 10 5 EFBEMO COc1cc(NC[C@H]2CCC[N@H+]2CCCO)c(Cl)cc1[N+](=O)[O-] ZINC000596256191 479227083 /nfs/dbraw/zinc/22/70/83/479227083.db2.gz BNCZUPZOHXOMFV-LLVKDONJSA-N 1 1 343.811 2.516 10 5 EFBEMO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1nccc2ccc([N+](=O)[O-])cc21 ZINC000596361257 479265095 /nfs/dbraw/zinc/26/50/95/479265095.db2.gz KLEXMWMEKCKALT-AWEZNQCLSA-N 1 1 345.447 2.827 10 5 EFBEMO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1nccc2ccc([N+](=O)[O-])cc21 ZINC000596361257 479265106 /nfs/dbraw/zinc/26/51/06/479265106.db2.gz KLEXMWMEKCKALT-AWEZNQCLSA-N 1 1 345.447 2.827 10 5 EFBEMO CC[C@H](NC(=O)N(CC)[C@@H]1CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000596456927 479302737 /nfs/dbraw/zinc/30/27/37/479302737.db2.gz UZOKCRWXMFILQW-CVEARBPZSA-N 1 1 334.420 2.782 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](C(F)F)C1 ZINC000611179610 479304164 /nfs/dbraw/zinc/30/41/64/479304164.db2.gz GFXDXLABHYFBBP-LLVKDONJSA-N 1 1 327.331 2.819 10 5 EFBEMO COc1cccc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c1[N+](=O)[O-] ZINC000596514367 479324723 /nfs/dbraw/zinc/32/47/23/479324723.db2.gz KQMQMVBONDCIPT-HZPDHXFCSA-N 1 1 347.415 2.659 10 5 EFBEMO Cc1c(C[N@@H+]2CCOC[C@@H]2[C@H]2CCCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000585800616 479331696 /nfs/dbraw/zinc/33/16/96/479331696.db2.gz BSVQNUUVBGPCNA-KBAYOESNSA-N 1 1 334.416 2.655 10 5 EFBEMO Cc1c(C[N@H+]2CCOC[C@@H]2[C@H]2CCCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000585800616 479331700 /nfs/dbraw/zinc/33/17/00/479331700.db2.gz BSVQNUUVBGPCNA-KBAYOESNSA-N 1 1 334.416 2.655 10 5 EFBEMO O=C1[C@@H]([N@H+]2CC[C@H]3CC[C@@H](C2)S3)CCN1c1cccc([N+](=O)[O-])c1 ZINC000599552806 479331794 /nfs/dbraw/zinc/33/17/94/479331794.db2.gz IYRIWPKQSDTYDT-PMPSAXMXSA-N 1 1 347.440 2.670 10 5 EFBEMO NC(=O)c1ccc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c([N+](=O)[O-])c1 ZINC000599572770 479337690 /nfs/dbraw/zinc/33/76/90/479337690.db2.gz BLPVMFVEJCTWSD-QGZVFWFLSA-N 1 1 340.383 2.720 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(CN3C[C@@H]4C[NH2+]C[C@H]4C3)s2)cc1 ZINC000611287775 479337934 /nfs/dbraw/zinc/33/79/34/479337934.db2.gz HVPALQFOABZODK-KBPBESRZSA-N 1 1 329.425 2.975 10 5 EFBEMO COC(=O)c1ccc(C[N@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)nc1 ZINC000586760135 479345379 /nfs/dbraw/zinc/34/53/79/479345379.db2.gz SILMQLJTQYHFDP-GFCCVEGCSA-N 1 1 329.356 2.969 10 5 EFBEMO COC(=O)c1ccc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)nc1 ZINC000586760135 479345384 /nfs/dbraw/zinc/34/53/84/479345384.db2.gz SILMQLJTQYHFDP-GFCCVEGCSA-N 1 1 329.356 2.969 10 5 EFBEMO CC1(C)C[N@H+](CCNc2ccnc3cc([N+](=O)[O-])ccc32)CCO1 ZINC000593460468 479350694 /nfs/dbraw/zinc/35/06/94/479350694.db2.gz CKEFVRHQOXTDQK-UHFFFAOYSA-N 1 1 330.388 2.666 10 5 EFBEMO CC1(C)C[N@@H+](CCNc2ccnc3cc([N+](=O)[O-])ccc32)CCO1 ZINC000593460468 479350700 /nfs/dbraw/zinc/35/07/00/479350700.db2.gz CKEFVRHQOXTDQK-UHFFFAOYSA-N 1 1 330.388 2.666 10 5 EFBEMO C[C@@H](Nc1ccnc2cc([N+](=O)[O-])ccc21)[C@@H](C)[NH+]1CCOCC1 ZINC000593461958 479351631 /nfs/dbraw/zinc/35/16/31/479351631.db2.gz WMSCRHHYDLFLBO-CHWSQXEVSA-N 1 1 330.388 2.664 10 5 EFBEMO COc1cc(C[N@@H+]2Cc3cnn(C)c3CC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000596597963 479353396 /nfs/dbraw/zinc/35/33/96/479353396.db2.gz HCJKRIJSUJKABU-UHFFFAOYSA-N 1 1 344.415 2.921 10 5 EFBEMO COc1cc(C[N@H+]2Cc3cnn(C)c3CC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000596597963 479353399 /nfs/dbraw/zinc/35/33/99/479353399.db2.gz HCJKRIJSUJKABU-UHFFFAOYSA-N 1 1 344.415 2.921 10 5 EFBEMO C[C@@H](CCN1CC[NH+](C)CC1)Nc1ccnc2cc([N+](=O)[O-])ccc21 ZINC000593467384 479354495 /nfs/dbraw/zinc/35/44/95/479354495.db2.gz LRSHINLRBBSCNO-AWEZNQCLSA-N 1 1 343.431 2.581 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000593479900 479359564 /nfs/dbraw/zinc/35/95/64/479359564.db2.gz LDEKHIBYXQEDTL-UHFFFAOYSA-N 1 1 334.420 2.869 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])[C@H]2CCC[C@@H]21 ZINC000599644489 479365904 /nfs/dbraw/zinc/36/59/04/479365904.db2.gz BFXZBXOGQLSCKH-KFWWJZLASA-N 1 1 336.363 2.898 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])[C@H]2CCC[C@@H]21 ZINC000599644489 479365909 /nfs/dbraw/zinc/36/59/09/479365909.db2.gz BFXZBXOGQLSCKH-KFWWJZLASA-N 1 1 336.363 2.898 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)[C@@H]2CCC[C@H]21 ZINC000599657370 479374606 /nfs/dbraw/zinc/37/46/06/479374606.db2.gz JWYIXVWJJXJOJH-SQWLQELKSA-N 1 1 336.363 2.898 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)[C@@H]2CCC[C@H]21 ZINC000599657370 479374611 /nfs/dbraw/zinc/37/46/11/479374611.db2.gz JWYIXVWJJXJOJH-SQWLQELKSA-N 1 1 336.363 2.898 10 5 EFBEMO O=C(C[N@@H+]1CCCC2(CC2)CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000599673274 479384440 /nfs/dbraw/zinc/38/44/40/479384440.db2.gz NQFNXZQDCLJSNO-UHFFFAOYSA-N 1 1 347.371 2.528 10 5 EFBEMO O=C(C[N@H+]1CCCC2(CC2)CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000599673274 479384447 /nfs/dbraw/zinc/38/44/47/479384447.db2.gz NQFNXZQDCLJSNO-UHFFFAOYSA-N 1 1 347.371 2.528 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000611502426 479397609 /nfs/dbraw/zinc/39/76/09/479397609.db2.gz SEQUOTBPBHYATL-AAEUAGOBSA-N 1 1 339.367 2.612 10 5 EFBEMO COC(=O)C1C[C@H](C)[NH+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000599709106 479401403 /nfs/dbraw/zinc/40/14/03/479401403.db2.gz PLGKAKIYCNMTES-RYUDHWBXSA-N 1 1 336.388 2.765 10 5 EFBEMO COCC[N@H+]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])C(C)(C)C1 ZINC000593694348 479424824 /nfs/dbraw/zinc/42/48/24/479424824.db2.gz YYSIJYUKKKCMSI-VURMDHGXSA-N 1 1 333.432 2.651 10 5 EFBEMO CC(C)(C)CC(=O)N1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000603873068 479442472 /nfs/dbraw/zinc/44/24/72/479442472.db2.gz GLEKAYKNWMWYLH-UHFFFAOYSA-N 1 1 333.432 2.718 10 5 EFBEMO CC[N@H+]1CC[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599831746 479443196 /nfs/dbraw/zinc/44/31/96/479443196.db2.gz YIMAKKFQKVMJJH-GFCCVEGCSA-N 1 1 343.387 2.606 10 5 EFBEMO CC[N@H+]1CC[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599831747 479443600 /nfs/dbraw/zinc/44/36/00/479443600.db2.gz YIMAKKFQKVMJJH-LBPRGKRZSA-N 1 1 343.387 2.606 10 5 EFBEMO O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000588816151 479444364 /nfs/dbraw/zinc/44/43/64/479444364.db2.gz LYBOGPZRDDLPGW-UONOGXRCSA-N 1 1 341.770 2.507 10 5 EFBEMO C[N@@H+]1CC=C(CNC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)CC1 ZINC000599833783 479444822 /nfs/dbraw/zinc/44/48/22/479444822.db2.gz YJXNNRYJBRUSIG-UHFFFAOYSA-N 1 1 341.371 2.526 10 5 EFBEMO CCN(C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1 ZINC000596831881 479445450 /nfs/dbraw/zinc/44/54/50/479445450.db2.gz MDMLUCXXQYLROE-ZDUSSCGKSA-N 1 1 336.392 2.551 10 5 EFBEMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599837420 479446855 /nfs/dbraw/zinc/44/68/55/479446855.db2.gz DIHHAFXYAWILJC-GFCCVEGCSA-N 1 1 343.387 2.701 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)c2ncnc3ccc([N+](=O)[O-])cc32)[C@@H](C)C1 ZINC000611706638 479450990 /nfs/dbraw/zinc/45/09/90/479450990.db2.gz KUMMCZVXRVLCPF-BLLLJJGKSA-N 1 1 329.404 2.705 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611709098 479452502 /nfs/dbraw/zinc/45/25/02/479452502.db2.gz XMDPDJNRCSJAKZ-BETUJISGSA-N 1 1 329.404 2.635 10 5 EFBEMO COc1cccc([N+](=O)[O-])c1NCC(C)(C)[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000589104557 479478253 /nfs/dbraw/zinc/47/82/53/479478253.db2.gz RAJAHTXVFFBYMS-STQMWFEESA-N 1 1 337.420 2.903 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@@H](OCc3ccccn3)C2)cc1[N+](=O)[O-] ZINC000602713829 479497371 /nfs/dbraw/zinc/49/73/71/479497371.db2.gz DHWZRDMGWZZEKO-MRXNPFEDSA-N 1 1 343.383 2.790 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@@H](OCc3ccccn3)C2)cc1[N+](=O)[O-] ZINC000602713829 479497375 /nfs/dbraw/zinc/49/73/75/479497375.db2.gz DHWZRDMGWZZEKO-MRXNPFEDSA-N 1 1 343.383 2.790 10 5 EFBEMO Cc1ccc(C[N@@H+]2C[C@@H](O)[C@H](Oc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000602727615 479507091 /nfs/dbraw/zinc/50/70/91/479507091.db2.gz FDRSSQXIIVNYIT-QZTJIDSGSA-N 1 1 328.368 2.527 10 5 EFBEMO Cc1ccc(C[N@H+]2C[C@@H](O)[C@H](Oc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000602727615 479507097 /nfs/dbraw/zinc/50/70/97/479507097.db2.gz FDRSSQXIIVNYIT-QZTJIDSGSA-N 1 1 328.368 2.527 10 5 EFBEMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000575945401 479508872 /nfs/dbraw/zinc/50/88/72/479508872.db2.gz AYKBLHOKXMZKFL-CYBMUJFWSA-N 1 1 335.404 2.550 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[NH+](CCCF)CC1 ZINC000600076457 479509268 /nfs/dbraw/zinc/50/92/68/479509268.db2.gz KIXBYVNYPOAUFB-UHFFFAOYSA-N 1 1 337.395 2.637 10 5 EFBEMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[N@@H+]2CCCC[C@H]2C1 ZINC000604481845 479525296 /nfs/dbraw/zinc/52/52/96/479525296.db2.gz LNSGDPXBWTWQBS-AWEZNQCLSA-N 1 1 329.356 2.651 10 5 EFBEMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000604481845 479525301 /nfs/dbraw/zinc/52/53/01/479525301.db2.gz LNSGDPXBWTWQBS-AWEZNQCLSA-N 1 1 329.356 2.651 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000589502350 479533236 /nfs/dbraw/zinc/53/32/36/479533236.db2.gz VCBDVLPJZFGJDZ-CZUORRHYSA-N 1 1 349.431 2.544 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](c3ccco3)C2)c1 ZINC000589498239 479534271 /nfs/dbraw/zinc/53/42/71/479534271.db2.gz QXPZWDJPHLAZHJ-ZDUSSCGKSA-N 1 1 330.340 2.964 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@]3(CCCOC3)C2)c1 ZINC000589501899 479534683 /nfs/dbraw/zinc/53/46/83/479534683.db2.gz JRBOVQIOZYVMNS-SFHVURJKSA-N 1 1 348.399 2.774 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@]2(C)CCCO)c1 ZINC000589516138 479537653 /nfs/dbraw/zinc/53/76/53/479537653.db2.gz HATHSXACWIOOGE-QGZVFWFLSA-N 1 1 336.388 2.508 10 5 EFBEMO C[C@]12CC[N@H+](Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C[C@H]1C2(F)F ZINC000590049568 479596029 /nfs/dbraw/zinc/59/60/29/479596029.db2.gz OAFVWCMEDIBBEU-CABCVRRESA-N 1 1 340.326 2.843 10 5 EFBEMO C[C@]12CC[N@@H+](Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C[C@H]1C2(F)F ZINC000590049568 479596031 /nfs/dbraw/zinc/59/60/31/479596031.db2.gz OAFVWCMEDIBBEU-CABCVRRESA-N 1 1 340.326 2.843 10 5 EFBEMO C[N@H+]1C[C@H]2CCN(Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)[C@@H]2C1 ZINC000590052938 479596618 /nfs/dbraw/zinc/59/66/18/479596618.db2.gz QRWBQCKEUGZGRP-CZUORRHYSA-N 1 1 344.440 2.854 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](Cn2ccnn2)C1 ZINC000597172762 479605325 /nfs/dbraw/zinc/60/53/25/479605325.db2.gz CCBPAYLHHATVRL-SCZPIIQISA-N 1 1 327.388 2.612 10 5 EFBEMO CC(C)c1ccc(C[N@H+]2CC[C@@H](Cn3ccnn3)C2)cc1[N+](=O)[O-] ZINC000597176237 479606346 /nfs/dbraw/zinc/60/63/46/479606346.db2.gz SRHBTCXOMCESFY-OAHLLOKOSA-N 1 1 329.404 2.832 10 5 EFBEMO CO[C@]1(CO)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000597188278 479612203 /nfs/dbraw/zinc/61/22/03/479612203.db2.gz SIOHLUCSWURSDP-GOSISDBHSA-N 1 1 346.383 2.828 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](N(C)C(=O)N(C)C)C1 ZINC000597224645 479630175 /nfs/dbraw/zinc/63/01/75/479630175.db2.gz NIIAEJANWYBGAZ-OOXMNIKJSA-N 1 1 346.431 2.686 10 5 EFBEMO C[C@@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000597225809 479630854 /nfs/dbraw/zinc/63/08/54/479630854.db2.gz VHLSBYGVBWZUMH-KGLIPLIRSA-N 1 1 344.415 2.995 10 5 EFBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CC[C@@H]3COC[C@H]3C2)c1 ZINC000597231850 479633807 /nfs/dbraw/zinc/63/38/07/479633807.db2.gz RUENYLHZMGHJBI-ZYHUDNBSSA-N 1 1 328.315 2.665 10 5 EFBEMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@@H]21 ZINC000590441272 479648135 /nfs/dbraw/zinc/64/81/35/479648135.db2.gz CZHGDNPBHNXKDA-DOMZBBRYSA-N 1 1 349.456 2.871 10 5 EFBEMO C[N@H+]1C[C@@H]2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@@H]2C1 ZINC000590442470 479648248 /nfs/dbraw/zinc/64/82/48/479648248.db2.gz HEQWABBEYIZQLN-GXFFZTMASA-N 1 1 331.397 2.586 10 5 EFBEMO O=C(CC[NH2+]C1CCN(C2CCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000579222768 479675626 /nfs/dbraw/zinc/67/56/26/479675626.db2.gz DSAUCLPDXPTWSK-UHFFFAOYSA-N 1 1 346.431 2.530 10 5 EFBEMO C[C@@H]1CC[N@@H+](CC(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000579244548 479678512 /nfs/dbraw/zinc/67/85/12/479678512.db2.gz ORVYRRPCCGGTDN-WBMJQRKESA-N 1 1 335.429 2.511 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cc4ccccc4[nH]3)CC2)nc1 ZINC000619069255 479679712 /nfs/dbraw/zinc/67/97/12/479679712.db2.gz LLNASGKSEUMGMD-UHFFFAOYSA-N 1 1 337.383 2.793 10 5 EFBEMO CC1(C)C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000619434240 479789491 /nfs/dbraw/zinc/78/94/91/479789491.db2.gz PNMHPIAKPDWCGP-LZCIBIBXSA-N 1 1 332.400 2.878 10 5 EFBEMO CC1(C)C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000619434240 479789497 /nfs/dbraw/zinc/78/94/97/479789497.db2.gz PNMHPIAKPDWCGP-LZCIBIBXSA-N 1 1 332.400 2.878 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2CCC[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000616135055 479833058 /nfs/dbraw/zinc/83/30/58/479833058.db2.gz FYACZGOTIGKMMV-AWEZNQCLSA-N 1 1 334.372 2.521 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2CCC[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000616135056 479833237 /nfs/dbraw/zinc/83/32/37/479833237.db2.gz FYACZGOTIGKMMV-CQSZACIVSA-N 1 1 334.372 2.521 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H]2C[NH+]2C[C@@H](C)O[C@H](C)C2)n1 ZINC000614517860 480328379 /nfs/dbraw/zinc/32/83/79/480328379.db2.gz CZNSKXNLKCPOLN-BZUAXINKSA-N 1 1 348.447 2.685 10 5 EFBEMO COc1cc(CN(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000184230071 533793795 /nfs/dbraw/zinc/79/37/95/533793795.db2.gz NESYONRCNIJBOP-DGCLKSJQSA-N 1 1 325.384 2.657 10 5 EFBEMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCOCC1 ZINC000077322825 519654064 /nfs/dbraw/zinc/65/40/64/519654064.db2.gz VMNKIJNZLQVKSM-UHFFFAOYSA-N 1 1 336.388 2.851 10 5 EFBEMO CCOCC[N@H+]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000245706205 519920429 /nfs/dbraw/zinc/92/04/29/519920429.db2.gz FDHYIFWPXKNHOX-IQIBNGDESA-N 1 1 333.432 2.651 10 5 EFBEMO CCOc1ccc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)cc1[N+](=O)[O-] ZINC000119102843 520898386 /nfs/dbraw/zinc/89/83/86/520898386.db2.gz DZURBCUNOFRJTL-GJZGRUSLSA-N 1 1 347.415 2.550 10 5 EFBEMO CC[N@H+](CCc1nccs1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000121079960 521179799 /nfs/dbraw/zinc/17/97/99/521179799.db2.gz QHCUJDVFAWZZQK-GFCCVEGCSA-N 1 1 348.428 2.943 10 5 EFBEMO CC[N@@H+](CCc1nccs1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000121079960 521179806 /nfs/dbraw/zinc/17/98/06/521179806.db2.gz QHCUJDVFAWZZQK-GFCCVEGCSA-N 1 1 348.428 2.943 10 5 EFBEMO CC[N@H+]1CCC[C@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1 ZINC000119093889 521645103 /nfs/dbraw/zinc/64/51/03/521645103.db2.gz YVRFXPLKJNQTJR-HNNXBMFYSA-N 1 1 346.431 2.753 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000245477837 521652998 /nfs/dbraw/zinc/65/29/98/521652998.db2.gz USRKBEHFKYTOQG-CABCVRRESA-N 1 1 348.447 2.646 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000245443628 521713193 /nfs/dbraw/zinc/71/31/93/521713193.db2.gz XIYVBEZFRQNJGL-WMLDXEAASA-N 1 1 348.447 2.504 10 5 EFBEMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+]2CCC[C@H]2C1 ZINC000179659974 521751938 /nfs/dbraw/zinc/75/19/38/521751938.db2.gz QXQUXXXFXOGRCO-ZDUSSCGKSA-N 1 1 335.429 2.627 10 5 EFBEMO CC[C@H](NC(=O)N1CCC[N@H+](C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000176708787 522419820 /nfs/dbraw/zinc/41/98/20/522419820.db2.gz XMUVXMTWANPUPQ-KRWDZBQOSA-N 1 1 346.431 2.926 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000245935716 523318252 /nfs/dbraw/zinc/31/82/52/523318252.db2.gz KVQHICAIYHALSV-HOTGVXAUSA-N 1 1 331.416 2.531 10 5 EFBEMO CCc1ccc(C(=O)N(C)[C@H]2CC[N@H+](CC)C[C@H]2C)cc1[N+](=O)[O-] ZINC000245408415 523880669 /nfs/dbraw/zinc/88/06/69/523880669.db2.gz HBMCNYGUZXICCH-CJNGLKHVSA-N 1 1 333.432 2.960 10 5 EFBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(c2cc[nH]n2)CC1 ZINC000195506365 524280189 /nfs/dbraw/zinc/28/01/89/524280189.db2.gz GHNVKPRYSGIVTR-LBPRGKRZSA-N 1 1 343.387 2.525 10 5 EFBEMO C[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@H]1c1cccc(F)c1 ZINC000245571882 524291425 /nfs/dbraw/zinc/29/14/25/524291425.db2.gz BXTLMBXDNJNSJL-SCLBCKFNSA-N 1 1 345.374 2.979 10 5 EFBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000175143639 534778050 /nfs/dbraw/zinc/77/80/50/534778050.db2.gz MSKFPPQMUZCDPR-HNNXBMFYSA-N 1 1 329.360 2.796 10 5 EFBEMO Cc1ccc(C[N@@H+](C)CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)o1 ZINC000117333737 524392863 /nfs/dbraw/zinc/39/28/63/524392863.db2.gz NUTURCSPHWOODU-UHFFFAOYSA-N 1 1 345.355 2.926 10 5 EFBEMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1 ZINC000245444529 525446399 /nfs/dbraw/zinc/44/63/99/525446399.db2.gz JSANPRHLTOTXFT-KGLIPLIRSA-N 1 1 347.415 2.691 10 5 EFBEMO Cc1ccc([C@@H](C)NC(=O)N2CCC[N@H+](C3CC3)CC2)cc1[N+](=O)[O-] ZINC000176751187 525701127 /nfs/dbraw/zinc/70/11/27/525701127.db2.gz GLNKSLKDVOWZHP-CQSZACIVSA-N 1 1 346.431 2.844 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](CNc3ccccn3)C2)c1 ZINC000171642040 534886699 /nfs/dbraw/zinc/88/66/99/534886699.db2.gz IIHNSJMQFVANNA-HNNXBMFYSA-N 1 1 342.399 2.803 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N2CCC[N@H+](C3CC3)CC2)cc1[N+](=O)[O-] ZINC000176751205 525895747 /nfs/dbraw/zinc/89/57/47/525895747.db2.gz GLNKSLKDVOWZHP-AWEZNQCLSA-N 1 1 346.431 2.844 10 5 EFBEMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[N@H+](C2CC2)CC1 ZINC000061605379 525988264 /nfs/dbraw/zinc/98/82/64/525988264.db2.gz KRAIZCFKPXYGSU-CYBMUJFWSA-N 1 1 349.456 2.772 10 5 EFBEMO Cc1nc(C[C@@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)no1 ZINC000195518369 526920199 /nfs/dbraw/zinc/92/01/99/526920199.db2.gz IKFAQPQDNYTQRU-AWEZNQCLSA-N 1 1 346.387 2.620 10 5 EFBEMO Cc1nc(C[C@H]2CCC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)C2)no1 ZINC000195518225 526924098 /nfs/dbraw/zinc/92/40/98/526924098.db2.gz QMFVFYCMMPROMV-CQSZACIVSA-N 1 1 346.387 2.620 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](Oc3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000194011951 527349067 /nfs/dbraw/zinc/34/90/67/527349067.db2.gz OVWFBDHGDRDHPT-HNNXBMFYSA-N 1 1 344.327 2.551 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Oc3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000194011951 527349072 /nfs/dbraw/zinc/34/90/72/527349072.db2.gz OVWFBDHGDRDHPT-HNNXBMFYSA-N 1 1 344.327 2.551 10 5 EFBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000177190746 527448184 /nfs/dbraw/zinc/44/81/84/527448184.db2.gz JMAHZMXJEABSDE-CYBMUJFWSA-N 1 1 332.335 2.544 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000184199256 527525551 /nfs/dbraw/zinc/52/55/51/527525551.db2.gz JNJJPSQWVPHYAB-ZTODGRRHSA-N 1 1 331.416 2.939 10 5 EFBEMO CC[N@H+]1CCC[C@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000175435992 529088893 /nfs/dbraw/zinc/08/88/93/529088893.db2.gz TZXSAASOFYBCCH-AWEZNQCLSA-N 1 1 334.420 2.613 10 5 EFBEMO CC(C)Oc1cc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000412126415 534942254 /nfs/dbraw/zinc/94/22/54/534942254.db2.gz KDYXVDNXYMHEAO-UKRRQHHQSA-N 1 1 349.431 2.937 10 5 EFBEMO CC(C)Oc1cc(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000412188879 534942472 /nfs/dbraw/zinc/94/24/72/534942472.db2.gz FECMGAMSYMJMDH-HNNXBMFYSA-N 1 1 347.415 2.691 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@H]4COCC[C@@H]43)c2)cc1 ZINC000756892440 575797428 /nfs/dbraw/zinc/79/74/28/575797428.db2.gz WXJDLKHZERHJRO-YJBOKZPZSA-N 1 1 342.399 2.917 10 5 EFBEMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCCCO)CC2)cc1Cl ZINC000761515936 576173659 /nfs/dbraw/zinc/17/36/59/576173659.db2.gz WWOAQNUQXVWQII-UHFFFAOYSA-N 1 1 328.796 2.612 10 5 EFBEMO C/C(=C/C(=O)NCC[N@@H+]1CC=C(C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000762706011 576326149 /nfs/dbraw/zinc/32/61/49/576326149.db2.gz JKSPDFQCOMEXHO-SQFISAMPSA-N 1 1 329.400 2.766 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@H](Cc3ccncc3)C2)cc1 ZINC000765006846 576535636 /nfs/dbraw/zinc/53/56/36/576535636.db2.gz YYXAGZCMNZMRML-YJBOKZPZSA-N 1 1 327.384 2.588 10 5 EFBEMO Cc1[nH+]ccn1CCCOC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000767617020 577219125 /nfs/dbraw/zinc/21/91/25/577219125.db2.gz RFYBZAPUHPEBCT-UHFFFAOYSA-N 1 1 328.328 2.828 10 5 EFBEMO CC[N@@H+](CCNc1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-])C(C)C ZINC000726594479 577374842 /nfs/dbraw/zinc/37/48/42/577374842.db2.gz AYGFVXIPPSPYIJ-VQHVLOKHSA-N 1 1 335.404 2.923 10 5 EFBEMO COc1cc(C[NH2+][C@@H]2C[C@H](O)c3ccccc32)c([N+](=O)[O-])cc1O ZINC000850371457 1250451988 /nfs/dbraw/zinc/45/19/88/1250451988.db2.gz JVNZALLKDDDPES-HIFRSBDPSA-N 1 1 330.340 2.577 10 5 EFBEMO O=[N+]([O-])c1cccc(Br)c1C[NH2+][C@@H]1C[C@@H](O)C12CCC2 ZINC000850388128 1250460531 /nfs/dbraw/zinc/46/05/31/1250460531.db2.gz IGBTXWAYFYLZTA-CHWSQXEVSA-N 1 1 341.205 2.750 10 5 EFBEMO Cc1noc(C[N@@H+]2CCCN(c3ccc(C)cc3)CC2)c1[N+](=O)[O-] ZINC000851732954 1251232501 /nfs/dbraw/zinc/23/25/01/1251232501.db2.gz DZOACXUMSOMZSY-UHFFFAOYSA-N 1 1 330.388 2.912 10 5 EFBEMO Cc1noc(C[N@H+]2CCCN(c3ccc(C)cc3)CC2)c1[N+](=O)[O-] ZINC000851732954 1251232509 /nfs/dbraw/zinc/23/25/09/1251232509.db2.gz DZOACXUMSOMZSY-UHFFFAOYSA-N 1 1 330.388 2.912 10 5 EFBEMO [NH3+]C[C@@H]1CC2(CO1)CCN(Cc1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000923448261 1261669058 /nfs/dbraw/zinc/66/90/58/1261669058.db2.gz ANSJQWXIFOITMX-AWEZNQCLSA-N 1 1 339.823 2.578 10 5 EFBEMO C[C@@H](NC(=O)NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000923451554 1261688636 /nfs/dbraw/zinc/68/86/36/1261688636.db2.gz OGQPNYKEUGVIAY-DYVFJYSZSA-N 1 1 346.431 2.972 10 5 EFBEMO CC(C)(C)C(=O)NCC1=CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001486518922 1263306588 /nfs/dbraw/zinc/30/65/88/1263306588.db2.gz BGYGEZDLBAEBRD-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(c2cccc(F)n2)CC1 ZINC000824815481 1278300362 /nfs/dbraw/zinc/30/03/62/1278300362.db2.gz QMMXWCKLVJBJQO-UHFFFAOYSA-N 1 1 330.363 2.760 10 5 EFBEMO CC[NH+](CC)CC1CCN(Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000738071614 1268310773 /nfs/dbraw/zinc/31/07/73/1268310773.db2.gz SSBOTJHXEZQTPE-UHFFFAOYSA-N 1 1 345.447 2.956 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]([C@H](O)C(F)(F)F)C2)cc1Cl ZINC000825123696 1278419965 /nfs/dbraw/zinc/41/99/65/1278419965.db2.gz BVMLACAROCKPGC-SKDRFNHKSA-N 1 1 338.713 2.993 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]([C@H](O)C(F)(F)F)C2)cc1Cl ZINC000825123696 1278419968 /nfs/dbraw/zinc/41/99/68/1278419968.db2.gz BVMLACAROCKPGC-SKDRFNHKSA-N 1 1 338.713 2.993 10 5 EFBEMO COC(=O)/C=C/c1ccc(NCC[N@H+]2CCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000742427923 1270048856 /nfs/dbraw/zinc/04/88/56/1270048856.db2.gz UJCPFOBMKPJSFQ-CFNZNRNTSA-N 1 1 333.388 2.677 10 5 EFBEMO COC(=O)/C=C/c1ccc(NCC[N@H+]2CCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000742427925 1270049175 /nfs/dbraw/zinc/04/91/75/1270049175.db2.gz UJCPFOBMKPJSFQ-STMXVASLSA-N 1 1 333.388 2.677 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CC[C@]4(C3)CCCOC4)c2)c1 ZINC000789548125 1276805107 /nfs/dbraw/zinc/80/51/07/1276805107.db2.gz ZZUOEAXZCFWJBT-SFHVURJKSA-N 1 1 342.399 2.918 10 5 EFBEMO O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000791258629 1278005049 /nfs/dbraw/zinc/00/50/49/1278005049.db2.gz KTPHJDPJOQGZGC-TZMCWYRMSA-N 1 1 341.770 2.507 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CC[C@@]4(CC4(F)F)C3)n2)c1 ZINC000844759501 1279225788 /nfs/dbraw/zinc/22/57/88/1279225788.db2.gz ZKWWJQKWCXVYAT-CQSZACIVSA-N 1 1 335.314 2.542 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@@]4(CC4(F)F)C3)n2)c1 ZINC000844759501 1279225797 /nfs/dbraw/zinc/22/57/97/1279225797.db2.gz ZKWWJQKWCXVYAT-CQSZACIVSA-N 1 1 335.314 2.542 10 5 EFBEMO C[C@H]([NH2+]CCC(=O)Nc1ccccn1)c1c(F)cccc1[N+](=O)[O-] ZINC000872027108 1287404779 /nfs/dbraw/zinc/40/47/79/1287404779.db2.gz HLHCQSDTFCDOTL-NSHDSACASA-N 1 1 332.335 2.808 10 5 EFBEMO C[C@H]([NH2+][C@H](CO)C[C@@H](O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052502 1287413307 /nfs/dbraw/zinc/41/33/07/1287413307.db2.gz SNUBTJLOIBBWMU-RVSPLBMKSA-N 1 1 348.374 2.869 10 5 EFBEMO CCN(C)C(=O)[C@@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])C(C)C ZINC000872075314 1287420432 /nfs/dbraw/zinc/42/04/32/1287420432.db2.gz PQRFARZOWIYYHP-ABAIWWIYSA-N 1 1 325.384 2.887 10 5 EFBEMO C[C@H]([NH2+][C@@H]1COc2ccccc2[C@H]1O)c1c(F)cccc1[N+](=O)[O-] ZINC000872074266 1287420453 /nfs/dbraw/zinc/42/04/53/1287420453.db2.gz ZTCAJOLVGNYGKP-MNRXQERYSA-N 1 1 332.331 2.879 10 5 EFBEMO CC[N@@H+](CCNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N)C(C)C ZINC000825574838 1287424522 /nfs/dbraw/zinc/42/45/22/1287424522.db2.gz BXDUCVCYTMINDJ-UHFFFAOYSA-N 1 1 343.815 2.682 10 5 EFBEMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)/C=C(\C)c1ccc([N+](=O)[O-])cc1 ZINC000846988515 1280676343 /nfs/dbraw/zinc/67/63/43/1280676343.db2.gz MHVQWFVVXVZMKD-WCRPCQDQSA-N 1 1 331.416 2.941 10 5 EFBEMO CN(C)c1cc[nH+]c(NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000808164500 1281548787 /nfs/dbraw/zinc/54/87/87/1281548787.db2.gz YKHWFQGIYWWTNX-UHFFFAOYSA-N 1 1 326.360 2.587 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@H](C4CC4)C3)n2)c1 ZINC000808230019 1281598741 /nfs/dbraw/zinc/59/87/41/1281598741.db2.gz FQOCQFMGFSBCIC-HNNXBMFYSA-N 1 1 327.388 2.933 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](C(C)(C)O)C1 ZINC001175890541 1287578845 /nfs/dbraw/zinc/57/88/45/1287578845.db2.gz BENLQHOPRANWTH-YPMHNXCESA-N 1 1 346.387 2.799 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000810556549 1283336350 /nfs/dbraw/zinc/33/63/50/1283336350.db2.gz PUBOEKFTKFMZAT-INIZCTEOSA-N 1 1 342.342 2.990 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCc2c(F)cccc2[N+](=O)[O-])C1 ZINC000811444853 1284319971 /nfs/dbraw/zinc/31/99/71/1284319971.db2.gz MOZMUGPYCZLZKI-MRXNPFEDSA-N 1 1 342.342 2.990 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCc2ccc([N+](=O)[O-])cc2F)C1 ZINC000811446908 1284323820 /nfs/dbraw/zinc/32/38/20/1284323820.db2.gz YIFLWMQQTWGFLD-MRXNPFEDSA-N 1 1 342.342 2.990 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000811449539 1284326052 /nfs/dbraw/zinc/32/60/52/1284326052.db2.gz RQHJPPRAHUCUOM-MRXNPFEDSA-N 1 1 342.342 2.990 10 5 EFBEMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000747833250 1285584812 /nfs/dbraw/zinc/58/48/12/1285584812.db2.gz VEOCGIKXNUINLZ-KGLIPLIRSA-N 1 1 330.388 2.651 10 5 EFBEMO C[C@H](COC(=O)[C@@H](C)[NH+]1CCC(Cc2ccccc2)CC1)[N+](=O)[O-] ZINC000813101907 1285652370 /nfs/dbraw/zinc/65/23/70/1285652370.db2.gz LFMNCEAHHNWJQY-HUUCEWRRSA-N 1 1 334.416 2.538 10 5 EFBEMO O=C(CC1CCOCC1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171360 1285703330 /nfs/dbraw/zinc/70/33/30/1285703330.db2.gz ISTHWLRWKVQJHB-KRWDZBQOSA-N 1 1 348.399 2.529 10 5 EFBEMO O=C(CC1CCOCC1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171360 1285703335 /nfs/dbraw/zinc/70/33/35/1285703335.db2.gz ISTHWLRWKVQJHB-KRWDZBQOSA-N 1 1 348.399 2.529 10 5 EFBEMO CC(C)(C)OCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173330 1285705780 /nfs/dbraw/zinc/70/57/80/1285705780.db2.gz ZHFWZYWMIROSKW-HNNXBMFYSA-N 1 1 336.388 2.527 10 5 EFBEMO CC(C)(C)OCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173330 1285705788 /nfs/dbraw/zinc/70/57/88/1285705788.db2.gz ZHFWZYWMIROSKW-HNNXBMFYSA-N 1 1 336.388 2.527 10 5 EFBEMO C[N@H+]1CCC[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000813442126 1285910627 /nfs/dbraw/zinc/91/06/27/1285910627.db2.gz FDYGSBWTWOVGLN-SECBINFHSA-N 1 1 332.187 2.726 10 5 EFBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cc[nH+]c(N2CCCCC2)c1 ZINC001134437808 1286740698 /nfs/dbraw/zinc/74/06/98/1286740698.db2.gz LPSQUYUNJXAKNF-UHFFFAOYSA-N 1 1 341.371 2.936 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1 ZINC001134550953 1286902043 /nfs/dbraw/zinc/90/20/43/1286902043.db2.gz SAJQAPWNSACGGF-FCEWJHQRSA-N 1 1 345.443 2.574 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1 ZINC001134550954 1286902554 /nfs/dbraw/zinc/90/25/54/1286902554.db2.gz SAJQAPWNSACGGF-MDZRGWNJSA-N 1 1 345.443 2.574 10 5 EFBEMO CCOC(=O)[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC001176650013 1288077907 /nfs/dbraw/zinc/07/79/07/1288077907.db2.gz NELOWSYXCUFCSZ-ZDUSSCGKSA-N 1 1 336.388 2.767 10 5 EFBEMO CCOC(=O)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC001176650013 1288077909 /nfs/dbraw/zinc/07/79/09/1288077909.db2.gz NELOWSYXCUFCSZ-ZDUSSCGKSA-N 1 1 336.388 2.767 10 5 EFBEMO Cc1c(Cl)cccc1N1CC[NH+](CCn2ccc([N+](=O)[O-])n2)CC1 ZINC001176841984 1288146795 /nfs/dbraw/zinc/14/67/95/1288146795.db2.gz MNSMFBGUUIHIBC-UHFFFAOYSA-N 1 1 349.822 2.575 10 5 EFBEMO Cn1cc([C@H]2CCC[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)nn1 ZINC001176880468 1288159271 /nfs/dbraw/zinc/15/92/71/1288159271.db2.gz VNPAVYSQURUHOI-NSHDSACASA-N 1 1 335.795 2.756 10 5 EFBEMO Cn1cc([C@H]2CCC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)nn1 ZINC001176880468 1288159274 /nfs/dbraw/zinc/15/92/74/1288159274.db2.gz VNPAVYSQURUHOI-NSHDSACASA-N 1 1 335.795 2.756 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCCC[N@H+]1CC ZINC001136754870 1289394701 /nfs/dbraw/zinc/39/47/01/1289394701.db2.gz GTXLLWVBFFTFMF-ZDUSSCGKSA-N 1 1 335.404 2.598 10 5 EFBEMO CC[N@@H+](C)[C@@H]1CCN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC001181841019 1289971761 /nfs/dbraw/zinc/97/17/61/1289971761.db2.gz VDRGZFLQXZGZJB-MRXNPFEDSA-N 1 1 331.416 2.569 10 5 EFBEMO C[C@H](CN1CCOCC1)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001191683518 1292626647 /nfs/dbraw/zinc/62/66/47/1292626647.db2.gz XEYZPVVKEKLFPG-OAHLLOKOSA-N 1 1 333.432 2.528 10 5 EFBEMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001192313281 1292863949 /nfs/dbraw/zinc/86/39/49/1292863949.db2.gz CCMYGQAWKVOFBV-WDEREUQCSA-N 1 1 342.237 2.882 10 5 EFBEMO C[C@H](CN1CCOCC1)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001192387441 1292887651 /nfs/dbraw/zinc/88/76/51/1292887651.db2.gz CAYJGCQGBBPSSX-OAHLLOKOSA-N 1 1 333.432 2.528 10 5 EFBEMO CC(=O)c1c(NCCC[N@H+]2CCCO[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000882265087 1293145550 /nfs/dbraw/zinc/14/55/50/1293145550.db2.gz PPCKDVPRCRHDAT-CYBMUJFWSA-N 1 1 335.404 2.710 10 5 EFBEMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCC[C@]2(CCOC2)O1 ZINC001194262296 1293574503 /nfs/dbraw/zinc/57/45/03/1293574503.db2.gz MAMPPSNECPOAPR-FUHWJXTLSA-N 1 1 334.416 2.797 10 5 EFBEMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCC[C@@]2(CCOC2)O1 ZINC001194262299 1293574672 /nfs/dbraw/zinc/57/46/72/1293574672.db2.gz MAMPPSNECPOAPR-WMZOPIPTSA-N 1 1 334.416 2.797 10 5 EFBEMO COC1(c2nccn2C)CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC001197469588 1294558401 /nfs/dbraw/zinc/55/84/01/1294558401.db2.gz ZNACPBHSWUBTQO-UHFFFAOYSA-N 1 1 348.378 2.605 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](c2cn(C)nn2)C1 ZINC001198612300 1295148143 /nfs/dbraw/zinc/14/81/43/1295148143.db2.gz NDSJLMJFIAANLV-UONOGXRCSA-N 1 1 329.404 2.972 10 5 EFBEMO COc1ccc(OCC[N@H+]2CCCC[C@]23CCOC3)c([N+](=O)[O-])c1 ZINC001198761846 1295238634 /nfs/dbraw/zinc/23/86/34/1295238634.db2.gz RLTRHUKZADNJRX-QGZVFWFLSA-N 1 1 336.388 2.627 10 5 EFBEMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1CC[N@@H+](C)[C@H]1C ZINC000931627305 1297357948 /nfs/dbraw/zinc/35/79/48/1297357948.db2.gz ZMIYUBZZHAYHGL-GXSJLCMTSA-N 1 1 326.784 2.771 10 5 EFBEMO Cc1ccncc1C(=O)NCCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001490169746 1298610547 /nfs/dbraw/zinc/61/05/47/1298610547.db2.gz QWFRAVKWQFVMMW-UHFFFAOYSA-N 1 1 348.428 2.612 10 5 EFBEMO Cc1ccncc1C(=O)NCCC[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001490169746 1298610561 /nfs/dbraw/zinc/61/05/61/1298610561.db2.gz QWFRAVKWQFVMMW-UHFFFAOYSA-N 1 1 348.428 2.612 10 5 EFBEMO Cc1cocc1C(=O)NCCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001490236566 1298656449 /nfs/dbraw/zinc/65/64/49/1298656449.db2.gz KNZYMZBYKREKKP-UHFFFAOYSA-N 1 1 331.372 2.748 10 5 EFBEMO CC/C=C\CC[NH+]1CCC(N(CCC)C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001490616395 1299043288 /nfs/dbraw/zinc/04/32/88/1299043288.db2.gz GBBCIJKXMQHRFZ-MBZYTVFJSA-N 1 1 337.464 2.711 10 5 EFBEMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H](c3ccccn3)C2)c1 ZINC000852086965 1299542084 /nfs/dbraw/zinc/54/20/84/1299542084.db2.gz YNLAYWHOICTEEL-YJBOKZPZSA-N 1 1 327.384 2.903 10 5 EFBEMO C[C@@]12COC[C@]1(C)C[N@H+](Cn1cc(-c3cccc([N+](=O)[O-])c3)cn1)C2 ZINC000853542641 1300157335 /nfs/dbraw/zinc/15/73/35/1300157335.db2.gz FHDFUFRQQPPUKP-HDICACEKSA-N 1 1 342.399 2.774 10 5 EFBEMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000853965272 1300367214 /nfs/dbraw/zinc/36/72/14/1300367214.db2.gz GFBSECPHUIUIIP-CQSZACIVSA-N 1 1 339.823 2.592 10 5 EFBEMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000854513569 1300604086 /nfs/dbraw/zinc/60/40/86/1300604086.db2.gz OZXSPTJWXYZOGD-RHSMWYFYSA-N 1 1 340.383 2.679 10 5 EFBEMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860564415 1301846256 /nfs/dbraw/zinc/84/62/56/1301846256.db2.gz SDZUSHYZVDOWOP-CHWSQXEVSA-N 1 1 327.384 2.913 10 5 EFBEMO CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000861338781 1302074057 /nfs/dbraw/zinc/07/40/57/1302074057.db2.gz FDIGIGSDAATGMC-ABAIWWIYSA-N 1 1 342.779 2.514 10 5 EFBEMO CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000861338784 1302074902 /nfs/dbraw/zinc/07/49/02/1302074902.db2.gz FDIGIGSDAATGMC-XHDPSFHLSA-N 1 1 342.779 2.514 10 5 EFBEMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000861338783 1302075550 /nfs/dbraw/zinc/07/55/50/1302075550.db2.gz FDIGIGSDAATGMC-NHYWBVRUSA-N 1 1 342.779 2.514 10 5 EFBEMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)C1 ZINC000861347201 1302094129 /nfs/dbraw/zinc/09/41/29/1302094129.db2.gz HHOORPMJJAUPSM-HAMASDEPSA-N 1 1 348.399 2.651 10 5 EFBEMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000862020999 1302266437 /nfs/dbraw/zinc/26/64/37/1302266437.db2.gz ZKZISPGUEYAUDP-CQSZACIVSA-N 1 1 327.384 2.914 10 5 EFBEMO C/C(=C/C(=O)NC[C@H]1CCCC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000862793582 1302461356 /nfs/dbraw/zinc/46/13/56/1302461356.db2.gz QCLJDNHUPZYXCT-QKXCFHHRSA-N 1 1 331.416 2.846 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@H]4CC[C@@H](C3)S4)n2)cc1 ZINC000863295498 1302578336 /nfs/dbraw/zinc/57/83/36/1302578336.db2.gz WERUIFOCJCHJGE-CABCVRRESA-N 1 1 345.428 2.781 10 5 EFBEMO Cc1nn(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)c2ncc([N+](=O)[O-])cc12 ZINC000794653874 1302904289 /nfs/dbraw/zinc/90/42/89/1302904289.db2.gz BFAXOTMTNNPQQH-JOYOIKCWSA-N 1 1 343.309 2.878 10 5 EFBEMO Cc1nn(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)c2ncc([N+](=O)[O-])cc12 ZINC000794653874 1302904300 /nfs/dbraw/zinc/90/43/00/1302904300.db2.gz BFAXOTMTNNPQQH-JOYOIKCWSA-N 1 1 343.309 2.878 10 5 EFBEMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1c2ccccc2C[N@H+]1C ZINC000866195576 1303559271 /nfs/dbraw/zinc/55/92/71/1303559271.db2.gz XMNBNWSOBFPCKF-QGZVFWFLSA-N 1 1 340.383 2.553 10 5 EFBEMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1c2ccccc2C[N@@H+]1C ZINC000866195576 1303559276 /nfs/dbraw/zinc/55/92/76/1303559276.db2.gz XMNBNWSOBFPCKF-QGZVFWFLSA-N 1 1 340.383 2.553 10 5 EFBEMO CNC(=O)c1ccc(NC[C@@H]2c3ccccc3C[N@H+]2C)c([N+](=O)[O-])c1 ZINC000866195554 1303560050 /nfs/dbraw/zinc/56/00/50/1303560050.db2.gz XFFUMUFRCHHNPW-QGZVFWFLSA-N 1 1 340.383 2.553 10 5 EFBEMO CNC(=O)c1ccc(NC[C@@H]2c3ccccc3C[N@@H+]2C)c([N+](=O)[O-])c1 ZINC000866195554 1303560056 /nfs/dbraw/zinc/56/00/56/1303560056.db2.gz XFFUMUFRCHHNPW-QGZVFWFLSA-N 1 1 340.383 2.553 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3ccc([N+](=O)[O-])cc3Br)CC[C@H]21 ZINC000866207076 1303563334 /nfs/dbraw/zinc/56/33/34/1303563334.db2.gz UZKRXVWGBGYNRP-GXFFZTMASA-N 1 1 340.221 2.888 10 5 EFBEMO COc1cc(N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c(Cl)cc1[N+](=O)[O-] 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EFBEMO Cc1cc(C)c(C(=O)NC/C=C\C[NH2+]Cc2csc([N+](=O)[O-])c2)[nH]1 ZINC001321120000 1329345409 /nfs/dbraw/zinc/34/54/09/1329345409.db2.gz DCCOCMASJRKGIS-ARJAWSKDSA-N 1 1 348.428 2.677 10 5 EFBEMO CCC(C)(CC)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21 ZINC001317214453 1327757835 /nfs/dbraw/zinc/75/78/35/1327757835.db2.gz ULHLDDPYAFTNPJ-FVQHAEBGSA-N 1 1 345.443 2.968 10 5 EFBEMO CCC[N@H+](CCNC(=O)c1oncc1C)Cc1ccccc1[N+](=O)[O-] ZINC001317544055 1328127677 /nfs/dbraw/zinc/12/76/77/1328127677.db2.gz GKJUZIKHCYAERX-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1oncc1C)Cc1ccccc1[N+](=O)[O-] ZINC001317544055 1328127684 /nfs/dbraw/zinc/12/76/84/1328127684.db2.gz GKJUZIKHCYAERX-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO O=C(NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)C(C1CC1)C1CC1 ZINC001323592808 1329553471 /nfs/dbraw/zinc/55/34/71/1329553471.db2.gz WMESMACRJGAOQT-UHFFFAOYSA-N 1 1 349.456 2.831 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CNC(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 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WIJOKLODYSENEC-UHFFFAOYSA-N 1 1 344.371 2.917 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(NC[C@@H]2CCCC[N@H+]2C)cc1C ZINC001559296172 1415238170 /nfs/dbraw/zinc/23/81/70/1415238170.db2.gz FDHYDHIDHIHZME-ZDUSSCGKSA-N 1 1 335.404 2.976 10 5 EFBEMO CC[N@H+]1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC001559656259 1415252859 /nfs/dbraw/zinc/25/28/59/1415252859.db2.gz MCGZGDPOZVVMBS-LLVKDONJSA-N 1 1 342.237 2.883 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+](CC[S@](=O)C(F)(F)F)C2CC2)cc1 ZINC001559712961 1415253720 /nfs/dbraw/zinc/25/37/20/1415253720.db2.gz BOZCLJNYLCKMCL-QFIPXVFZSA-N 1 1 336.335 2.828 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+](CC[S@](=O)C(F)(F)F)C2CC2)cc1 ZINC001559712961 1415253722 /nfs/dbraw/zinc/25/37/22/1415253722.db2.gz BOZCLJNYLCKMCL-QFIPXVFZSA-N 1 1 336.335 2.828 10 5 EFBEMO Cc1nccnc1[C@@H](C)[NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC001560124250 1415264309 /nfs/dbraw/zinc/26/43/09/1415264309.db2.gz RFTLONQUAZZTBW-CHWSQXEVSA-N 1 1 343.387 2.679 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(F)cc2C)C[C@@H]1C ZINC001565956287 1415267774 /nfs/dbraw/zinc/26/77/74/1415267774.db2.gz SAOIUHJMDBPHHN-STQMWFEESA-N 1 1 337.395 2.987 10 5 EFBEMO CC[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001560230989 1415269233 /nfs/dbraw/zinc/26/92/33/1415269233.db2.gz KNNDNXFBVMDOBH-GFCCVEGCSA-N 1 1 349.460 2.895 10 5 EFBEMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001560230989 1415269234 /nfs/dbraw/zinc/26/92/34/1415269234.db2.gz KNNDNXFBVMDOBH-GFCCVEGCSA-N 1 1 349.460 2.895 10 5 EFBEMO COc1ccc(CN2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)cc1[N+](=O)[O-] ZINC001560238077 1415269935 /nfs/dbraw/zinc/26/99/35/1415269935.db2.gz IMKZMRPRVXWRMK-KDURUIRLSA-N 1 1 345.443 2.911 10 5 EFBEMO C[C@@H]1C[C@@H](NC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC001566383999 1415544300 /nfs/dbraw/zinc/54/43/00/1415544300.db2.gz FMBAEGMHLFUPHJ-ZYHUDNBSSA-N 1 1 337.807 2.532 10 5 EFBEMO C[N@@H+](CCCNC(=O)[C@H]1C[C@H]2C[C@H]2C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001566483661 1415576126 /nfs/dbraw/zinc/57/61/26/1415576126.db2.gz JBACQPIUOPQFDD-ZSHCYNCHSA-N 1 1 331.416 2.579 10 5 EFBEMO Cc1cc(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)oc1C ZINC001567277269 1416052939 /nfs/dbraw/zinc/05/29/39/1416052939.db2.gz UQLVGBWUHZFOMP-UHFFFAOYSA-N 1 1 331.372 2.666 10 5 EFBEMO Cc1cc(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)oc1C ZINC001567277269 1416052945 /nfs/dbraw/zinc/05/29/45/1416052945.db2.gz UQLVGBWUHZFOMP-UHFFFAOYSA-N 1 1 331.372 2.666 10 5 EFBEMO CC[N@@H+](CCNC(=O)Cc1ccsc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001567325173 1416072841 /nfs/dbraw/zinc/07/28/41/1416072841.db2.gz QISRQMUBZXHWNI-UHFFFAOYSA-N 1 1 347.440 2.837 10 5 EFBEMO CC[N@@H+](CCNC(=O)/C=C\c1ccco1)Cc1ccc([N+](=O)[O-])cc1 ZINC001567325314 1416072927 /nfs/dbraw/zinc/07/29/27/1416072927.db2.gz WCIONYUJOCOWEK-KTKRTIGZSA-N 1 1 343.383 2.839 10 5 EFBEMO CC[N@@H+](CCNC(=O)C(C)(C)C(F)F)Cc1cccc([N+](=O)[O-])c1 ZINC001567347439 1416084237 /nfs/dbraw/zinc/08/42/37/1416084237.db2.gz CTKNXALPFAONTG-UHFFFAOYSA-N 1 1 343.374 2.824 10 5 EFBEMO CCC[N@@H+](CCNC(=O)C1=COCCC1)Cc1cccc([N+](=O)[O-])c1 ZINC001567422841 1416131067 /nfs/dbraw/zinc/13/10/67/1416131067.db2.gz BYPRZJWKZUYKQJ-UHFFFAOYSA-N 1 1 347.415 2.617 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1cc(C)on1)Cc1cccc([N+](=O)[O-])c1 ZINC001567421794 1416131430 /nfs/dbraw/zinc/13/14/30/1416131430.db2.gz DMECDMNDWOAXFW-UHFFFAOYSA-N 1 1 346.387 2.533 10 5 EFBEMO Cc1cccc(C)c1C[N@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(C)C ZINC001567641713 1416224644 /nfs/dbraw/zinc/22/46/44/1416224644.db2.gz PSUMDHIXZCSEHT-SJLPKXTDSA-N 1 1 347.459 2.685 10 5 EFBEMO Cc1cccc(C)c1C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])C(C)C ZINC001567641713 1416224645 /nfs/dbraw/zinc/22/46/45/1416224645.db2.gz PSUMDHIXZCSEHT-SJLPKXTDSA-N 1 1 347.459 2.685 10 5 EFBEMO Cc1cccc(C)c1C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])C(C)C ZINC001567641713 1416224648 /nfs/dbraw/zinc/22/46/48/1416224648.db2.gz PSUMDHIXZCSEHT-SJLPKXTDSA-N 1 1 347.459 2.685 10 5 EFBEMO CC(F)(F)CCC(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001692315191 1417275282 /nfs/dbraw/zinc/27/52/82/1417275282.db2.gz MIKOHXDKBSREJM-UHFFFAOYSA-N 1 1 341.358 2.578 10 5 EFBEMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CCC2=CCCCC2)CC1 ZINC001699861716 1417483418 /nfs/dbraw/zinc/48/34/18/1417483418.db2.gz PIBGIYCXEUJRAB-IAGOWNOFSA-N 1 1 349.475 2.760 10 5 EFBEMO C[N@@H+](CCCNC(=O)C1(C2CC2)CC1)Cc1cccc([N+](=O)[O-])c1 ZINC001712953678 1418292137 /nfs/dbraw/zinc/29/21/37/1418292137.db2.gz YOVRERZSIQMECU-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO C[N@H+](CCNC(=O)c1cccc(F)c1F)Cc1ccccc1[N+](=O)[O-] ZINC001713464882 1418546474 /nfs/dbraw/zinc/54/64/74/1418546474.db2.gz VTVOWPOKBBQXCT-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO C[N@@H+](CCNC(=O)c1cccc(F)c1F)Cc1ccccc1[N+](=O)[O-] ZINC001713464882 1418546477 /nfs/dbraw/zinc/54/64/77/1418546477.db2.gz VTVOWPOKBBQXCT-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO CCCC(C)(C)C(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001714971525 1418643378 /nfs/dbraw/zinc/64/33/78/1418643378.db2.gz HFHPVQOOOBWQKR-UHFFFAOYSA-N 1 1 333.432 2.969 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)C=C1CCC1 ZINC001717206972 1419266676 /nfs/dbraw/zinc/26/66/76/1419266676.db2.gz PSMFZOZZFHMLOA-UHFFFAOYSA-N 1 1 331.416 2.985 10 5 EFBEMO CCC(=O)NC1(C2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC001718000809 1419650455 /nfs/dbraw/zinc/65/04/55/1419650455.db2.gz DUHBIZYYGYXQIQ-UHFFFAOYSA-N 1 1 337.445 2.927 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1cscn1 ZINC001724847854 1425066316 /nfs/dbraw/zinc/06/63/16/1425066316.db2.gz LKTKOJOQYGOUCM-UHFFFAOYSA-N 1 1 348.428 2.645 10 5 EFBEMO Cc1nn(C[N@H+]2CC[C@]3(O)CCCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc12 ZINC000121264632 715210548 /nfs/dbraw/zinc/21/05/48/715210548.db2.gz TVHBTKJNGMJBOH-RDTXWAMCSA-N 1 1 344.415 2.837 10 5 EFBEMO CC[C@H](NC(=O)N(C)[C@H]1CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000893449128 715519535 /nfs/dbraw/zinc/51/95/35/715519535.db2.gz FMWXASHASQZIMG-HOTGVXAUSA-N 1 1 334.420 2.782 10 5 EFBEMO COC(=O)/C=C\c1ccc(NC[C@H](C)[N@@H+](C)C2CC2)c([N+](=O)[O-])c1 ZINC000255650873 717341897 /nfs/dbraw/zinc/34/18/97/717341897.db2.gz LYJYPULTBLCVDZ-LRAPTIAOSA-N 1 1 333.388 2.676 10 5 EFBEMO COC(=O)[C@@H]1[C@@H](C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)C1(F)F ZINC000893946354 720178453 /nfs/dbraw/zinc/17/84/53/720178453.db2.gz ZKZRIZACGDBQKM-KGLIPLIRSA-N 1 1 340.326 2.614 10 5 EFBEMO COC(=O)[C@@H]1[C@@H](C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)C1(F)F ZINC000893946354 720178457 /nfs/dbraw/zinc/17/84/57/720178457.db2.gz ZKZRIZACGDBQKM-KGLIPLIRSA-N 1 1 340.326 2.614 10 5 EFBEMO CCC[N@H+]1CC[C@H](CNc2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])C1 ZINC000053583382 720854637 /nfs/dbraw/zinc/85/46/37/720854637.db2.gz YBJIUTRWFRVDBQ-KEDPEKRHSA-N 1 1 347.415 2.925 10 5 EFBEMO O=C(N(Cc1ccccc1[N+](=O)[O-])C1CC1)[C@@]12CC[N@@H+](C1)CCC2 ZINC000897139206 724049217 /nfs/dbraw/zinc/04/92/17/724049217.db2.gz IRPMVPKODCAQHT-SFHVURJKSA-N 1 1 329.400 2.572 10 5 EFBEMO COCc1ncc2c(n1)CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000895415143 724124281 /nfs/dbraw/zinc/12/42/81/724124281.db2.gz LOQPSDZDKONNCK-GQCTYLIASA-N 1 1 340.383 2.603 10 5 EFBEMO CC(=O)c1ccc([N+](=O)[O-])cc1N[C@H]1CCC[N@@H+]2CCSC[C@@H]12 ZINC000895570961 724198661 /nfs/dbraw/zinc/19/86/61/724198661.db2.gz XSQICZMYIDHWOE-HOCLYGCPSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1ccc([N+](=O)[O-])cc1N[C@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000895570961 724198663 /nfs/dbraw/zinc/19/86/63/724198663.db2.gz XSQICZMYIDHWOE-HOCLYGCPSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1cc(N[C@@H]2CCC[N@@H+]3CCSC[C@@H]23)ccc1[N+](=O)[O-] ZINC000895566982 724203831 /nfs/dbraw/zinc/20/38/31/724203831.db2.gz DPTVFZMKBACIKD-ZBFHGGJFSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1cc(N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)ccc1[N+](=O)[O-] ZINC000895566982 724203835 /nfs/dbraw/zinc/20/38/35/724203835.db2.gz DPTVFZMKBACIKD-ZBFHGGJFSA-N 1 1 335.429 2.789 10 5 EFBEMO Cn1cc(C[N@H+]2C[C@@H]3CSC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000895779193 724311425 /nfs/dbraw/zinc/31/14/25/724311425.db2.gz NFKSLLMSPSIGJB-GASCZTMLSA-N 1 1 344.440 2.790 10 5 EFBEMO COC(=O)N[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000895850725 724350899 /nfs/dbraw/zinc/35/08/99/724350899.db2.gz NPPWUDMNOXPWCH-ZDUSSCGKSA-N 1 1 345.355 2.785 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000913760139 725851158 /nfs/dbraw/zinc/85/11/58/725851158.db2.gz HGXJLPBISZDJMM-BXKDBHETSA-N 1 1 341.770 2.554 10 5 EFBEMO COC(=O)/C=C/c1ccc(NC[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000915211481 726898797 /nfs/dbraw/zinc/89/87/97/726898797.db2.gz UAIHRPCERBSHSE-UFZAZABTSA-N 1 1 345.399 2.677 10 5 EFBEMO COC(=O)/C=C\c1ccc(NCCC[N@@H+](C)C(C)C)c([N+](=O)[O-])c1 ZINC000915211859 726899110 /nfs/dbraw/zinc/89/91/10/726899110.db2.gz IBPRMKMNVPUDCX-CLFYSBASSA-N 1 1 335.404 2.923 10 5 EFBEMO CC(C)(C)c1ccc(NC(=O)C2C[NH+]([C@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000908077512 727094664 /nfs/dbraw/zinc/09/46/64/727094664.db2.gz VNBJGKBBVVEYRN-AWEZNQCLSA-N 1 1 347.415 2.552 10 5 EFBEMO O=C(NCc1cc([N+](=O)[O-])c(F)cc1F)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC000911471972 727543292 /nfs/dbraw/zinc/54/32/92/727543292.db2.gz AJSIURZMSBWLEF-RISCZKNCSA-N 1 1 339.342 2.506 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000912030986 727637887 /nfs/dbraw/zinc/63/78/87/727637887.db2.gz KKMHQIDKXQLBPT-INIZCTEOSA-N 1 1 349.431 2.796 10 5 EFBEMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3ccc([N+](=O)[O-])c(Cl)c3)C[C@@]2(C)C1 ZINC000913284854 727815829 /nfs/dbraw/zinc/81/58/29/727815829.db2.gz RQPLAEJQQVAXSX-IYBDPMFKSA-N 1 1 337.807 2.662 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000129590726 727934780 /nfs/dbraw/zinc/93/47/80/727934780.db2.gz GQDYKZIWHPDHOO-LLVKDONJSA-N 1 1 325.796 2.852 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000129590888 727935101 /nfs/dbraw/zinc/93/51/01/727935101.db2.gz GQDYKZIWHPDHOO-NSHDSACASA-N 1 1 325.796 2.852 10 5 EFBEMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@]4(O)CCCC[C@@H]4C3)c2c1 ZINC000164990225 728004232 /nfs/dbraw/zinc/00/42/32/728004232.db2.gz VQSMBFJLDXXYFO-RHSMWYFYSA-N 1 1 330.388 2.529 10 5 EFBEMO CC[N@H+]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)C(C)(C)C1 ZINC001646593018 1087900819 /nfs/dbraw/zinc/90/08/19/1087900819.db2.gz QYSYELNTWDBURX-XHSDSOJGSA-N 1 1 331.416 2.545 10 5 EFBEMO C[C@@H]1CN(CCOc2cccc([N+](=O)[O-])c2)CCN1c1cc[nH+]cc1 ZINC001620542776 1090607523 /nfs/dbraw/zinc/60/75/23/1090607523.db2.gz JWHWDIFCRKRHGL-OAHLLOKOSA-N 1 1 342.399 2.579 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@]2(CO)CCCC[C@@]2(CO)C1 ZINC001648523379 1092229538 /nfs/dbraw/zinc/22/95/38/1092229538.db2.gz NSEQHQVYZRAJRY-ZYSHUDEJSA-N 1 1 348.443 2.811 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2C[C@@H](Cc3ccccc3)[C@H](O)C2)c1 ZINC001648585363 1092235108 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341.411 2.694 10 5 EFBEMO CC(C)c1oncc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001267224726 1093265722 /nfs/dbraw/zinc/26/57/22/1093265722.db2.gz KELQRWJGWLRUTG-UHFFFAOYSA-N 1 1 346.387 2.568 10 5 EFBEMO CC(C)c1oncc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001267224726 1093265725 /nfs/dbraw/zinc/26/57/25/1093265725.db2.gz KELQRWJGWLRUTG-UHFFFAOYSA-N 1 1 346.387 2.568 10 5 EFBEMO C[N@@H+](CCNC(=O)C1(F)CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001267225624 1093268592 /nfs/dbraw/zinc/26/85/92/1093268592.db2.gz ZTQLZUQGNSRBEH-UHFFFAOYSA-N 1 1 337.395 2.815 10 5 EFBEMO CC[N@@H+](CCNC(=O)/C=C/c1ccc[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC001267240583 1093338161 /nfs/dbraw/zinc/33/81/61/1093338161.db2.gz QZZHBTSWQYGANC-CMDGGOBGSA-N 1 1 342.399 2.574 10 5 EFBEMO CCCCC(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc([N+](=O)[O-])cc1 ZINC001267389081 1094461040 /nfs/dbraw/zinc/46/10/40/1094461040.db2.gz KEGHSSDYTYPZOG-CALCHBBNSA-N 1 1 331.416 2.960 10 5 EFBEMO 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CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000105851829 204168931 /nfs/dbraw/zinc/16/89/31/204168931.db2.gz XGPOSFWEFQWVQD-ZDUSSCGKSA-N 1 1 328.372 2.831 10 5 EFBEMO Cc1nc(C)n(C[C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000105884783 204175676 /nfs/dbraw/zinc/17/56/76/204175676.db2.gz MRSJOYFRVVFYBV-INIZCTEOSA-N 1 1 329.404 2.715 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CCO[C@@H](C)C2)CC1 ZINC000107316782 204231795 /nfs/dbraw/zinc/23/17/95/204231795.db2.gz MZQCCVFWFIFHNF-LSDHHAIUSA-N 1 1 333.432 2.841 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(N2CCO[C@@H](C)C2)CC1 ZINC000107316782 204231800 /nfs/dbraw/zinc/23/18/00/204231800.db2.gz MZQCCVFWFIFHNF-LSDHHAIUSA-N 1 1 333.432 2.841 10 5 EFBEMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)NCc1ccco1 ZINC000111399026 204355625 /nfs/dbraw/zinc/35/56/25/204355625.db2.gz VSWQCLLKXSHWKI-JTQLQIEISA-N 1 1 337.763 2.636 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1C[N@@H+](C(C)C)C[C@H]1C ZINC000246117704 205177768 /nfs/dbraw/zinc/17/77/68/205177768.db2.gz KDOVUTCLZBRITH-UKRRQHHQSA-N 1 1 333.432 2.979 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)C[C@@H]1CCC[N@H+]1C ZINC000421711125 246075849 /nfs/dbraw/zinc/07/58/49/246075849.db2.gz NSRBGKOBIHWEEP-LBPRGKRZSA-N 1 1 325.796 2.723 10 5 EFBEMO Cc1cnc(CC[N@@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])s1 ZINC000157554975 206142769 /nfs/dbraw/zinc/14/27/69/206142769.db2.gz SIHMREWLAAHJSQ-LBPRGKRZSA-N 1 1 348.428 2.861 10 5 EFBEMO Cc1cnc(CC[N@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])s1 ZINC000157554975 206142775 /nfs/dbraw/zinc/14/27/75/206142775.db2.gz SIHMREWLAAHJSQ-LBPRGKRZSA-N 1 1 348.428 2.861 10 5 EFBEMO CC[C@H](NC(=O)N1CCC[C@H]2C[N@@H+](C)C[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000425693459 247168967 /nfs/dbraw/zinc/16/89/67/247168967.db2.gz STDBNLRBHJHCTK-BHYGNILZSA-N 1 1 346.431 2.782 10 5 EFBEMO C[C@H]1[C@@H](CO)CC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000426006142 247224839 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BHTBDKJAFVGKJN-BETUJISGSA-N 1 1 335.404 2.596 10 5 EFBEMO COc1cc(C[N@@H+]2CCC[C@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000444739598 250338894 /nfs/dbraw/zinc/33/88/94/250338894.db2.gz VCORMAJQIWBKQT-SMDDNHRTSA-N 1 1 348.321 2.739 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000444739598 250338898 /nfs/dbraw/zinc/33/88/98/250338898.db2.gz VCORMAJQIWBKQT-SMDDNHRTSA-N 1 1 348.321 2.739 10 5 EFBEMO Cc1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)cc1[N+](=O)[O-] ZINC000174967769 207077671 /nfs/dbraw/zinc/07/76/71/207077671.db2.gz FIXYVEVPUHBLOE-CVEARBPZSA-N 1 1 331.416 2.991 10 5 EFBEMO C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000449676091 251113786 /nfs/dbraw/zinc/11/37/86/251113786.db2.gz FBUAAJAQOURHEB-GUYCJALGSA-N 1 1 346.383 2.827 10 5 EFBEMO C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000449676598 251113980 /nfs/dbraw/zinc/11/39/80/251113980.db2.gz IJLPYZUWBSHBMR-GUYCJALGSA-N 1 1 346.383 2.827 10 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CC[N@H+]1CCC[C@H]1CN(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000177024258 207283726 /nfs/dbraw/zinc/28/37/26/207283726.db2.gz CBBWTCXJHPMQQZ-AWEZNQCLSA-N 1 1 339.823 2.733 10 5 EFBEMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000177095691 207293326 /nfs/dbraw/zinc/29/33/26/207293326.db2.gz FCPDZUCRTGGTDG-CMPLNLGQSA-N 1 1 338.795 2.949 10 5 EFBEMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000177095676 207293758 /nfs/dbraw/zinc/29/37/58/207293758.db2.gz FCPDZUCRTGGTDG-ZYHUDNBSSA-N 1 1 338.795 2.949 10 5 EFBEMO CN(C(=O)c1ccc([N+](=O)[O-])o1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000268556265 252020362 /nfs/dbraw/zinc/02/03/62/252020362.db2.gz NOAJHASXMOXPJH-CQSZACIVSA-N 1 1 329.356 2.534 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@H]1CCCO1 ZINC000245383355 141383268 /nfs/dbraw/zinc/38/32/68/141383268.db2.gz OXEOIULBVYCFPY-BXUZGUMPSA-N 1 1 332.360 2.817 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@H]1CCCO1 ZINC000245383355 141383269 /nfs/dbraw/zinc/38/32/69/141383269.db2.gz OXEOIULBVYCFPY-BXUZGUMPSA-N 1 1 332.360 2.817 10 5 EFBEMO CC[N@H+]1C[C@@H](C)N(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H]1C ZINC000345942982 142121793 /nfs/dbraw/zinc/12/17/93/142121793.db2.gz FKJYJXDCHYRNOF-NWDGAFQWSA-N 1 1 330.388 2.631 10 5 EFBEMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@@H](c2nc(C3CC3)no2)C1 ZINC000346235493 142173217 /nfs/dbraw/zinc/17/32/17/142173217.db2.gz LGVBOOBVCWACED-LLVKDONJSA-N 1 1 332.335 2.984 10 5 EFBEMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](c2nc(C3CC3)no2)C1 ZINC000346235493 142173218 /nfs/dbraw/zinc/17/32/18/142173218.db2.gz LGVBOOBVCWACED-LLVKDONJSA-N 1 1 332.335 2.984 10 5 EFBEMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@H](c2nc(C3CC3)no2)C1 ZINC000346235503 142173230 /nfs/dbraw/zinc/17/32/30/142173230.db2.gz LGVBOOBVCWACED-NSHDSACASA-N 1 1 332.335 2.984 10 5 EFBEMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](c2nc(C3CC3)no2)C1 ZINC000346235503 142173231 /nfs/dbraw/zinc/17/32/31/142173231.db2.gz LGVBOOBVCWACED-NSHDSACASA-N 1 1 332.335 2.984 10 5 EFBEMO CCc1cc(CCC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)on1 ZINC000347733188 142264128 /nfs/dbraw/zinc/26/41/28/142264128.db2.gz OLWNFCMWZMTVHQ-UHFFFAOYSA-N 1 1 344.415 2.900 10 5 EFBEMO C[C@@H]1CC[C@]2(CC[N@@H+](C[C@H](O)COc3ccccc3[N+](=O)[O-])C2)C1 ZINC000343763556 145289024 /nfs/dbraw/zinc/28/90/24/145289024.db2.gz VWSFRCBBZWQROA-VKJFTORMSA-N 1 1 334.416 2.847 10 5 EFBEMO CN(C(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F)[C@H]1CCC[N@@H+](C)C1 ZINC000349128891 146057436 /nfs/dbraw/zinc/05/74/36/146057436.db2.gz LKJYZCCMIKDBSR-JTQLQIEISA-N 1 1 345.321 2.780 10 5 EFBEMO COC(=O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000351604320 146157573 /nfs/dbraw/zinc/15/75/73/146157573.db2.gz UKQWBVFAZKRCSN-LBPRGKRZSA-N 1 1 330.340 2.850 10 5 EFBEMO COc1c(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000355803169 147068930 /nfs/dbraw/zinc/06/89/30/147068930.db2.gz RCHBTDOIOHZVDK-BETUJISGSA-N 1 1 335.404 2.596 10 5 EFBEMO CC[C@@H]1C[C@@H](C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)CCO1 ZINC000357000896 147396690 /nfs/dbraw/zinc/39/66/90/147396690.db2.gz WTCQAXHDOUIIGA-SQWLQELKSA-N 1 1 334.420 2.681 10 5 EFBEMO CCC[N@@H+](CC)CCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000359356441 148064480 /nfs/dbraw/zinc/06/44/80/148064480.db2.gz AKSIEGVHXOIXRA-UHFFFAOYSA-N 1 1 345.346 2.658 10 5 EFBEMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000359454736 148089230 /nfs/dbraw/zinc/08/92/30/148089230.db2.gz DREVQZBTOYXKQK-INIZCTEOSA-N 1 1 333.432 2.860 10 5 EFBEMO C[C@@H]1CC[C@]2(CC[N@@H+](C[C@@H](O)COc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000359540596 148115617 /nfs/dbraw/zinc/11/56/17/148115617.db2.gz CNRODHMHJWPBLD-KYJSFNMBSA-N 1 1 334.416 2.847 10 5 EFBEMO Cc1c(CNC(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000359545296 148117604 /nfs/dbraw/zinc/11/76/04/148117604.db2.gz RWWPAOYXOTXHMF-DOMZBBRYSA-N 1 1 334.420 2.527 10 5 EFBEMO C[C@@H]1CC[C@@]2(CC[N@@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C2)C1 ZINC000359555927 148121104 /nfs/dbraw/zinc/12/11/04/148121104.db2.gz LFMJNSMLRVYNEI-AUUYWEPGSA-N 1 1 343.427 2.996 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000360341982 148335474 /nfs/dbraw/zinc/33/54/74/148335474.db2.gz HNUCXUIARDBWEN-INIZCTEOSA-N 1 1 327.384 2.933 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C(C)C)[C@H]1CCOC1 ZINC000361402470 148620902 /nfs/dbraw/zinc/62/09/02/148620902.db2.gz JEBYCUVVTHATAN-HNNXBMFYSA-N 1 1 335.404 2.731 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000364364434 149137051 /nfs/dbraw/zinc/13/70/51/149137051.db2.gz UBUYIYBHASQBCR-UHFFFAOYSA-N 1 1 328.372 2.506 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)C1CC1 ZINC000368102142 150036597 /nfs/dbraw/zinc/03/65/97/150036597.db2.gz MOTOWCXAODOPED-GDBMZVCRSA-N 1 1 326.400 2.786 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@H]1CCc2[nH]cnc2C1)C1CC1 ZINC000368102143 150037175 /nfs/dbraw/zinc/03/71/75/150037175.db2.gz MOTOWCXAODOPED-GOEBONIOSA-N 1 1 326.400 2.786 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H](Cc3ccncc3)C2)c1 ZINC000368151208 150051361 /nfs/dbraw/zinc/05/13/61/150051361.db2.gz ZHHFHCKZOPOUJL-CRAIPNDOSA-N 1 1 327.384 2.588 10 5 EFBEMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000368259909 150079853 /nfs/dbraw/zinc/07/98/53/150079853.db2.gz HCUOYHJWEFHYPB-SFHVURJKSA-N 1 1 330.359 2.870 10 5 EFBEMO Cn1cc(C[N@@H+]2CCO[C@H](C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000368879322 150228381 /nfs/dbraw/zinc/22/83/81/150228381.db2.gz HIDAZJZNUIXBCY-KRWDZBQOSA-N 1 1 342.399 2.606 10 5 EFBEMO Cn1cc(C[N@H+]2CCO[C@H](C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000368879322 150228383 /nfs/dbraw/zinc/22/83/83/150228383.db2.gz HIDAZJZNUIXBCY-KRWDZBQOSA-N 1 1 342.399 2.606 10 5 EFBEMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000369527363 150377325 /nfs/dbraw/zinc/37/73/25/150377325.db2.gz KXWFUBVOWAERSI-KRWDZBQOSA-N 1 1 334.322 2.967 10 5 EFBEMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000369527363 150377327 /nfs/dbraw/zinc/37/73/27/150377327.db2.gz KXWFUBVOWAERSI-KRWDZBQOSA-N 1 1 334.322 2.967 10 5 EFBEMO COc1cc(C[N@H+](C[C@@H](C)OC)C(C)C)c([N+](=O)[O-])cc1OC ZINC000353825567 286217697 /nfs/dbraw/zinc/21/76/97/286217697.db2.gz YKGRDHLRUWYQFN-GFCCVEGCSA-N 1 1 326.393 2.857 10 5 EFBEMO Cc1c(CC(=O)N2CCC(c3cnc[nH]3)CC2)cccc1[N+](=O)[O-] ZINC000372469397 151012287 /nfs/dbraw/zinc/01/22/87/151012287.db2.gz WQMRXMMEKKJGSP-UHFFFAOYSA-N 1 1 328.372 2.575 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000123405798 222272469 /nfs/dbraw/zinc/27/24/69/222272469.db2.gz LLUWTZKVZUUEOK-CQSZACIVSA-N 1 1 337.420 2.528 10 5 EFBEMO C[N@H+]1CCC[C@H]1CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113328517 544569781 /nfs/dbraw/zinc/56/97/81/544569781.db2.gz URCVKZSPPNVHDN-HNNXBMFYSA-N 1 1 332.429 2.902 10 5 EFBEMO CN1CCC[C@H]1C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113328517 544569786 /nfs/dbraw/zinc/56/97/86/544569786.db2.gz URCVKZSPPNVHDN-HNNXBMFYSA-N 1 1 332.429 2.902 10 5 EFBEMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc([N+](=O)[O-])cnc2C)c1 ZINC000194128943 265364327 /nfs/dbraw/zinc/36/43/27/265364327.db2.gz JSRJUQJFVCIIGE-UHFFFAOYSA-N 1 1 342.399 2.680 10 5 EFBEMO C[C@H](Nc1ccc2c(c1)C[N@H+](C)C2)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000194519255 265375231 /nfs/dbraw/zinc/37/52/31/265375231.db2.gz ZXBJWXOKJLPMSO-LBPRGKRZSA-N 1 1 340.383 2.979 10 5 EFBEMO C[C@@H]1C[N@H+](CCCNc2ncc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000265578297 265484031 /nfs/dbraw/zinc/48/40/31/265484031.db2.gz WDBXMFRCHBLJII-PHIMTYICSA-N 1 1 328.800 2.554 10 5 EFBEMO CC(C)c1nnc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000271685652 266041647 /nfs/dbraw/zinc/04/16/47/266041647.db2.gz DHYSYXJFCLMTGK-SNVBAGLBSA-N 1 1 349.416 2.859 10 5 EFBEMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000276511354 267003256 /nfs/dbraw/zinc/00/32/56/267003256.db2.gz BGUVILNTNVDTOD-GFCCVEGCSA-N 1 1 339.823 2.970 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000277908993 267296486 /nfs/dbraw/zinc/29/64/86/267296486.db2.gz DGODJGZNCDOAOK-LLVKDONJSA-N 1 1 337.807 2.771 10 5 EFBEMO COC(=O)[C@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000271094114 273096598 /nfs/dbraw/zinc/09/65/98/273096598.db2.gz LYEZFGWFTQRPRR-LBPRGKRZSA-N 1 1 347.396 2.713 10 5 EFBEMO COC(=O)[C@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000271094114 273096599 /nfs/dbraw/zinc/09/65/99/273096599.db2.gz LYEZFGWFTQRPRR-LBPRGKRZSA-N 1 1 347.396 2.713 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000271117778 273099096 /nfs/dbraw/zinc/09/90/96/273099096.db2.gz WWMYQBVGPLHLNL-CYBMUJFWSA-N 1 1 330.340 2.850 10 5 EFBEMO O=C1C[C@@]2(CC[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)CN1 ZINC000279467436 273218505 /nfs/dbraw/zinc/21/85/05/273218505.db2.gz RVFUWMXFNNISCY-SFHVURJKSA-N 1 1 341.367 2.567 10 5 EFBEMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)COCc1ccccc1 ZINC000285453577 274002390 /nfs/dbraw/zinc/00/23/90/274002390.db2.gz YRNIJRZBRKAWIH-GOSISDBHSA-N 1 1 344.411 2.647 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000286124004 274138363 /nfs/dbraw/zinc/13/83/63/274138363.db2.gz MOLZRCIRPZGOKR-NSHDSACASA-N 1 1 331.376 2.530 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286232345 274158508 /nfs/dbraw/zinc/15/85/08/274158508.db2.gz CTXSYHCONOLLEB-PBWFPOADSA-N 1 1 347.415 2.751 10 5 EFBEMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)C[C@H]1CCCO1 ZINC000263882777 274202542 /nfs/dbraw/zinc/20/25/42/274202542.db2.gz CHQDKOOZVVXUGV-CMPLNLGQSA-N 1 1 341.795 2.686 10 5 EFBEMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@H]1CCCO1 ZINC000263882777 274202545 /nfs/dbraw/zinc/20/25/45/274202545.db2.gz CHQDKOOZVVXUGV-CMPLNLGQSA-N 1 1 341.795 2.686 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)c2ncnc3sc([N+](=O)[O-])cc32)[C@H](C)C1 ZINC000286650102 274243418 /nfs/dbraw/zinc/24/34/18/274243418.db2.gz CGXXFMSVMXTVDX-ZYHUDNBSSA-N 1 1 335.433 2.766 10 5 EFBEMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000355789555 274384688 /nfs/dbraw/zinc/38/46/88/274384688.db2.gz XIEGERBGVNEKTO-MGPQQGTHSA-N 1 1 331.416 2.850 10 5 EFBEMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000355789548 274399491 /nfs/dbraw/zinc/39/94/91/274399491.db2.gz XIEGERBGVNEKTO-HZSPNIEDSA-N 1 1 331.416 2.850 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CC[N@H+]3CCC[C@@H]3C2)c(Br)c1 ZINC000172757285 275036630 /nfs/dbraw/zinc/03/66/30/275036630.db2.gz UUEGNHHGVIJABF-LLVKDONJSA-N 1 1 326.194 2.642 10 5 EFBEMO CC(C)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)cc1[N+](=O)[O-] ZINC000364970694 276053324 /nfs/dbraw/zinc/05/33/24/276053324.db2.gz HREVPNZWPNOFMI-JLJPHGGASA-N 1 1 331.416 2.804 10 5 EFBEMO CC(C)c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)cc1[N+](=O)[O-] ZINC000364970694 276053325 /nfs/dbraw/zinc/05/33/25/276053325.db2.gz HREVPNZWPNOFMI-JLJPHGGASA-N 1 1 331.416 2.804 10 5 EFBEMO CC[N@@H+]1CCN(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000341791009 276192434 /nfs/dbraw/zinc/19/24/34/276192434.db2.gz QGSXYCQXIZBCCH-LLVKDONJSA-N 1 1 325.796 2.723 10 5 EFBEMO CC[N@H+]1CCN(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000341791009 276192436 /nfs/dbraw/zinc/19/24/36/276192436.db2.gz QGSXYCQXIZBCCH-LLVKDONJSA-N 1 1 325.796 2.723 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H](C)C1 ZINC000193998528 276225456 /nfs/dbraw/zinc/22/54/56/276225456.db2.gz WXWPMBFHKXKPMB-DOMZBBRYSA-N 1 1 336.392 2.665 10 5 EFBEMO CC(C)(C)[N@H+]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)sc2C1 ZINC000425090768 277156175 /nfs/dbraw/zinc/15/61/75/277156175.db2.gz XQMLUNRLAHNINE-UHFFFAOYSA-N 1 1 349.416 2.788 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)Nc2ccncc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000189754869 277168021 /nfs/dbraw/zinc/16/80/21/277168021.db2.gz BXUSZYOKVMWFRR-HOCLYGCPSA-N 1 1 341.371 2.557 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000247911283 277168839 /nfs/dbraw/zinc/16/88/39/277168839.db2.gz AFPQJYFBJQNJFW-DOTOQJQBSA-N 1 1 343.358 2.909 10 5 EFBEMO NC(=O)c1ccc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)c([N+](=O)[O-])c1 ZINC000152967598 293354376 /nfs/dbraw/zinc/35/43/76/293354376.db2.gz XUHHXHDTVAGIGY-INIZCTEOSA-N 1 1 347.415 2.617 10 5 EFBEMO CCOc1ccc(C(=O)N(C)CCCn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000153716999 293390286 /nfs/dbraw/zinc/39/02/86/293390286.db2.gz DXAAVVKCWZEBMS-UHFFFAOYSA-N 1 1 346.387 2.661 10 5 EFBEMO Cc1sc(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000341038663 294071994 /nfs/dbraw/zinc/07/19/94/294071994.db2.gz MMQBUYMXTINJDJ-PHIMTYICSA-N 1 1 325.434 2.957 10 5 EFBEMO CC[C@H](NC(=O)[C@H]1CCn2c(C)[nH+]cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000290489068 294100073 /nfs/dbraw/zinc/10/00/73/294100073.db2.gz VYBPZIDMDUBFQN-YOEHRIQHSA-N 1 1 342.399 2.930 10 5 EFBEMO CC[C@@H](NC(=O)[C@H]1CCn2c(C)[nH+]cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000290489066 294100383 /nfs/dbraw/zinc/10/03/83/294100383.db2.gz VYBPZIDMDUBFQN-WMLDXEAASA-N 1 1 342.399 2.930 10 5 EFBEMO COc1ccc(NC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000291110208 294278379 /nfs/dbraw/zinc/27/83/79/294278379.db2.gz KIDVPDAVXKEQEI-INIZCTEOSA-N 1 1 339.367 2.754 10 5 EFBEMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000293932776 295081931 /nfs/dbraw/zinc/08/19/31/295081931.db2.gz YXIADFIXJIFYFQ-JTQLQIEISA-N 1 1 345.321 2.685 10 5 EFBEMO CN(C(=O)CCC(C)(C)[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000294788416 295227613 /nfs/dbraw/zinc/22/76/13/295227613.db2.gz APJUNOPPOAYOKY-MRXNPFEDSA-N 1 1 333.432 2.555 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000299609220 311102495 /nfs/dbraw/zinc/10/24/95/311102495.db2.gz IINMMQXJBVAPKQ-INIZCTEOSA-N 1 1 339.395 2.908 10 5 EFBEMO NC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCC[N@H+](C2CCCCC2)C1 ZINC000301166757 311122515 /nfs/dbraw/zinc/12/25/15/311122515.db2.gz DYHWOZCTKYMDOG-ZDUSSCGKSA-N 1 1 346.431 2.903 10 5 EFBEMO COC(=O)/C=C/c1ccc(NC[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1 ZINC000301214390 311124901 /nfs/dbraw/zinc/12/49/01/311124901.db2.gz XGMAJHFZKSLSLE-OWNNVSBGSA-N 1 1 333.388 2.535 10 5 EFBEMO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@@H+]1CCOC[C@H]1C ZINC000301411167 311136182 /nfs/dbraw/zinc/13/61/82/311136182.db2.gz YEDGVGSXKCDTCK-GHMZBOCLSA-N 1 1 345.346 2.717 10 5 EFBEMO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@H+]1CCOC[C@H]1C ZINC000301411167 311136183 /nfs/dbraw/zinc/13/61/83/311136183.db2.gz YEDGVGSXKCDTCK-GHMZBOCLSA-N 1 1 345.346 2.717 10 5 EFBEMO Cc1cc(NCc2ccc(C[NH+]3CCOCC3)cc2)ncc1[N+](=O)[O-] ZINC000301433998 311137337 /nfs/dbraw/zinc/13/73/37/311137337.db2.gz QHAUTXWFNJIVTG-UHFFFAOYSA-N 1 1 342.399 2.743 10 5 EFBEMO Cc1ccnc(NCC2(N3CCCCC3)CC[NH+](C)CC2)c1[N+](=O)[O-] ZINC000301436944 311137348 /nfs/dbraw/zinc/13/73/48/311137348.db2.gz HQCPCJHMZGEBRL-UHFFFAOYSA-N 1 1 347.463 2.660 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+](C(C)C)C2)c1 ZINC000302093759 311177326 /nfs/dbraw/zinc/17/73/26/311177326.db2.gz NBWFBWKOENSQML-CYBMUJFWSA-N 1 1 335.404 2.914 10 5 EFBEMO C[N@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])cn2)[C@H]1c1cccs1 ZINC000302169599 311182111 /nfs/dbraw/zinc/18/21/11/311182111.db2.gz TYZSWDVBPSKOGP-RISCZKNCSA-N 1 1 333.417 2.941 10 5 EFBEMO C[C@H]1C[NH+](Cc2cccc(Nc3ncc([N+](=O)[O-])cn3)c2)C[C@H](C)O1 ZINC000302174324 311182488 /nfs/dbraw/zinc/18/24/88/311182488.db2.gz WGGGSEXAOBEACH-STQMWFEESA-N 1 1 343.387 2.738 10 5 EFBEMO CC[C@@H]1CN(c2c(C)cc([N+](=O)[O-])cc2Cl)CC[N@@H+]1C[C@H](C)O ZINC000302688715 311196717 /nfs/dbraw/zinc/19/67/17/311196717.db2.gz RCGGTLPKMPCNKY-QWHCGFSZSA-N 1 1 341.839 2.838 10 5 EFBEMO CC[C@@H]1CN(c2c(C)cc([N+](=O)[O-])cc2Cl)CC[N@H+]1C[C@H](C)O ZINC000302688715 311196718 /nfs/dbraw/zinc/19/67/18/311196718.db2.gz RCGGTLPKMPCNKY-QWHCGFSZSA-N 1 1 341.839 2.838 10 5 EFBEMO Cc1sc(C(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000330663212 311327685 /nfs/dbraw/zinc/32/76/85/311327685.db2.gz STOPUYSJJWXTGO-MNOVXSKESA-N 1 1 325.434 2.815 10 5 EFBEMO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@H]([NH3+])c1ccccc1 ZINC000414826329 312054976 /nfs/dbraw/zinc/05/49/76/312054976.db2.gz FMMOPTYJCXUMDA-GUYCJALGSA-N 1 1 342.399 2.602 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000524337634 316154497 /nfs/dbraw/zinc/15/44/97/316154497.db2.gz KCYQBKSISJCDQW-OKILXGFUSA-N 1 1 334.420 2.657 10 5 EFBEMO C[N@@H+](CCNC(=O)NCc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000524590381 316161825 /nfs/dbraw/zinc/16/18/25/316161825.db2.gz GALLMDPYZLNOOA-UHFFFAOYSA-N 1 1 334.420 2.659 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(Cc2cccc(O)c2)CC1 ZINC000183315061 323328571 /nfs/dbraw/zinc/32/85/71/323328571.db2.gz KMKXYYYVKZDRJM-UHFFFAOYSA-N 1 1 341.411 2.927 10 5 EFBEMO C[C@H](C(=O)NCC[N@H+]1CCCC[C@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000185003414 323379999 /nfs/dbraw/zinc/37/99/99/323379999.db2.gz USIROKGOBDTJSC-OLZOCXBDSA-N 1 1 337.395 2.828 10 5 EFBEMO CC(C)[N@@H+]1C[C@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000161179891 473215355 /nfs/dbraw/zinc/21/53/55/473215355.db2.gz BNTVPERQSROUCE-YOEHRIQHSA-N 1 1 348.447 2.632 10 5 EFBEMO COc1cc(C(=O)NCC[N@@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000161296323 473224688 /nfs/dbraw/zinc/22/46/88/473224688.db2.gz OZXQGNIVYHWZMF-UHFFFAOYSA-N 1 1 335.404 2.598 10 5 EFBEMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CC[C@@H](CCO)C1 ZINC000124331245 473233618 /nfs/dbraw/zinc/23/36/18/473233618.db2.gz ZCFJGOJHMHKCRA-JTQLQIEISA-N 1 1 329.194 2.562 10 5 EFBEMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CC[C@@H](CCO)C1 ZINC000124331245 473233623 /nfs/dbraw/zinc/23/36/23/473233623.db2.gz ZCFJGOJHMHKCRA-JTQLQIEISA-N 1 1 329.194 2.562 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCC(C)(C)[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000124366609 473238799 /nfs/dbraw/zinc/23/87/99/473238799.db2.gz VXWJQKDAKLCXAD-KBPBESRZSA-N 1 1 349.431 2.521 10 5 EFBEMO CC[C@H]1CN(c2ccc3ncccc3c2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000112080426 473241641 /nfs/dbraw/zinc/24/16/41/473241641.db2.gz ZDBHZTWVYSGBRM-AWEZNQCLSA-N 1 1 344.415 2.690 10 5 EFBEMO CN1CC[N@@H+](C)Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc21 ZINC000095986347 473244139 /nfs/dbraw/zinc/24/41/39/473244139.db2.gz VHVBHHYZNXNJAR-UHFFFAOYSA-N 1 1 340.383 2.729 10 5 EFBEMO C[C@@H]1C[C@H](N(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000124798763 473304697 /nfs/dbraw/zinc/30/46/97/473304697.db2.gz WEGMLUOAXJLKSF-TZMCWYRMSA-N 1 1 337.445 2.628 10 5 EFBEMO C[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])o2)CCC[N@H+]1Cc1ccccc1 ZINC000162337924 473327382 /nfs/dbraw/zinc/32/73/82/473327382.db2.gz RQFZVUWDAVTPRL-SFHVURJKSA-N 1 1 343.383 2.972 10 5 EFBEMO O=C1C[C@@H]([C@H]2CCCC[N@@H+]2Cc2cc([N+](=O)[O-])ccc2Cl)CN1 ZINC000125063604 473350501 /nfs/dbraw/zinc/35/05/01/473350501.db2.gz QUIDNZWDJJRDNF-IAQYHMDHSA-N 1 1 337.807 2.739 10 5 EFBEMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000113367254 473388598 /nfs/dbraw/zinc/38/85/98/473388598.db2.gz LUEOEPHBISKJQC-ZYHUDNBSSA-N 1 1 338.795 2.949 10 5 EFBEMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000619867567 479898760 /nfs/dbraw/zinc/89/87/60/479898760.db2.gz WHUZYUIKRQPETN-LBPRGKRZSA-N 1 1 330.388 2.632 10 5 EFBEMO CCC[N@H+]1CC[C@@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000619902840 479917099 /nfs/dbraw/zinc/91/70/99/479917099.db2.gz PPRZXGRAWOFHQY-CQSZACIVSA-N 1 1 349.434 2.895 10 5 EFBEMO C[N@@H+](CCc1ccc(F)cc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000055024408 472132211 /nfs/dbraw/zinc/13/22/11/472132211.db2.gz PCXXOOJRTRPMCJ-QGZVFWFLSA-N 1 1 348.374 2.648 10 5 EFBEMO CCOc1ccc(C(=O)N2CCC[N@H+](C(C)C)CC2)cc1[N+](=O)[O-] ZINC000068800526 472247232 /nfs/dbraw/zinc/24/72/32/472247232.db2.gz GLCJNEAQZDASBZ-UHFFFAOYSA-N 1 1 335.404 2.550 10 5 EFBEMO C[N@@H+](CCNC(=O)CCOc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000068899639 472262057 /nfs/dbraw/zinc/26/20/57/472262057.db2.gz UJEDMXSHCAFNQP-UHFFFAOYSA-N 1 1 349.431 2.744 10 5 EFBEMO COc1ccc(C(=O)NCC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000068906107 472262951 /nfs/dbraw/zinc/26/29/51/472262951.db2.gz TVPFXSKRTHJTBK-UHFFFAOYSA-N 1 1 335.404 2.598 10 5 EFBEMO CC(C)COC1CC[NH+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000077395762 472520704 /nfs/dbraw/zinc/52/07/04/472520704.db2.gz QPGKRXTXDDJXLJ-UHFFFAOYSA-N 1 1 349.431 2.695 10 5 EFBEMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000155357336 472536362 /nfs/dbraw/zinc/53/63/62/472536362.db2.gz YNKCDHUIBGEHPR-UWVGGRQHSA-N 1 1 345.321 2.778 10 5 EFBEMO CC(C)[N@@H+]1C[C@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000155677124 472593558 /nfs/dbraw/zinc/59/35/58/472593558.db2.gz KSSNUYPTNQRDDY-LRDDRELGSA-N 1 1 346.431 2.628 10 5 EFBEMO C[C@@H](CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)[N@H+]1CCC[C@H](C)C1 ZINC000119883819 472596558 /nfs/dbraw/zinc/59/65/58/472596558.db2.gz DTALBEBTDQRBBH-STQMWFEESA-N 1 1 344.415 2.926 10 5 EFBEMO Cc1ccc(OC[C@H](O)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000046835972 472608426 /nfs/dbraw/zinc/60/84/26/472608426.db2.gz MMGJNXFNQVZCNC-MRXNPFEDSA-N 1 1 330.384 2.775 10 5 EFBEMO Cc1ccc(OC[C@H](O)C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000046835972 472608431 /nfs/dbraw/zinc/60/84/31/472608431.db2.gz MMGJNXFNQVZCNC-MRXNPFEDSA-N 1 1 330.384 2.775 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000120124239 472634596 /nfs/dbraw/zinc/63/45/96/472634596.db2.gz PNOVWFSWHXRHML-AWEZNQCLSA-N 1 1 332.404 2.914 10 5 EFBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000046991594 472637109 /nfs/dbraw/zinc/63/71/09/472637109.db2.gz YPTVQWICLFGSNV-CYBMUJFWSA-N 1 1 334.420 2.540 10 5 EFBEMO CCn1cnnc1[C@H]1CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000103475343 472637653 /nfs/dbraw/zinc/63/76/53/472637653.db2.gz UTYKOFQHIYULSA-LBPRGKRZSA-N 1 1 333.367 2.725 10 5 EFBEMO CCn1cnnc1[C@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000103475343 472637657 /nfs/dbraw/zinc/63/76/57/472637657.db2.gz UTYKOFQHIYULSA-LBPRGKRZSA-N 1 1 333.367 2.725 10 5 EFBEMO O=C(C[N@@H+](C[C@@H]1CCCO1)C1CCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000072716338 472705497 /nfs/dbraw/zinc/70/54/97/472705497.db2.gz ZDLBVQSBLGXSCW-HNNXBMFYSA-N 1 1 347.415 2.957 10 5 EFBEMO C[C@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000078870247 472780466 /nfs/dbraw/zinc/78/04/66/472780466.db2.gz LZMLDTKOCNKTJF-QWRGUYRKSA-N 1 1 325.796 2.803 10 5 EFBEMO C[C@@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000078870245 472780976 /nfs/dbraw/zinc/78/09/76/472780976.db2.gz LZMLDTKOCNKTJF-MNOVXSKESA-N 1 1 325.796 2.803 10 5 EFBEMO CCn1cc(CN2CCC[N@H+](Cc3ccccc3[N+](=O)[O-])CC2)cn1 ZINC000105870146 472792115 /nfs/dbraw/zinc/79/21/15/472792115.db2.gz YOGASCHIYVLWSS-UHFFFAOYSA-N 1 1 343.431 2.519 10 5 EFBEMO CCn1cc(CN2CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])CC2)cn1 ZINC000105870146 472792120 /nfs/dbraw/zinc/79/21/20/472792120.db2.gz YOGASCHIYVLWSS-UHFFFAOYSA-N 1 1 343.431 2.519 10 5 EFBEMO CCn1cc(C[N@@H+]2CCCN(Cc3ccccc3[N+](=O)[O-])CC2)cn1 ZINC000105870146 472792127 /nfs/dbraw/zinc/79/21/27/472792127.db2.gz YOGASCHIYVLWSS-UHFFFAOYSA-N 1 1 343.431 2.519 10 5 EFBEMO CCn1cc(C[N@H+]2CCCN(Cc3ccccc3[N+](=O)[O-])CC2)cn1 ZINC000105870146 472792132 /nfs/dbraw/zinc/79/21/32/472792132.db2.gz YOGASCHIYVLWSS-UHFFFAOYSA-N 1 1 343.431 2.519 10 5 EFBEMO Cc1cnn([C@H]2CCC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000106221235 472833729 /nfs/dbraw/zinc/83/37/29/472833729.db2.gz SBMMNMALNSSZRJ-INIZCTEOSA-N 1 1 330.388 2.816 10 5 EFBEMO Cc1cnn([C@@H]2CCC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000106221232 472834649 /nfs/dbraw/zinc/83/46/49/472834649.db2.gz SBMMNMALNSSZRJ-MRXNPFEDSA-N 1 1 330.388 2.816 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C[C@@H]1CCCCO1 ZINC000121841299 472928179 /nfs/dbraw/zinc/92/81/79/472928179.db2.gz FOMZRPVFUXFQFC-HNNXBMFYSA-N 1 1 335.404 2.733 10 5 EFBEMO Cc1cc(C(=O)N2CCC(Cc3[nH+]ccn3C)CC2)ccc1[N+](=O)[O-] ZINC000122024565 472965121 /nfs/dbraw/zinc/96/51/21/472965121.db2.gz ZXUKEFJBDDZZGT-UHFFFAOYSA-N 1 1 342.399 2.732 10 5 EFBEMO Cc1cc(N2CCC(N(C)c3ccc([N+](=O)[O-])cn3)CC2)nc(C)[nH+]1 ZINC000065621456 472994050 /nfs/dbraw/zinc/99/40/50/472994050.db2.gz YLUBFDVDZOXBAZ-UHFFFAOYSA-N 1 1 342.403 2.502 10 5 EFBEMO C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000159588282 473041489 /nfs/dbraw/zinc/04/14/89/473041489.db2.gz SZUMGPORBXPOFH-OLZOCXBDSA-N 1 1 343.383 2.941 10 5 EFBEMO O=C1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCN1 ZINC000093101526 473042888 /nfs/dbraw/zinc/04/28/88/473042888.db2.gz SFKJFNMKMWKNDE-UHFFFAOYSA-N 1 1 331.397 2.645 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCN(c2cccnn2)CC1 ZINC000093150026 473052649 /nfs/dbraw/zinc/05/26/49/473052649.db2.gz NFUDLLMOLAGTNZ-QPJJXVBHSA-N 1 1 339.399 2.610 10 5 EFBEMO Cc1ccc(N2CCN(C[C@H]3CCCC[N@@H+]3C)CC2)c([N+](=O)[O-])c1 ZINC000080635274 473060758 /nfs/dbraw/zinc/06/07/58/473060758.db2.gz VAJGDCJZNFRZKR-MRXNPFEDSA-N 1 1 332.448 2.510 10 5 EFBEMO CC(C)[N@@H+](CCc1nccs1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000159825641 473065032 /nfs/dbraw/zinc/06/50/32/473065032.db2.gz LIIBRYMDBJZDDH-UHFFFAOYSA-N 1 1 348.428 2.603 10 5 EFBEMO C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123118466 473099377 /nfs/dbraw/zinc/09/93/77/473099377.db2.gz FTSYRLGCEOWADK-DOMZBBRYSA-N 1 1 346.431 2.724 10 5 EFBEMO CCc1ccc(NC(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000095403811 473198252 /nfs/dbraw/zinc/19/82/52/473198252.db2.gz SDSTWVOFIPWWSY-CYBMUJFWSA-N 1 1 334.420 2.963 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H](CO)CC(C)C ZINC000185335233 473397772 /nfs/dbraw/zinc/39/77/72/473397772.db2.gz WHWQZIFLRFZNLV-HNNXBMFYSA-N 1 1 337.420 2.571 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H](Cn3cncn3)C2)c1 ZINC000172180014 473542237 /nfs/dbraw/zinc/54/22/37/473542237.db2.gz PYVGCDIGKYFYOW-GFCCVEGCSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H](Cn3cncn3)C2)c1 ZINC000172180014 473542245 /nfs/dbraw/zinc/54/22/45/473542245.db2.gz PYVGCDIGKYFYOW-GFCCVEGCSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3nncn3C3CC3)C2)cc1 ZINC000152404574 473557992 /nfs/dbraw/zinc/55/79/92/473557992.db2.gz HDVQXQLNMGYCQV-CQSZACIVSA-N 1 1 327.388 2.901 10 5 EFBEMO CC[N@H+]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000127435917 473613365 /nfs/dbraw/zinc/61/33/65/473613365.db2.gz OQIFNRNGKCMSLB-LBPRGKRZSA-N 1 1 345.321 2.828 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000153727515 473639407 /nfs/dbraw/zinc/63/94/07/473639407.db2.gz NYSBRRFAVIDYER-HUUCEWRRSA-N 1 1 332.404 2.994 10 5 EFBEMO CC[C@@H]1CN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C[C@@H](C)O ZINC000153802644 473643360 /nfs/dbraw/zinc/64/33/60/473643360.db2.gz FYXAJZKABDIOLF-TZMCWYRMSA-N 1 1 341.839 2.525 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](Cn3cncn3)C2)ccc1Cl ZINC000153884480 473646868 /nfs/dbraw/zinc/64/68/68/473646868.db2.gz WWQZEXILWABCPX-ZDUSSCGKSA-N 1 1 335.795 2.752 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](Cn3cncn3)C2)ccc1Cl ZINC000153884480 473646872 /nfs/dbraw/zinc/64/68/72/473646872.db2.gz WWQZEXILWABCPX-ZDUSSCGKSA-N 1 1 335.795 2.752 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000245436912 473699455 /nfs/dbraw/zinc/69/94/55/473699455.db2.gz VVYHOZTVBZWXTM-KGLIPLIRSA-N 1 1 332.404 2.994 10 5 EFBEMO Cn1nccc1[C@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000281479500 473734618 /nfs/dbraw/zinc/73/46/18/473734618.db2.gz SFNUTDOUYZBJEL-SJORKVTESA-N 1 1 330.388 2.589 10 5 EFBEMO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCC[N@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000281495146 473739868 /nfs/dbraw/zinc/73/98/68/473739868.db2.gz UBPZKKHIEYDGRP-QWQQUQAHSA-N 1 1 348.443 2.890 10 5 EFBEMO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCC[N@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000281495140 473740386 /nfs/dbraw/zinc/74/03/86/473740386.db2.gz UBPZKKHIEYDGRP-HWDJUHOGSA-N 1 1 348.443 2.890 10 5 EFBEMO CCN(C)C(=O)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000186818514 473763274 /nfs/dbraw/zinc/76/32/74/473763274.db2.gz XTXJBIWKGZCUJZ-GOSISDBHSA-N 1 1 327.384 2.752 10 5 EFBEMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H](c3nccs3)C2)c1 ZINC000246283048 473815257 /nfs/dbraw/zinc/81/52/57/473815257.db2.gz NWEOYSZXZJXPEG-HIFRSBDPSA-N 1 1 333.413 2.964 10 5 EFBEMO CCc1nccn1[C@@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000246363768 473840962 /nfs/dbraw/zinc/84/09/62/473840962.db2.gz XQQGMZHNAXQTKC-IAGOWNOFSA-N 1 1 344.415 2.724 10 5 EFBEMO CCc1ccc(C(=O)N(C)[C@@H]2CC[N@H+](CC)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000173464916 473846200 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1 1 332.356 2.765 10 5 EFBEMO Cc1nc(CN2CCC[N@@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)no1 ZINC000247248229 474099728 /nfs/dbraw/zinc/09/97/28/474099728.db2.gz SXKMWMYROHGJRE-CYBMUJFWSA-N 1 1 345.403 2.555 10 5 EFBEMO Cc1nc(CN2CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)no1 ZINC000247248229 474099735 /nfs/dbraw/zinc/09/97/35/474099735.db2.gz SXKMWMYROHGJRE-CYBMUJFWSA-N 1 1 345.403 2.555 10 5 EFBEMO CCOc1ccc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000247337288 474122740 /nfs/dbraw/zinc/12/27/40/474122740.db2.gz JAQVMDFJLWNPFI-JSGCOSHPSA-N 1 1 335.404 2.548 10 5 EFBEMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000265017039 474164491 /nfs/dbraw/zinc/16/44/91/474164491.db2.gz XULFHWKFMQCHCR-RISCZKNCSA-N 1 1 329.356 2.650 10 5 EFBEMO COc1ccc(OCC[N@@H+]2CCO[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000247514102 474169447 /nfs/dbraw/zinc/16/94/47/474169447.db2.gz MTPBMZNTMJQUOB-GDBMZVCRSA-N 1 1 336.388 2.626 10 5 EFBEMO COc1ccc(OCC[N@H+]2CCO[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000247514102 474169453 /nfs/dbraw/zinc/16/94/53/474169453.db2.gz MTPBMZNTMJQUOB-GDBMZVCRSA-N 1 1 336.388 2.626 10 5 EFBEMO C[N@H+]1CCC[C@H]1CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275402928 474172850 /nfs/dbraw/zinc/17/28/50/474172850.db2.gz BNGUYDRMICIJAI-AWEZNQCLSA-N 1 1 335.407 2.918 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)s2)[C@@H](C)C1 ZINC000247538093 474175253 /nfs/dbraw/zinc/17/52/53/474175253.db2.gz XVBCXFBVPKDCOD-CMPLNLGQSA-N 1 1 325.434 2.767 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@]3(O)CCCC[C@H]3C2)c2c(c1)COCO2 ZINC000247945473 474228874 /nfs/dbraw/zinc/22/88/74/474228874.db2.gz DMCSRXRTLAVSOK-YJBOKZPZSA-N 1 1 348.399 2.588 10 5 EFBEMO CSc1cccc(C(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-] ZINC000188922977 474235234 /nfs/dbraw/zinc/23/52/34/474235234.db2.gz LZNBQBRWBRGJMM-NWDGAFQWSA-N 1 1 335.429 2.625 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000275842697 474336633 /nfs/dbraw/zinc/33/66/33/474336633.db2.gz HEJDSYBVCZHPFM-CHWSQXEVSA-N 1 1 337.807 2.913 10 5 EFBEMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CC[C@H](O)CC1 ZINC000275845728 474338456 /nfs/dbraw/zinc/33/84/56/474338456.db2.gz KLMGAXHPENGXDT-KOMQPUFPSA-N 1 1 331.372 2.985 10 5 EFBEMO CC[N@H+]1CCC[C@@H](NC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000175953458 474347196 /nfs/dbraw/zinc/34/71/96/474347196.db2.gz QUHVYDULXAFACE-DZGCQCFKSA-N 1 1 334.420 2.748 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000248573644 474363456 /nfs/dbraw/zinc/36/34/56/474363456.db2.gz NYSBRRFAVIDYER-GJZGRUSLSA-N 1 1 332.404 2.994 10 5 EFBEMO CO[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC[C@@H]1C ZINC000189346361 474367771 /nfs/dbraw/zinc/36/77/71/474367771.db2.gz DPIXRZKRUUTVAJ-BLLLJJGKSA-N 1 1 335.404 2.589 10 5 EFBEMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CC[C@H](O)CC1 ZINC000275950565 474369459 /nfs/dbraw/zinc/36/94/59/474369459.db2.gz JHQCZTLLDVJYOP-AULYBMBSSA-N 1 1 330.331 2.932 10 5 EFBEMO C[C@@H](C(=O)NCC[N@H+]1CCCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000248599917 474373274 /nfs/dbraw/zinc/37/32/74/474373274.db2.gz USIROKGOBDTJSC-QWHCGFSZSA-N 1 1 337.395 2.828 10 5 EFBEMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC[N@H+]1C ZINC000265942503 474395968 /nfs/dbraw/zinc/39/59/68/474395968.db2.gz IFTFJNGYYRAHQC-YPMHNXCESA-N 1 1 331.372 2.896 10 5 EFBEMO COc1ccc(OC)c([C@H]2CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)c1 ZINC000176197316 474406638 /nfs/dbraw/zinc/40/66/38/474406638.db2.gz RNQNKSMPLRKMBQ-OAHLLOKOSA-N 1 1 346.387 2.646 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCC[N@@H+](CC)C1 ZINC000184763999 474603006 /nfs/dbraw/zinc/60/30/06/474603006.db2.gz RAMCVHHZOMEUCF-CVEARBPZSA-N 1 1 333.432 2.764 10 5 EFBEMO C[C@@H](NC(=O)NCC[N@H+]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000249684154 474603931 /nfs/dbraw/zinc/60/39/31/474603931.db2.gz CWXCNFMGEFDQFZ-UONOGXRCSA-N 1 1 334.420 2.829 10 5 EFBEMO C[C@H](CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)[N@H+]1CCC[C@@H](C)C1 ZINC000249723434 474606960 /nfs/dbraw/zinc/60/69/60/474606960.db2.gz DTALBEBTDQRBBH-CHWSQXEVSA-N 1 1 344.415 2.926 10 5 EFBEMO O=[N+]([O-])c1cnc2ccccc2c1N1CC[NH+](Cc2ccncc2)CC1 ZINC000291586619 474625167 /nfs/dbraw/zinc/62/51/67/474625167.db2.gz GYIDKQMSUNIJBK-UHFFFAOYSA-N 1 1 349.394 2.860 10 5 EFBEMO CC(C)(C)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1O ZINC000278474250 474653924 /nfs/dbraw/zinc/65/39/24/474653924.db2.gz ICGVYNZRXSSLAU-DZGCQCFKSA-N 1 1 337.376 2.732 10 5 EFBEMO CC(C)(C)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1O ZINC000278474250 474653927 /nfs/dbraw/zinc/65/39/27/474653927.db2.gz ICGVYNZRXSSLAU-DZGCQCFKSA-N 1 1 337.376 2.732 10 5 EFBEMO CC(C)(C)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H]1O ZINC000278474261 474654043 /nfs/dbraw/zinc/65/40/43/474654043.db2.gz ICGVYNZRXSSLAU-ZFWWWQNUSA-N 1 1 337.376 2.732 10 5 EFBEMO CC(C)(C)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H]1O ZINC000278474261 474654045 /nfs/dbraw/zinc/65/40/45/474654045.db2.gz ICGVYNZRXSSLAU-ZFWWWQNUSA-N 1 1 337.376 2.732 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2c2cc[nH]n2)cccc1[N+](=O)[O-] ZINC000278521871 474679443 /nfs/dbraw/zinc/67/94/43/474679443.db2.gz CQWRCOLEGKIWOX-INIZCTEOSA-N 1 1 343.387 2.792 10 5 EFBEMO CN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000340818811 474688529 /nfs/dbraw/zinc/68/85/29/474688529.db2.gz NPYXMLYLCPLESJ-KRWDZBQOSA-N 1 1 342.399 2.918 10 5 EFBEMO COc1ccc(C[N@@H+](C)[C@@H]2Cc3ccccc3[C@H]2O)cc1[N+](=O)[O-] ZINC000252512621 474690582 /nfs/dbraw/zinc/69/05/82/474690582.db2.gz TVOMOHXIRDWKOQ-SJLPKXTDSA-N 1 1 328.368 2.694 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(N3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)nc2c1 ZINC000278607585 474732916 /nfs/dbraw/zinc/73/29/16/474732916.db2.gz ZWAGQBPTSODBKT-PXAZEXFGSA-N 1 1 341.415 2.924 10 5 EFBEMO C[C@@H]1C[N@H+](CCCCNc2ncc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000267978732 474735563 /nfs/dbraw/zinc/73/55/63/474735563.db2.gz XHDASHZJRADCGZ-TXEJJXNPSA-N 1 1 342.827 2.945 10 5 EFBEMO COC(=O)c1cc(N2CCC(c3[nH]cc[nH+]3)CC2)cc(C)c1[N+](=O)[O-] ZINC000268009700 474750665 /nfs/dbraw/zinc/75/06/65/474750665.db2.gz UQWMMLQZMFBJJA-UHFFFAOYSA-N 1 1 344.371 2.797 10 5 EFBEMO C[N@H+]1CCC[C@H]1CNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291919618 474751755 /nfs/dbraw/zinc/75/17/55/474751755.db2.gz LQFJBHZWNYGJDO-VIFPVBQESA-N 1 1 332.187 2.726 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000337177410 474760019 /nfs/dbraw/zinc/76/00/19/474760019.db2.gz OWJOTBUBHCLTKU-HUUCEWRRSA-N 1 1 347.415 2.672 10 5 EFBEMO C[C@@H]1CC[C@@H](C(N)=O)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000338961857 474780716 /nfs/dbraw/zinc/78/07/16/474780716.db2.gz RJJPFARQZLEVEA-NXEZZACHSA-N 1 1 345.321 2.699 10 5 EFBEMO C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000338961857 474780723 /nfs/dbraw/zinc/78/07/23/474780723.db2.gz RJJPFARQZLEVEA-NXEZZACHSA-N 1 1 345.321 2.699 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278730593 474800957 /nfs/dbraw/zinc/80/09/57/474800957.db2.gz LDWCRXYYWJRJOY-NWDGAFQWSA-N 1 1 348.321 2.609 10 5 EFBEMO Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1CCC[N@@H+](C)[C@H]1c1ccnn1C ZINC000284908514 474822058 /nfs/dbraw/zinc/82/20/58/474822058.db2.gz OYFYARBRDVKMDN-XJKSGUPXSA-N 1 1 344.419 2.527 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC000292163553 474881435 /nfs/dbraw/zinc/88/14/35/474881435.db2.gz JIZMGLRJZBCBAG-GPZRYRNASA-N 1 1 329.400 2.552 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)C1=CC[N@@H+](C)CC1 ZINC000273446555 474902204 /nfs/dbraw/zinc/90/22/04/474902204.db2.gz AYHKHAJSWLSAJO-XTZCOPOCSA-N 1 1 329.400 2.765 10 5 EFBEMO CCCC(=O)N[C@@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000255887156 474913275 /nfs/dbraw/zinc/91/32/75/474913275.db2.gz NLBYNORJNLAKTM-MEMKZHQFSA-N 1 1 331.416 2.989 10 5 EFBEMO CCCC(=O)N[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000255887156 474913282 /nfs/dbraw/zinc/91/32/82/474913282.db2.gz NLBYNORJNLAKTM-MEMKZHQFSA-N 1 1 331.416 2.989 10 5 EFBEMO C[N@@H+]1C[C@H]2CN(C(=O)c3cccc4c(=O)c5ccccc5[nH]c34)C[C@H]2C1 ZINC000279203730 474964489 /nfs/dbraw/zinc/96/44/89/474964489.db2.gz MFWCPITWLPQPCR-OKILXGFUSA-N 1 1 347.418 2.727 10 5 EFBEMO CCNC(=O)C[C@H]1CCCC[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000285357179 474985867 /nfs/dbraw/zinc/98/58/67/474985867.db2.gz QHGVKIDBCKCUJI-LLVKDONJSA-N 1 1 341.358 2.754 10 5 EFBEMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000285357179 474985877 /nfs/dbraw/zinc/98/58/77/474985877.db2.gz QHGVKIDBCKCUJI-LLVKDONJSA-N 1 1 341.358 2.754 10 5 EFBEMO COC(=O)c1cc(NCCCn2cc[nH+]c2C)cc(C)c1[N+](=O)[O-] ZINC000268492350 475012566 /nfs/dbraw/zinc/01/25/66/475012566.db2.gz PASBPHHHWJUQAV-UHFFFAOYSA-N 1 1 332.360 2.697 10 5 EFBEMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1ccc([N+](=O)[O-])o1 ZINC000281102501 475072235 /nfs/dbraw/zinc/07/22/35/475072235.db2.gz UBVQICXGPGYAGP-UKRRQHHQSA-N 1 1 341.367 2.944 10 5 EFBEMO Cc1cc(C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)cc(C)c1O ZINC000295950446 475140382 /nfs/dbraw/zinc/14/03/82/475140382.db2.gz HKKQWYDIBMPZKC-UHFFFAOYSA-N 1 1 342.399 2.634 10 5 EFBEMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000345550620 475258711 /nfs/dbraw/zinc/25/87/11/475258711.db2.gz WWOCSWVYZOONEH-ZDUSSCGKSA-N 1 1 337.420 2.844 10 5 EFBEMO COc1cccc(N2C[C@H]([NH2+]Cc3csc([N+](=O)[O-])c3)CC2=O)c1 ZINC000337761624 475303528 /nfs/dbraw/zinc/30/35/28/475303528.db2.gz WUCJYDPKQCDYRY-GFCCVEGCSA-N 1 1 347.396 2.560 10 5 EFBEMO CCOc1ccc(C(=O)NCC[N@H+]2CCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000347416636 475310395 /nfs/dbraw/zinc/31/03/95/475310395.db2.gz CMLIMEBPJYOBDC-UHFFFAOYSA-N 1 1 349.431 2.845 10 5 EFBEMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccc(S(C)(=O)=O)c1 ZINC000296663124 475419627 /nfs/dbraw/zinc/41/96/27/475419627.db2.gz FJJRATBBZNEVQM-UHFFFAOYSA-N 1 1 348.424 2.673 10 5 EFBEMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccc(S(C)(=O)=O)c1 ZINC000296663124 475419634 /nfs/dbraw/zinc/41/96/34/475419634.db2.gz FJJRATBBZNEVQM-UHFFFAOYSA-N 1 1 348.424 2.673 10 5 EFBEMO CN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000358126314 475421824 /nfs/dbraw/zinc/42/18/24/475421824.db2.gz GMAYWVLAGDBGPQ-CQSZACIVSA-N 1 1 349.406 2.707 10 5 EFBEMO Cc1ccncc1C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000361410089 475426558 /nfs/dbraw/zinc/42/65/58/475426558.db2.gz JWVJBIFABGVPJS-UHFFFAOYSA-N 1 1 328.372 2.759 10 5 EFBEMO O=C(CC[N@H+]1CCOC[C@@H]1CC1CCC1)Nc1ccccc1[N+](=O)[O-] ZINC000339775379 475490476 /nfs/dbraw/zinc/49/04/76/475490476.db2.gz DRJPOWBEJWCLIH-HNNXBMFYSA-N 1 1 347.415 2.814 10 5 EFBEMO COc1cc(C[N@H+]2CCCCC[C@H]2CCO)c([N+](=O)[O-])cc1F ZINC000342040521 475526213 /nfs/dbraw/zinc/52/62/13/475526213.db2.gz XCAHSUAXDIXQFS-ZDUSSCGKSA-N 1 1 326.368 2.870 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000338045923 475541532 /nfs/dbraw/zinc/54/15/32/475541532.db2.gz GEJPASBZKLCOHQ-VNHYZAJKSA-N 1 1 333.432 2.999 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@](CO)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000361592036 475578705 /nfs/dbraw/zinc/57/87/05/475578705.db2.gz UYKCFROQNCSBIE-IBGZPJMESA-N 1 1 342.395 2.739 10 5 EFBEMO CC1(C)C[N@H+](C2(CNc3ccncc3[N+](=O)[O-])CCCCC2)CCO1 ZINC000343040813 475714862 /nfs/dbraw/zinc/71/48/62/475714862.db2.gz UEHVBWVKYOEJJA-UHFFFAOYSA-N 1 1 348.447 2.637 10 5 EFBEMO C[C@H](NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000297457543 475764357 /nfs/dbraw/zinc/76/43/57/475764357.db2.gz CCBXPMSVNNMFJX-WWGRRREGSA-N 1 1 334.420 2.780 10 5 EFBEMO COc1ccccc1[C@H](C)[NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000358682264 475856256 /nfs/dbraw/zinc/85/62/56/475856256.db2.gz OELPFNXSDQVOSN-NSHDSACASA-N 1 1 329.356 2.553 10 5 EFBEMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000297932954 475928299 /nfs/dbraw/zinc/92/82/99/475928299.db2.gz VDGSVBCLKAJBGF-NXEZZACHSA-N 1 1 345.321 2.778 10 5 EFBEMO COc1ccccc1[C@H](C)[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000340323732 475946733 /nfs/dbraw/zinc/94/67/33/475946733.db2.gz RJAYGXSBHOAMOV-LBPRGKRZSA-N 1 1 329.356 2.893 10 5 EFBEMO O=[N+]([O-])c1ccn(CC[NH+]2CC(c3nc4ccccc4s3)C2)n1 ZINC000358830272 475972407 /nfs/dbraw/zinc/97/24/07/475972407.db2.gz NXWFIHRUPYVMFN-UHFFFAOYSA-N 1 1 329.385 2.500 10 5 EFBEMO C[C@@]12CC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C[C@@H]1C2(F)F ZINC000298325569 476056433 /nfs/dbraw/zinc/05/64/33/476056433.db2.gz RCTUVTWBYJWPNM-DZGCQCFKSA-N 1 1 340.326 2.938 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000298403672 476081518 /nfs/dbraw/zinc/08/15/18/476081518.db2.gz WRLRCDHOCVKESF-RIEGTJTDSA-N 1 1 339.342 2.899 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000298403672 476081522 /nfs/dbraw/zinc/08/15/22/476081522.db2.gz WRLRCDHOCVKESF-RIEGTJTDSA-N 1 1 339.342 2.899 10 5 EFBEMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000358996392 476099718 /nfs/dbraw/zinc/09/97/18/476099718.db2.gz WXXRGYFZSFIODB-SNVBAGLBSA-N 1 1 345.346 2.656 10 5 EFBEMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(OCC)c([N+](=O)[O-])c2)C1 ZINC000362242490 476105377 /nfs/dbraw/zinc/10/53/77/476105377.db2.gz IDWUBRQOOIKJBM-CQSZACIVSA-N 1 1 349.431 2.797 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])cc1F ZINC000362312847 476162330 /nfs/dbraw/zinc/16/23/30/476162330.db2.gz BDCNQQHCAOAJIS-QWHCGFSZSA-N 1 1 338.379 2.991 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000357077822 476211470 /nfs/dbraw/zinc/21/14/70/476211470.db2.gz XLHSPWZZNMCNTH-RDTXWAMCSA-N 1 1 347.415 2.814 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H]4COCC[C@H]43)o2)cc1 ZINC000362447384 476257524 /nfs/dbraw/zinc/25/75/24/476257524.db2.gz KQQUOHPUKCVXDX-UKRRQHHQSA-N 1 1 344.371 2.646 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]3COCC[C@H]32)cccc1[N+](=O)[O-] ZINC000362447009 476258023 /nfs/dbraw/zinc/25/80/23/476258023.db2.gz JVEBWDFQAHYREY-RHSMWYFYSA-N 1 1 347.415 2.733 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H]4COCC[C@@H]43)o2)cc1 ZINC000362447386 476258070 /nfs/dbraw/zinc/25/80/70/476258070.db2.gz KQQUOHPUKCVXDX-ZFWWWQNUSA-N 1 1 344.371 2.646 10 5 EFBEMO CNC(=O)c1cc([N+](=O)[O-])ccc1NCC[N@@H+](C)C1CCCCC1 ZINC000357174909 476277291 /nfs/dbraw/zinc/27/72/91/476277291.db2.gz QPSYXGLDDMVSGE-UHFFFAOYSA-N 1 1 334.420 2.631 10 5 EFBEMO O=[N+]([O-])c1cnc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)s1 ZINC000369749582 476507544 /nfs/dbraw/zinc/50/75/44/476507544.db2.gz JKWUOXSEMMCHQU-LLVKDONJSA-N 1 1 333.417 2.968 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(n2c[nH+]cc2C)CC1 ZINC000369868201 476564392 /nfs/dbraw/zinc/56/43/92/476564392.db2.gz PGHYXGJSEQUOFT-UHFFFAOYSA-N 1 1 344.371 2.586 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@]3(CCOC3)C2)cccc1[N+](=O)[O-] ZINC000451905842 476715446 /nfs/dbraw/zinc/71/54/46/476715446.db2.gz SLSQBQZLMYPDAO-KSSFIOAISA-N 1 1 347.415 2.733 10 5 EFBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC2(CCOCC2)[C@@H]1C ZINC000375240010 476733796 /nfs/dbraw/zinc/73/37/96/476733796.db2.gz HFSNIROPFXUPCR-KBPBESRZSA-N 1 1 347.415 2.813 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](C(=O)OC(C)(C)C)C1 ZINC000430210221 476781572 /nfs/dbraw/zinc/78/15/72/476781572.db2.gz TWZOZLPAMAWFHH-ZDUSSCGKSA-N 1 1 336.388 2.767 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C(=O)OC(C)(C)C)C1 ZINC000430210221 476781579 /nfs/dbraw/zinc/78/15/79/476781579.db2.gz TWZOZLPAMAWFHH-ZDUSSCGKSA-N 1 1 336.388 2.767 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC(C)=C[C@H](C)C1 ZINC000430287683 476805529 /nfs/dbraw/zinc/80/55/29/476805529.db2.gz YQXKKISRGSYHPF-LBPRGKRZSA-N 1 1 333.388 2.830 10 5 EFBEMO COC[C@@H]1CCC[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000452079663 476810594 /nfs/dbraw/zinc/81/05/94/476810594.db2.gz HYRNGNSWHCVBHX-CQSZACIVSA-N 1 1 335.404 2.590 10 5 EFBEMO Cc1sc(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000456986041 476817735 /nfs/dbraw/zinc/81/77/35/476817735.db2.gz IYEGZIWNCSRFBZ-ZDUSSCGKSA-N 1 1 331.397 2.751 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)O[C@H](C)[C@@H]1C ZINC000446081657 476824475 /nfs/dbraw/zinc/82/44/75/476824475.db2.gz WESDADANFMYGLJ-MELADBBJSA-N 1 1 335.404 2.730 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c(F)c1 ZINC000375417188 476826218 /nfs/dbraw/zinc/82/62/18/476826218.db2.gz UIYVUGSBFOFAHF-GFCCVEGCSA-N 1 1 332.335 2.984 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c(F)c1 ZINC000375417188 476826228 /nfs/dbraw/zinc/82/62/28/476826228.db2.gz UIYVUGSBFOFAHF-GFCCVEGCSA-N 1 1 332.335 2.984 10 5 EFBEMO CC1(C)CCC[N@H+]1CCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000457070542 476857485 /nfs/dbraw/zinc/85/74/85/476857485.db2.gz GWHPCDFVTWYIDW-UHFFFAOYSA-N 1 1 330.388 2.680 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000446315385 476859660 /nfs/dbraw/zinc/85/96/60/476859660.db2.gz IZVYEMGTWLMREY-PWSUYJOCSA-N 1 1 325.796 2.769 10 5 EFBEMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cn2)C1 ZINC000366127249 476873728 /nfs/dbraw/zinc/87/37/28/476873728.db2.gz PAZRNAQHVBFFJN-GJZGRUSLSA-N 1 1 346.431 2.716 10 5 EFBEMO C[C@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000408026547 476936474 /nfs/dbraw/zinc/93/64/74/476936474.db2.gz YRRLMNGKEVYHGE-STQMWFEESA-N 1 1 342.399 2.775 10 5 EFBEMO NC1(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)CCCCCC1 ZINC000423208098 476963811 /nfs/dbraw/zinc/96/38/11/476963811.db2.gz YVKKPNZHXRLJTI-GJZGRUSLSA-N 1 1 335.452 2.916 10 5 EFBEMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3c[nH]cn3)CC2)c([N+](=O)[O-])c1 ZINC000375716290 476968238 /nfs/dbraw/zinc/96/82/38/476968238.db2.gz AUMWGDQTAPKCIP-UHFFFAOYSA-N 1 1 331.332 2.606 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCCCN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1 ZINC000447680283 477034662 /nfs/dbraw/zinc/03/46/62/477034662.db2.gz QOHAOJJJYKDLSD-ZDUSSCGKSA-N 1 1 331.420 2.960 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NC[C@H]1CCC[N@H+]1C ZINC000447816148 477064699 /nfs/dbraw/zinc/06/46/99/477064699.db2.gz IZKOJGQCIXMWHZ-SECBINFHSA-N 1 1 327.768 2.541 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC000366858074 477225072 /nfs/dbraw/zinc/22/50/72/477225072.db2.gz WACWNYONGBXRCE-IAGOWNOFSA-N 1 1 343.358 2.909 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC000366858074 477225079 /nfs/dbraw/zinc/22/50/79/477225079.db2.gz WACWNYONGBXRCE-IAGOWNOFSA-N 1 1 343.358 2.909 10 5 EFBEMO O=C(CC[N@@H+]1CCCCC[C@@H]1CCO)Nc1ccc([N+](=O)[O-])cc1 ZINC000411690459 477329967 /nfs/dbraw/zinc/32/99/67/477329967.db2.gz ATRMXTGCTWGQPI-OAHLLOKOSA-N 1 1 335.404 2.550 10 5 EFBEMO CCn1nc2c(cc1=O)C[N@H+]([C@H](C)c1cc([N+](=O)[O-])ccc1C)CC2 ZINC000371497576 477355902 /nfs/dbraw/zinc/35/59/02/477355902.db2.gz QAQZGSCFDRJHSI-CYBMUJFWSA-N 1 1 342.399 2.599 10 5 EFBEMO CCn1nc2c(cc1=O)C[N@@H+]([C@H](C)c1cc([N+](=O)[O-])ccc1C)CC2 ZINC000371497576 477355907 /nfs/dbraw/zinc/35/59/07/477355907.db2.gz QAQZGSCFDRJHSI-CYBMUJFWSA-N 1 1 342.399 2.599 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCO[C@@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000411848349 477391995 /nfs/dbraw/zinc/39/19/95/477391995.db2.gz NDVZTIHHHWTQDR-QGZVFWFLSA-N 1 1 347.415 2.733 10 5 EFBEMO C[C@@H]1CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1CCO ZINC000419009601 477492889 /nfs/dbraw/zinc/49/28/89/477492889.db2.gz WIPJZUNBGRUFAC-MNOVXSKESA-N 1 1 347.337 2.505 10 5 EFBEMO CC(C)c1ccc(C[N@@H+](C)[C@H]2CCN3CCO[C@H]2C3)cc1[N+](=O)[O-] ZINC000449358622 477560192 /nfs/dbraw/zinc/56/01/92/477560192.db2.gz COPHICMAFMGOQF-WMZOPIPTSA-N 1 1 333.432 2.623 10 5 EFBEMO C[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H](c2ccccc2)C1 ZINC000450228905 477584233 /nfs/dbraw/zinc/58/42/33/477584233.db2.gz VUHGBMNYAGICLM-QGZVFWFLSA-N 1 1 337.383 2.964 10 5 EFBEMO C[N@H+]1CC[C@H](CNC(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000455421044 477626369 /nfs/dbraw/zinc/62/63/69/477626369.db2.gz ULZXWYRVMCBILU-GFCCVEGCSA-N 1 1 334.420 2.966 10 5 EFBEMO CCc1cc(CCC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)on1 ZINC000450573018 477638874 /nfs/dbraw/zinc/63/88/74/477638874.db2.gz VSPBEIUELZMTND-AWEZNQCLSA-N 1 1 345.403 2.659 10 5 EFBEMO C[C@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000372150191 477662807 /nfs/dbraw/zinc/66/28/07/477662807.db2.gz NIZHOWNXOMLXDV-OMWUSAIZSA-N 1 1 342.395 2.952 10 5 EFBEMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cn1 ZINC000377226938 477700999 /nfs/dbraw/zinc/70/09/99/477700999.db2.gz UAQCSVAIDWKCAZ-AWEZNQCLSA-N 1 1 332.404 2.517 10 5 EFBEMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(OC[C@H]2CCOC2)CC1 ZINC000372391409 477784167 /nfs/dbraw/zinc/78/41/67/477784167.db2.gz BWKNGAUNBPNXDK-ZDUSSCGKSA-N 1 1 338.379 2.751 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@H](C(C)C)C1 ZINC000438478871 477846384 /nfs/dbraw/zinc/84/63/84/477846384.db2.gz AGGWFJKFJAFNNM-STQMWFEESA-N 1 1 335.404 2.908 10 5 EFBEMO CC(C)[C@@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000438484628 477849049 /nfs/dbraw/zinc/84/90/49/477849049.db2.gz RPIZMFZSKIBGRR-CYBMUJFWSA-N 1 1 333.388 2.871 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](C(C)C)C1 ZINC000438493271 477850893 /nfs/dbraw/zinc/85/08/93/477850893.db2.gz LIZUIBRGEDDSGJ-CYBMUJFWSA-N 1 1 335.404 2.910 10 5 EFBEMO COc1ccc(-c2ccc(C[N@H+]3C[C@@H](O)C4(CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000428388229 477883357 /nfs/dbraw/zinc/88/33/57/477883357.db2.gz VZGLHGOGTXSDIY-QGZVFWFLSA-N 1 1 344.367 2.820 10 5 EFBEMO NC(=O)C[C@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000559071271 477956678 /nfs/dbraw/zinc/95/66/78/477956678.db2.gz NNHHUPNDZULMPH-LLVKDONJSA-N 1 1 345.321 2.844 10 5 EFBEMO NC(=O)C[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000559071271 477956684 /nfs/dbraw/zinc/95/66/84/477956684.db2.gz NNHHUPNDZULMPH-LLVKDONJSA-N 1 1 345.321 2.844 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCCC[C@@H]3[C@@H]3CCC[C@H]3O)nc2c1 ZINC000451351216 477968529 /nfs/dbraw/zinc/96/85/29/477968529.db2.gz IKWFFAUAKHMPKO-IAOVAPTHSA-N 1 1 344.415 2.987 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H]2[C@@H]3C=C[C@@H](C3)[C@]2(C)C1 ZINC000451376136 477982220 /nfs/dbraw/zinc/98/22/20/477982220.db2.gz VJXAOBGEAGPBTI-DFHZNHDVSA-N 1 1 341.411 2.986 10 5 EFBEMO CN(C(=O)C[N@H+]1C[C@@H]2[C@@H]3C=C[C@@H](C3)[C@]2(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000451377871 477982736 /nfs/dbraw/zinc/98/27/36/477982736.db2.gz XMDYWORMNALWRQ-AHMDFLBRSA-N 1 1 341.411 2.702 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@](O)(CO)C2)s1 ZINC000459727799 478061159 /nfs/dbraw/zinc/06/11/59/478061159.db2.gz REFQRTZWBKOMNX-KRWDZBQOSA-N 1 1 348.424 2.643 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cn(CC4CC4)nn3)C2)cc1 ZINC000451546757 478082044 /nfs/dbraw/zinc/08/20/44/478082044.db2.gz JRVNXLFDKTZAPL-MRXNPFEDSA-N 1 1 341.415 2.976 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cn(CC4CC4)nn3)C2)cc1 ZINC000451546757 478082048 /nfs/dbraw/zinc/08/20/48/478082048.db2.gz JRVNXLFDKTZAPL-MRXNPFEDSA-N 1 1 341.415 2.976 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cn(CC4CC4)nn3)C2)cc1 ZINC000451546756 478083477 /nfs/dbraw/zinc/08/34/77/478083477.db2.gz JRVNXLFDKTZAPL-INIZCTEOSA-N 1 1 341.415 2.976 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cn(CC4CC4)nn3)C2)cc1 ZINC000451546756 478083484 /nfs/dbraw/zinc/08/34/84/478083484.db2.gz JRVNXLFDKTZAPL-INIZCTEOSA-N 1 1 341.415 2.976 10 5 EFBEMO CN(CC1CC1)C(=O)C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548839 478084546 /nfs/dbraw/zinc/08/45/46/478084546.db2.gz OPPHXQHVMXRLAL-MRXNPFEDSA-N 1 1 331.416 2.643 10 5 EFBEMO COc1cc(CN2CC[N@H+](C3CCC3)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000429383629 478126461 /nfs/dbraw/zinc/12/64/61/478126461.db2.gz HYJGJBGITHPUQX-CQSZACIVSA-N 1 1 333.432 2.910 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@@H]2C[C@@H](OC)C23CCC3)c1 ZINC000590661490 478279877 /nfs/dbraw/zinc/27/98/77/478279877.db2.gz ZFQWDHZEMXJWAE-HZPDHXFCSA-N 1 1 348.399 2.771 10 5 EFBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2C[C@@H]3CCC[C@]3(CO)C2)c1 ZINC000600207104 478282914 /nfs/dbraw/zinc/28/29/14/478282914.db2.gz IEDKYBDSXBHGLF-BLLLJJGKSA-N 1 1 342.342 2.791 10 5 EFBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2C[C@@H]3CCC[C@]3(CO)C2)c1 ZINC000600207104 478282922 /nfs/dbraw/zinc/28/29/22/478282922.db2.gz IEDKYBDSXBHGLF-BLLLJJGKSA-N 1 1 342.342 2.791 10 5 EFBEMO CCC1([NH+]2CCOCC2)CCN(Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000600208574 478284533 /nfs/dbraw/zinc/28/45/33/478284533.db2.gz MRIFRPQOXGNXEE-UHFFFAOYSA-N 1 1 347.459 2.980 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000600227334 478297003 /nfs/dbraw/zinc/29/70/03/478297003.db2.gz AOOPBEFITUUMPD-AWEZNQCLSA-N 1 1 335.379 2.871 10 5 EFBEMO COCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)[C@@H]1CCOC1 ZINC000490083780 478311763 /nfs/dbraw/zinc/31/17/63/478311763.db2.gz FQKQJGYEZNNCET-MRXNPFEDSA-N 1 1 338.404 2.619 10 5 EFBEMO COCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)[C@@H]1CCOC1 ZINC000490083780 478311770 /nfs/dbraw/zinc/31/17/70/478311770.db2.gz FQKQJGYEZNNCET-MRXNPFEDSA-N 1 1 338.404 2.619 10 5 EFBEMO O=C([C@@H]1CCc2[nH]cnc2C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000597468409 478366489 /nfs/dbraw/zinc/36/64/89/478366489.db2.gz QHPYYUQJWZGOKJ-CYBMUJFWSA-N 1 1 340.383 2.614 10 5 EFBEMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000600473142 478381646 /nfs/dbraw/zinc/38/16/46/478381646.db2.gz RSLAZHFUMZMZNU-CQSZACIVSA-N 1 1 342.399 2.823 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000600473141 478381710 /nfs/dbraw/zinc/38/17/10/478381710.db2.gz RSLAZHFUMZMZNU-AWEZNQCLSA-N 1 1 342.399 2.823 10 5 EFBEMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000600471461 478381939 /nfs/dbraw/zinc/38/19/39/478381939.db2.gz SFZQQJDSGTUKGQ-FGTMMUONSA-N 1 1 343.427 2.831 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000600474020 478384636 /nfs/dbraw/zinc/38/46/36/478384636.db2.gz WEMLJWPCXWXSKZ-AWEZNQCLSA-N 1 1 342.399 2.823 10 5 EFBEMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000600474021 478385146 /nfs/dbraw/zinc/38/51/46/478385146.db2.gz WEMLJWPCXWXSKZ-CQSZACIVSA-N 1 1 342.399 2.823 10 5 EFBEMO C[C@@H](C(=O)N1CC[NH2+][C@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000562958534 478393525 /nfs/dbraw/zinc/39/35/25/478393525.db2.gz IBYBOZCZUGODDB-KDOFPFPSSA-N 1 1 339.395 2.871 10 5 EFBEMO C[C@@H]([NH3+])c1ccc(CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000591275481 478504930 /nfs/dbraw/zinc/50/49/30/478504930.db2.gz GQJIEWVHVYTFPV-GFCCVEGCSA-N 1 1 343.383 2.676 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)n1 ZINC000541005211 478527404 /nfs/dbraw/zinc/52/74/04/478527404.db2.gz KKRIHCJMDXDRSM-HUUCEWRRSA-N 1 1 334.420 2.662 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000597856883 478542705 /nfs/dbraw/zinc/54/27/05/478542705.db2.gz CDMVFTYIUMARLV-LLVKDONJSA-N 1 1 330.388 2.679 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000597857297 478544070 /nfs/dbraw/zinc/54/40/70/478544070.db2.gz CPSCEKMBZVDSHT-ZDUSSCGKSA-N 1 1 331.372 2.944 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)c1 ZINC000597858186 478544619 /nfs/dbraw/zinc/54/46/19/478544619.db2.gz LSGBOYJOXGEPSD-AWEZNQCLSA-N 1 1 349.431 2.661 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000597859094 478545040 /nfs/dbraw/zinc/54/50/40/478545040.db2.gz RUXSOIWVEYDHTF-GFCCVEGCSA-N 1 1 330.388 2.679 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000597859949 478547056 /nfs/dbraw/zinc/54/70/56/478547056.db2.gz IQZLFBUBWZORNH-HNNXBMFYSA-N 1 1 347.415 2.547 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000597859638 478547302 /nfs/dbraw/zinc/54/73/02/478547302.db2.gz WUKSCFSDOURBQQ-HNNXBMFYSA-N 1 1 333.432 2.861 10 5 EFBEMO COc1ccc(C[NH2+]Cc2c(C(F)(F)F)cnn2C)cc1[N+](=O)[O-] ZINC000594917185 478583573 /nfs/dbraw/zinc/58/35/73/478583573.db2.gz HRMUYFGCRYCHSM-UHFFFAOYSA-N 1 1 344.293 2.646 10 5 EFBEMO CCN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598042243 478628380 /nfs/dbraw/zinc/62/83/80/478628380.db2.gz WNVZXNAAOTXPKL-IXDOHACOSA-N 1 1 331.416 2.641 10 5 EFBEMO CCOc1ccc(C(=O)N(CC)[C@@H]2CC[N@@H+](CC)C2)cc1[N+](=O)[O-] ZINC000598041797 478628549 /nfs/dbraw/zinc/62/85/49/478628549.db2.gz MZIAJMOKIZMVJG-CQSZACIVSA-N 1 1 335.404 2.550 10 5 EFBEMO CC(C)C(=O)N1CCC(Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000601103092 478656406 /nfs/dbraw/zinc/65/64/06/478656406.db2.gz NPOHFLYFQYKVGH-UHFFFAOYSA-N 1 1 342.399 2.624 10 5 EFBEMO COc1ccc(C[NH2+]Cc2ccnn2CC2CCC2)cc1[N+](=O)[O-] ZINC000601103242 478656502 /nfs/dbraw/zinc/65/65/02/478656502.db2.gz QYZDZNLIUSQSCX-UHFFFAOYSA-N 1 1 330.388 2.890 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CCC[N@H+](C(C)(C)C)CC1 ZINC000601108865 478661387 /nfs/dbraw/zinc/66/13/87/478661387.db2.gz NQYBCGBLTVBOLS-UHFFFAOYSA-N 1 1 349.357 2.658 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@](O)(C(F)(F)F)C3)c2c1 ZINC000601121406 478668534 /nfs/dbraw/zinc/66/85/34/478668534.db2.gz NVSJTGICGOPURW-CYBMUJFWSA-N 1 1 327.262 2.647 10 5 EFBEMO Cc1nn(C)c(C)c1C[C@H](C)Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000601121635 478669258 /nfs/dbraw/zinc/66/92/58/478669258.db2.gz OVYHRTBWISKYRD-NSHDSACASA-N 1 1 339.399 2.958 10 5 EFBEMO CC[N@H+]1CCCN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)CC1 ZINC000601130360 478676050 /nfs/dbraw/zinc/67/60/50/478676050.db2.gz JEZPXCDRPHNIOX-UHFFFAOYSA-N 1 1 331.416 2.571 10 5 EFBEMO COc1ccc(F)cc1C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC000601150334 478689354 /nfs/dbraw/zinc/68/93/54/478689354.db2.gz VTUARIZSMZTBQJ-KRWDZBQOSA-N 1 1 334.347 2.740 10 5 EFBEMO CN(C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000601152516 478691468 /nfs/dbraw/zinc/69/14/68/478691468.db2.gz FGFDNRZVJKXGAF-KRWDZBQOSA-N 1 1 343.427 2.712 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCO[C@@]4(CCSC4)C3)c2c1 ZINC000601181464 478710480 /nfs/dbraw/zinc/71/04/80/478710480.db2.gz KWXFWBGKRZBDSU-INIZCTEOSA-N 1 1 331.397 2.855 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c1 ZINC000542970459 478711275 /nfs/dbraw/zinc/71/12/75/478711275.db2.gz IQCQTTUZVATZHE-AWEZNQCLSA-N 1 1 347.415 2.550 10 5 EFBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@H]1CC[N@H+](C(C)(C)C)C1 ZINC000601191616 478715546 /nfs/dbraw/zinc/71/55/46/478715546.db2.gz OBAHXJTWSPOOLJ-QMMMGPOBSA-N 1 1 335.330 2.632 10 5 EFBEMO CC(C)(CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12)C(=O)N1CCCC1 ZINC000601203835 478721786 /nfs/dbraw/zinc/72/17/86/478721786.db2.gz WGVYZPVRMDZHRI-UHFFFAOYSA-N 1 1 342.399 2.625 10 5 EFBEMO CN(C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1)[C@H]1CCC[N@@H+](C)C1 ZINC000601231714 478737848 /nfs/dbraw/zinc/73/78/48/478737848.db2.gz IVUKFWFOOKGFEL-INIZCTEOSA-N 1 1 331.416 2.569 10 5 EFBEMO C[C@@H]1C[C@@H](NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)CC[N@H+]1C ZINC000601233234 478738816 /nfs/dbraw/zinc/73/88/16/478738816.db2.gz ZTGLTOWXSOGZMY-HIFRSBDPSA-N 1 1 331.416 2.615 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)c2ccc([N+](=O)[O-])c(OC(C)C)n2)[C@H](C)C1 ZINC000564469338 478748522 /nfs/dbraw/zinc/74/85/22/478748522.db2.gz CZEAGSGRXMZDQF-KGLIPLIRSA-N 1 1 336.436 2.944 10 5 EFBEMO CC[N@@H+](C)C[C@H]1CCN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000601260937 478753145 /nfs/dbraw/zinc/75/31/45/478753145.db2.gz WOBYGNPAHBDSDO-OAHLLOKOSA-N 1 1 345.443 2.817 10 5 EFBEMO CO[C@H](C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CCCC1 ZINC000595373189 478753218 /nfs/dbraw/zinc/75/32/18/478753218.db2.gz XZTXWEHBQDDSKE-GOEBONIOSA-N 1 1 334.420 2.681 10 5 EFBEMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601311116 478779897 /nfs/dbraw/zinc/77/98/97/478779897.db2.gz YKGRKMHEYVJBJM-SUMWQHHRSA-N 1 1 343.427 2.615 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[N@H+](CCn1ccnc1)[C@H]1CC[C@H](O)CC1 ZINC000592132268 478789895 /nfs/dbraw/zinc/78/98/95/478789895.db2.gz FXTNORMKNQSCQC-QAQDUYKDSA-N 1 1 344.415 2.597 10 5 EFBEMO C[C@@H](O)CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592132879 478790484 /nfs/dbraw/zinc/79/04/84/478790484.db2.gz PBJJXFOSPAERBY-DJIMGWMZSA-N 1 1 336.432 2.861 10 5 EFBEMO CCO[C@@H]1C[C@@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@@H]1SC ZINC000592165993 478810619 /nfs/dbraw/zinc/81/06/19/478810619.db2.gz FAUXTUOKMJQCBC-KYOSRNDESA-N 1 1 337.401 2.735 10 5 EFBEMO CNC(=O)[C@]1(C(F)(F)F)CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000592183067 478815670 /nfs/dbraw/zinc/81/56/70/478815670.db2.gz CPWMDKNIFHNDFW-HZMBPMFUSA-N 1 1 345.321 2.656 10 5 EFBEMO CC[C@@H]1[C@@H](C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CC[N@H+]1C ZINC000601391876 478816487 /nfs/dbraw/zinc/81/64/87/478816487.db2.gz BTCPICJWDAKYNE-DLBZAZTESA-N 1 1 331.416 2.816 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000598466492 478837354 /nfs/dbraw/zinc/83/73/54/478837354.db2.gz VMGZPBWNHDQRNX-UHFFFAOYSA-N 1 1 337.420 2.519 10 5 EFBEMO Cc1sc(C(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000598562089 478897377 /nfs/dbraw/zinc/89/73/77/478897377.db2.gz SYNIEJANKGNNMZ-CYBMUJFWSA-N 1 1 337.445 2.817 10 5 EFBEMO CC1(C)C[C@H]([N@@H+](CCn2cc([N+](=O)[O-])cn2)Cc2ccccc2)CO1 ZINC000595634525 478904549 /nfs/dbraw/zinc/90/45/49/478904549.db2.gz BPKLSSMLJPWCAR-INIZCTEOSA-N 1 1 344.415 2.861 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]2[C@@H]2CCCOC2)c1 ZINC000592516982 478926302 /nfs/dbraw/zinc/92/63/02/478926302.db2.gz MNZOQSKAFDDWSZ-ZBFHGGJFSA-N 1 1 348.399 2.772 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](Nc3ncccn3)C2)c(Cl)c1 ZINC000592517153 478926748 /nfs/dbraw/zinc/92/67/48/478926748.db2.gz TZOKAXKAWSEYAL-LBPRGKRZSA-N 1 1 333.779 2.725 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Nc3ncccn3)C2)c(Cl)c1 ZINC000592517153 478926753 /nfs/dbraw/zinc/92/67/53/478926753.db2.gz TZOKAXKAWSEYAL-LBPRGKRZSA-N 1 1 333.779 2.725 10 5 EFBEMO C[C@H]1COC2(CCC2)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000595680951 478931919 /nfs/dbraw/zinc/93/19/19/478931919.db2.gz JAVGWWIQYZWMIA-ZDUSSCGKSA-N 1 1 333.388 2.567 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC2(CCC2)OC[C@@H]1C ZINC000595680017 478932428 /nfs/dbraw/zinc/93/24/28/478932428.db2.gz GHHQAECEDPWHBG-AWEZNQCLSA-N 1 1 347.415 2.875 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@]3(C)COC[C@]3(C)C2)cccc1[N+](=O)[O-] ZINC000595688918 478937522 /nfs/dbraw/zinc/93/75/22/478937522.db2.gz KNUBHJRXSHPDMF-DOPJRALCSA-N 1 1 347.415 2.589 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@]3(C)COC[C@]3(C)C2)cccc1[N+](=O)[O-] ZINC000595688918 478937526 /nfs/dbraw/zinc/93/75/26/478937526.db2.gz KNUBHJRXSHPDMF-DOPJRALCSA-N 1 1 347.415 2.589 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1 ZINC000595742800 478971267 /nfs/dbraw/zinc/97/12/67/478971267.db2.gz HUGKCYHQCZHVJA-ZAZJYDDPSA-N 1 1 346.387 2.655 10 5 EFBEMO C[C@]12COC[C@H]1C[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000595759458 478979831 /nfs/dbraw/zinc/97/98/31/478979831.db2.gz QIHPJPOWUHOZOA-RISCZKNCSA-N 1 1 341.205 2.826 10 5 EFBEMO C[C@]12COC[C@H]1C[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000595759458 478979839 /nfs/dbraw/zinc/97/98/39/478979839.db2.gz QIHPJPOWUHOZOA-RISCZKNCSA-N 1 1 341.205 2.826 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2COC[C@@]2(C)C1 ZINC000595761483 478982851 /nfs/dbraw/zinc/98/28/51/478982851.db2.gz XABNGNACGREXBQ-CJBNDPTMSA-N 1 1 344.371 2.674 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000592748652 479025036 /nfs/dbraw/zinc/02/50/36/479025036.db2.gz OQHSKWWZSPUANK-LBPRGKRZSA-N 1 1 328.372 2.894 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000592763498 479031835 /nfs/dbraw/zinc/03/18/35/479031835.db2.gz SSQHVJLYVXBIFF-CYBMUJFWSA-N 1 1 346.387 2.500 10 5 EFBEMO CCOc1cc(C[N@H+]2CCC[C@H](C(=O)NC(C)C)C2)ccc1[N+](=O)[O-] ZINC000595850697 479032633 /nfs/dbraw/zinc/03/26/33/479032633.db2.gz NNAQYRFSXFTRLY-HNNXBMFYSA-N 1 1 349.431 2.730 10 5 EFBEMO C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@@H]1CCc2ccccc21 ZINC000595876134 479046205 /nfs/dbraw/zinc/04/62/05/479046205.db2.gz DPCAPYNDLZDNHR-HNNXBMFYSA-N 1 1 339.395 2.856 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c1 ZINC000595905010 479063531 /nfs/dbraw/zinc/06/35/31/479063531.db2.gz OBJYBUHVKASBHF-HDICACEKSA-N 1 1 332.400 2.866 10 5 EFBEMO CCCN(C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1CC[N@@H+](C)C1 ZINC000592832156 479064663 /nfs/dbraw/zinc/06/46/63/479064663.db2.gz RRLYAVOZSSBANB-ZDUSSCGKSA-N 1 1 330.388 2.632 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C[C@]45COC[C@@]4(C3)CCCC5)nc2c1 ZINC000595912200 479067089 /nfs/dbraw/zinc/06/70/89/479067089.db2.gz ZJBJEQURFQVSQD-HDICACEKSA-N 1 1 342.399 2.864 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3C[C@]45COC[C@@]4(C3)CCCC5)nc2c1 ZINC000595912200 479067093 /nfs/dbraw/zinc/06/70/93/479067093.db2.gz ZJBJEQURFQVSQD-HDICACEKSA-N 1 1 342.399 2.864 10 5 EFBEMO C[N@H+]1C[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000592881867 479086954 /nfs/dbraw/zinc/08/69/54/479086954.db2.gz NWCHYZDVMFMRDB-AEFFLSMTSA-N 1 1 339.395 2.670 10 5 EFBEMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCO[C@@H](C(F)F)CC2)cc1 ZINC000601976336 479105052 /nfs/dbraw/zinc/10/50/52/479105052.db2.gz POQRHWLRZDRASK-CQSZACIVSA-N 1 1 330.331 2.720 10 5 EFBEMO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H](n2cccn2)C(F)(F)F)c(F)c1 ZINC000598989494 479116337 /nfs/dbraw/zinc/11/63/37/479116337.db2.gz IZJRQJCHMYVCDZ-GFCCVEGCSA-N 1 1 332.257 2.824 10 5 EFBEMO COc1cc(CNC[C@H]2CC[N@H+]2C2CCCCC2)c([N+](=O)[O-])cc1O ZINC000598992432 479117581 /nfs/dbraw/zinc/11/75/81/479117581.db2.gz NRIONJLDEMKRFP-OAHLLOKOSA-N 1 1 349.431 2.806 10 5 EFBEMO COc1cc(C[NH2+]C[C@H]2CCN2C2CCCCC2)c([N+](=O)[O-])cc1O ZINC000598992432 479117588 /nfs/dbraw/zinc/11/75/88/479117588.db2.gz NRIONJLDEMKRFP-OAHLLOKOSA-N 1 1 349.431 2.806 10 5 EFBEMO COc1cc(CNC[C@@H]2CC[N@H+]2C2CCCCC2)c([N+](=O)[O-])cc1O ZINC000598992431 479118205 /nfs/dbraw/zinc/11/82/05/479118205.db2.gz NRIONJLDEMKRFP-HNNXBMFYSA-N 1 1 349.431 2.806 10 5 EFBEMO COc1cc(C[NH2+]C[C@@H]2CCN2C2CCCCC2)c([N+](=O)[O-])cc1O ZINC000598992431 479118215 /nfs/dbraw/zinc/11/82/15/479118215.db2.gz NRIONJLDEMKRFP-HNNXBMFYSA-N 1 1 349.431 2.806 10 5 EFBEMO Cc1cc(C2([NH2+]Cc3ccc([N+](=O)[O-])cc3C)CCOCC2)on1 ZINC000599021003 479128448 /nfs/dbraw/zinc/12/84/48/479128448.db2.gz RNDRKQYRVNUIKP-UHFFFAOYSA-N 1 1 331.372 2.995 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](CO)c2ccccc2C)c1 ZINC000593022174 479128851 /nfs/dbraw/zinc/12/88/51/479128851.db2.gz CSPJCYVUFKEFHH-INIZCTEOSA-N 1 1 344.367 2.513 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2cncc(F)c2)c1 ZINC000593023588 479130647 /nfs/dbraw/zinc/13/06/47/479130647.db2.gz WNZBIMRCHFJCFY-JTQLQIEISA-N 1 1 333.319 2.766 10 5 EFBEMO Cc1cc(N2CCN(C[C@@H]3CCCC[N@@H+]3C)CC2)c([N+](=O)[O-])s1 ZINC000596122883 479151728 /nfs/dbraw/zinc/15/17/28/479151728.db2.gz QEFLZPCXCUMUPD-AWEZNQCLSA-N 1 1 338.477 2.571 10 5 EFBEMO CNC(=O)c1ccc(NC[C@H]2CC[N@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000599127167 479170305 /nfs/dbraw/zinc/17/03/05/479170305.db2.gz QJZLBMGPEZZOMJ-OAHLLOKOSA-N 1 1 346.431 2.773 10 5 EFBEMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000599128019 479172226 /nfs/dbraw/zinc/17/22/26/479172226.db2.gz VLSLJJIMDKBACS-OAHLLOKOSA-N 1 1 346.431 2.773 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@H]2CNc2ncc(C)cc2[N+](=O)[O-])cc1 ZINC000599140470 479178774 /nfs/dbraw/zinc/17/87/74/479178774.db2.gz UIPIGKYYAVTINY-HNNXBMFYSA-N 1 1 342.399 2.993 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@H]2CNc2ncc(C)cc2[N+](=O)[O-])cc1 ZINC000599140470 479178780 /nfs/dbraw/zinc/17/87/80/479178780.db2.gz UIPIGKYYAVTINY-HNNXBMFYSA-N 1 1 342.399 2.993 10 5 EFBEMO COc1cc(N2CC[C@@H](c3[nH+]ccn3C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596174188 479179892 /nfs/dbraw/zinc/17/98/92/479179892.db2.gz ITLZHBBMETWZLU-SNVBAGLBSA-N 1 1 336.779 2.984 10 5 EFBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593116867 479183532 /nfs/dbraw/zinc/18/35/32/479183532.db2.gz JKDNGBQWCVJCKB-IINYFYTJSA-N 1 1 325.315 2.653 10 5 EFBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593116867 479183535 /nfs/dbraw/zinc/18/35/35/479183535.db2.gz JKDNGBQWCVJCKB-IINYFYTJSA-N 1 1 325.315 2.653 10 5 EFBEMO C[C@H](c1cccc(F)c1)[NH+]1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1 ZINC000596180345 479183747 /nfs/dbraw/zinc/18/37/47/479183747.db2.gz XBXGOMKOAQNXRJ-GFCCVEGCSA-N 1 1 345.378 2.594 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593115649 479183993 /nfs/dbraw/zinc/18/39/93/479183993.db2.gz CRNAQERQSARCKG-AWEZNQCLSA-N 1 1 325.315 2.573 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593115649 479184002 /nfs/dbraw/zinc/18/40/02/479184002.db2.gz CRNAQERQSARCKG-AWEZNQCLSA-N 1 1 325.315 2.573 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000593115223 479184076 /nfs/dbraw/zinc/18/40/76/479184076.db2.gz AOAKZSVTERIBQW-NHYWBVRUSA-N 1 1 339.342 2.961 10 5 EFBEMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000593115223 479184084 /nfs/dbraw/zinc/18/40/84/479184084.db2.gz AOAKZSVTERIBQW-NHYWBVRUSA-N 1 1 339.342 2.961 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CC[C@@]4(CC4(F)F)C3)o2)cc1 ZINC000593118832 479187650 /nfs/dbraw/zinc/18/76/50/479187650.db2.gz YSZRMSDNZLRNHY-CQSZACIVSA-N 1 1 336.298 2.876 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@]4(CC4(F)F)C3)o2)cc1 ZINC000593118832 479187659 /nfs/dbraw/zinc/18/76/59/479187659.db2.gz YSZRMSDNZLRNHY-CQSZACIVSA-N 1 1 336.298 2.876 10 5 EFBEMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC000596275381 479233794 /nfs/dbraw/zinc/23/37/94/479233794.db2.gz RBTRXVFGBNTHCQ-QWRGUYRKSA-N 1 1 347.337 2.505 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000593205027 479239073 /nfs/dbraw/zinc/23/90/73/479239073.db2.gz SXSRLBQNTKSXAA-UHFFFAOYSA-N 1 1 341.839 2.885 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000593209080 479240227 /nfs/dbraw/zinc/24/02/27/479240227.db2.gz OWZIOATUNMEHBC-UHFFFAOYSA-N 1 1 348.447 2.877 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000596307332 479246455 /nfs/dbraw/zinc/24/64/55/479246455.db2.gz KRCTUADLOPCTKS-AWEZNQCLSA-N 1 1 346.431 2.772 10 5 EFBEMO CCOC(=O)Cc1ccc(NC[C@@H]2CC[N@H+]2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000596309514 479248176 /nfs/dbraw/zinc/24/81/76/479248176.db2.gz STEQLLSRDXZVCO-AWEZNQCLSA-N 1 1 349.431 2.985 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000596307892 479248458 /nfs/dbraw/zinc/24/84/58/479248458.db2.gz QGIPZGQANCEGMQ-LBPRGKRZSA-N 1 1 332.404 2.764 10 5 EFBEMO C[C@@H](CN(C)CCC[NH+](C)C)Nc1ccnc2c1cccc2[N+](=O)[O-] ZINC000596361942 479265321 /nfs/dbraw/zinc/26/53/21/479265321.db2.gz NDRUNEDMSDURCY-AWEZNQCLSA-N 1 1 345.447 2.827 10 5 EFBEMO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000596360376 479265682 /nfs/dbraw/zinc/26/56/82/479265682.db2.gz KAVYJOJGOMTBGT-AWEZNQCLSA-N 1 1 345.447 2.827 10 5 EFBEMO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000596360376 479265690 /nfs/dbraw/zinc/26/56/90/479265690.db2.gz KAVYJOJGOMTBGT-AWEZNQCLSA-N 1 1 345.447 2.827 10 5 EFBEMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC000611179862 479304546 /nfs/dbraw/zinc/30/45/46/479304546.db2.gz LYLFLOSCWZAQBM-SNVBAGLBSA-N 1 1 343.330 2.519 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c1 ZINC000596514787 479324189 /nfs/dbraw/zinc/32/41/89/479324189.db2.gz GEZJRZIVOOMKBW-IAGOWNOFSA-N 1 1 331.416 2.959 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553146 479331099 /nfs/dbraw/zinc/33/10/99/479331099.db2.gz OQTNMKJDQZKRBL-KGLIPLIRSA-N 1 1 335.429 2.812 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553146 479331106 /nfs/dbraw/zinc/33/11/06/479331106.db2.gz OQTNMKJDQZKRBL-KGLIPLIRSA-N 1 1 335.429 2.812 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@H]([C@@H]3CCOC3)C1)OCCO2 ZINC000611287570 479338027 /nfs/dbraw/zinc/33/80/27/479338027.db2.gz RTBIFGDWPOXXHD-UONOGXRCSA-N 1 1 348.399 2.615 10 5 EFBEMO C[C@H](Nc1ccnc2cc([N+](=O)[O-])ccc21)[C@H](C)[NH+]1CCOCC1 ZINC000593461961 479352054 /nfs/dbraw/zinc/35/20/54/479352054.db2.gz WMSCRHHYDLFLBO-STQMWFEESA-N 1 1 330.388 2.664 10 5 EFBEMO Cn1ncc2c1CC(C)(C)C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC000596599225 479353263 /nfs/dbraw/zinc/35/32/63/479353263.db2.gz RKFRQNYMAXKQQI-UHFFFAOYSA-N 1 1 344.415 2.792 10 5 EFBEMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC(C)([NH+]2CCOCC2)CC1 ZINC000599623801 479357649 /nfs/dbraw/zinc/35/76/49/479357649.db2.gz XNEHKAKLLAVMNH-HNNXBMFYSA-N 1 1 333.432 2.843 10 5 EFBEMO C[C@H]1O[C@@H](C)[C@H](C)[C@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000599627042 479359371 /nfs/dbraw/zinc/35/93/71/479359371.db2.gz VAFVFHXLXPOFEX-KIGUWFBYSA-N 1 1 332.360 2.546 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000593479297 479359573 /nfs/dbraw/zinc/35/95/73/479359573.db2.gz AFWYMYAOYUFENX-UHFFFAOYSA-N 1 1 333.392 2.633 10 5 EFBEMO C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000599627223 479359941 /nfs/dbraw/zinc/35/99/41/479359941.db2.gz VAFVFHXLXPOFEX-ZVXAKGHKSA-N 1 1 332.360 2.546 10 5 EFBEMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)c1 ZINC000599634160 479362274 /nfs/dbraw/zinc/36/22/74/479362274.db2.gz GJCOWROJONGAOH-UHFFFAOYSA-N 1 1 340.305 2.868 10 5 EFBEMO O=[N+]([O-])c1cnn(CC[N@H+]2CCc3cc(C(F)(F)F)ccc3C2)c1 ZINC000599634160 479362284 /nfs/dbraw/zinc/36/22/84/479362284.db2.gz GJCOWROJONGAOH-UHFFFAOYSA-N 1 1 340.305 2.868 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C ZINC000596627328 479363011 /nfs/dbraw/zinc/36/30/11/479363011.db2.gz YIIOERJLQOHWFP-LBPRGKRZSA-N 1 1 336.392 2.598 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3C[C@@H]4CCC[C@]4(CO)C3)co2)cc1 ZINC000599635830 479363124 /nfs/dbraw/zinc/36/31/24/479363124.db2.gz ANBGJILXEBNFHL-KBXCAEBGSA-N 1 1 343.383 2.844 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@H]21 ZINC000599649563 479368758 /nfs/dbraw/zinc/36/87/58/479368758.db2.gz BNPKKYOHNYLFAW-GVDBMIGSSA-N 1 1 332.400 2.801 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@@H]2CCC[C@H]21 ZINC000599661168 479376721 /nfs/dbraw/zinc/37/67/21/479376721.db2.gz SKWYYFYTBXWVPY-RRFJBIMHSA-N 1 1 348.399 2.767 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC2(CC2)CC1 ZINC000599672904 479384287 /nfs/dbraw/zinc/38/42/87/479384287.db2.gz IXOLOECNUJEKBJ-UHFFFAOYSA-N 1 1 333.388 2.808 10 5 EFBEMO CC[C@@H](NC(=O)N1CC[N@@H+](C)C(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000603434991 479384801 /nfs/dbraw/zinc/38/48/01/479384801.db2.gz VWXCKRRGGAQPKO-OAHLLOKOSA-N 1 1 334.420 2.782 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611501377 479397338 /nfs/dbraw/zinc/39/73/38/479397338.db2.gz BEPKEJFCLDHYFZ-YPMHNXCESA-N 1 1 339.367 2.612 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@@H]3C[C@H]2C[S@]3=O)o1 ZINC000593689879 479423891 /nfs/dbraw/zinc/42/38/91/479423891.db2.gz YHTXCWYVTSVAFW-RBPJZEGCSA-N 1 1 332.381 2.560 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@@H]3C[C@H]2C[S@]3=O)o1 ZINC000593689879 479423898 /nfs/dbraw/zinc/42/38/98/479423898.db2.gz YHTXCWYVTSVAFW-RBPJZEGCSA-N 1 1 332.381 2.560 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c([N+](=O)[O-])cc1OC ZINC000593695547 479426425 /nfs/dbraw/zinc/42/64/25/479426425.db2.gz QOTICLFVINQBBG-AWEZNQCLSA-N 1 1 328.315 2.843 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@]3(CC3(F)F)C2)c([N+](=O)[O-])cc1OC ZINC000593695547 479426430 /nfs/dbraw/zinc/42/64/30/479426430.db2.gz QOTICLFVINQBBG-AWEZNQCLSA-N 1 1 328.315 2.843 10 5 EFBEMO CCN(C(=O)Nc1ccc([N+](=O)[O-])c2ccncc12)[C@@H]1CC[N@@H+](C)C1 ZINC000599834350 479445803 /nfs/dbraw/zinc/44/58/03/479445803.db2.gz HRXIPJNKLRCKNM-GFCCVEGCSA-N 1 1 343.387 2.701 10 5 EFBEMO O=C1Nc2ccccc2[C@]12CC[N@H+](Cc1csc([N+](=O)[O-])c1)C2 ZINC000614585368 479449257 /nfs/dbraw/zinc/44/92/57/479449257.db2.gz VIKULBHIJITAMW-MRXNPFEDSA-N 1 1 329.381 2.752 10 5 EFBEMO Cc1nc(NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c(C)c(C)[nH+]1 ZINC000588864563 479450360 /nfs/dbraw/zinc/45/03/60/479450360.db2.gz SSZNGSNZWYMWIL-UHFFFAOYSA-N 1 1 325.372 2.868 10 5 EFBEMO CCOC1CC2(C1)CC[N@@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])C2 ZINC000589518530 479537171 /nfs/dbraw/zinc/53/71/71/479537171.db2.gz SNQIIOJSFFGSCI-UHFFFAOYSA-N 1 1 348.399 2.772 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@](C)(OC)CC2)c1 ZINC000589515661 479537306 /nfs/dbraw/zinc/53/73/06/479537306.db2.gz XUCBCNSRWAJCGH-QGZVFWFLSA-N 1 1 336.388 2.772 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](OC3CCC3)C2)c1 ZINC000594021241 479551848 /nfs/dbraw/zinc/55/18/48/479551848.db2.gz PTFFNAFRBLRKCR-MRXNPFEDSA-N 1 1 348.399 2.915 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](OC3CCC3)C2)c1 ZINC000594021241 479551856 /nfs/dbraw/zinc/55/18/56/479551856.db2.gz PTFFNAFRBLRKCR-MRXNPFEDSA-N 1 1 348.399 2.915 10 5 EFBEMO C[N@@H+]1C[C@H]2[C@@H](CCN2Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000590052933 479597310 /nfs/dbraw/zinc/59/73/10/479597310.db2.gz QRWBQCKEUGZGRP-BBRMVZONSA-N 1 1 344.440 2.854 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](CSC)C2)c1 ZINC000590054824 479597393 /nfs/dbraw/zinc/59/73/93/479597393.db2.gz RLADDNCUHQPIQS-LBPRGKRZSA-N 1 1 338.429 2.956 10 5 EFBEMO C[N@H+]1C[C@@H]2CCN(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000590053070 479597743 /nfs/dbraw/zinc/59/77/43/479597743.db2.gz WIWMGAYCIPJWOS-WMLDXEAASA-N 1 1 327.384 2.991 10 5 EFBEMO CN1C[C@@H]2CC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000590053070 479597749 /nfs/dbraw/zinc/59/77/49/479597749.db2.gz WIWMGAYCIPJWOS-WMLDXEAASA-N 1 1 327.384 2.991 10 5 EFBEMO CN1C[C@@H]2CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000590053070 479597754 /nfs/dbraw/zinc/59/77/54/479597754.db2.gz WIWMGAYCIPJWOS-WMLDXEAASA-N 1 1 327.384 2.991 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](Cn2ccnn2)C1 ZINC000597172760 479605075 /nfs/dbraw/zinc/60/50/75/479605075.db2.gz CCBPAYLHHATVRL-IHWMJMDHSA-N 1 1 327.388 2.612 10 5 EFBEMO CO[C@]1(CO)CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000597187540 479612253 /nfs/dbraw/zinc/61/22/53/479612253.db2.gz NONXQCOTIKJOKA-GOSISDBHSA-N 1 1 346.383 2.828 10 5 EFBEMO C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H](C)[C@H]1O ZINC000597204089 479619307 /nfs/dbraw/zinc/61/93/07/479619307.db2.gz DGNXJVNHMRBZNR-MSRIBSCDSA-N 1 1 330.331 2.645 10 5 EFBEMO C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H](C)[C@H]1O ZINC000597204089 479619312 /nfs/dbraw/zinc/61/93/12/479619312.db2.gz DGNXJVNHMRBZNR-MSRIBSCDSA-N 1 1 330.331 2.645 10 5 EFBEMO C[C@H]1C[NH+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H](C)C1O ZINC000597204091 479620342 /nfs/dbraw/zinc/62/03/42/479620342.db2.gz DGNXJVNHMRBZNR-UWVGGRQHSA-N 1 1 330.331 2.645 10 5 EFBEMO CN1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCC1=O ZINC000597214213 479623371 /nfs/dbraw/zinc/62/33/71/479623371.db2.gz NBGJXBCOBDMMQJ-UHFFFAOYSA-N 1 1 345.424 2.987 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC4(COC4)C3)cs2)c1 ZINC000597230625 479633441 /nfs/dbraw/zinc/63/34/41/479633441.db2.gz SLYXTMILSWTNFB-UHFFFAOYSA-N 1 1 331.397 2.941 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC4(COC4)C3)cs2)c1 ZINC000597230625 479633446 /nfs/dbraw/zinc/63/34/46/479633446.db2.gz SLYXTMILSWTNFB-UHFFFAOYSA-N 1 1 331.397 2.941 10 5 EFBEMO COC(=O)c1c(Cl)c(N[C@@H]2CC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000590582826 479662621 /nfs/dbraw/zinc/66/26/21/479662621.db2.gz GETFFEKPFLFMDT-SNVBAGLBSA-N 1 1 341.795 2.929 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC2(CCOCC2)[C@H]1C ZINC000612540321 479688706 /nfs/dbraw/zinc/68/87/06/479688706.db2.gz VMBRQGRMTLGISZ-CQSZACIVSA-N 1 1 347.415 2.733 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC2(CCOCC2)[C@@H]1C ZINC000612540320 479688785 /nfs/dbraw/zinc/68/87/85/479688785.db2.gz VMBRQGRMTLGISZ-AWEZNQCLSA-N 1 1 347.415 2.733 10 5 EFBEMO O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000619252182 479732696 /nfs/dbraw/zinc/73/26/96/479732696.db2.gz GHYRHDULMLOERU-UONOGXRCSA-N 1 1 341.770 2.507 10 5 EFBEMO O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000619253403 479733147 /nfs/dbraw/zinc/73/31/47/479733147.db2.gz WWLWWLZMQOYBAD-QWHCGFSZSA-N 1 1 341.770 2.507 10 5 EFBEMO C[C@H](Nc1ccc([N+](=O)[O-])nc1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000610160282 480245291 /nfs/dbraw/zinc/24/52/91/480245291.db2.gz IYDHTHJUBXSMQV-WMLDXEAASA-N 1 1 342.399 2.691 10 5 EFBEMO C[C@H](Nc1ccc([N+](=O)[O-])nc1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000610160282 480245299 /nfs/dbraw/zinc/24/52/99/480245299.db2.gz IYDHTHJUBXSMQV-WMLDXEAASA-N 1 1 342.399 2.691 10 5 EFBEMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000610446384 480307955 /nfs/dbraw/zinc/30/79/55/480307955.db2.gz WFXZMQVQNOFLCM-CQSZACIVSA-N 1 1 342.399 2.660 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H]2C[NH+]2C[C@H](C)O[C@@H](C)C2)n1 ZINC000614517862 480329838 /nfs/dbraw/zinc/32/98/38/480329838.db2.gz CZNSKXNLKCPOLN-HRCADAONSA-N 1 1 348.447 2.685 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@]3(O)CCCC[C@@H]3C2)c([N+](=O)[O-])cc1F ZINC000184238009 533823930 /nfs/dbraw/zinc/82/39/30/533823930.db2.gz NPLJFSLJKTUJJO-CXAGYDPISA-N 1 1 338.379 2.870 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@]3(O)CCCC[C@@H]3C2)c([N+](=O)[O-])cc1F ZINC000184238009 533823941 /nfs/dbraw/zinc/82/39/41/533823941.db2.gz NPLJFSLJKTUJJO-CXAGYDPISA-N 1 1 338.379 2.870 10 5 EFBEMO C[C@@H]1CC[C@](CO)([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000187990643 534264688 /nfs/dbraw/zinc/26/46/88/534264688.db2.gz KXBKPWCFGWDLQR-PXAZEXFGSA-N 1 1 346.387 2.628 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000131960355 534320140 /nfs/dbraw/zinc/32/01/40/534320140.db2.gz JWNBCBAXBXYBHZ-AWEZNQCLSA-N 1 1 347.802 2.899 10 5 EFBEMO CC(C)(C)Oc1cc(N2CC[C@H]([NH+]3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000152380657 518887281 /nfs/dbraw/zinc/88/72/81/518887281.db2.gz IIEBQBLLBUCUHN-HNNXBMFYSA-N 1 1 349.431 2.683 10 5 EFBEMO CCOc1ccc(C(=O)N(C)C[C@H]2CCC[N@H+]2CC)cc1[N+](=O)[O-] ZINC000176979529 520890851 /nfs/dbraw/zinc/89/08/51/520890851.db2.gz JSQBLQCKKMKKOW-CQSZACIVSA-N 1 1 335.404 2.550 10 5 EFBEMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCc1nccs1 ZINC000121206878 520981251 /nfs/dbraw/zinc/98/12/51/520981251.db2.gz LZOVUPDONQFNPS-UHFFFAOYSA-N 1 1 348.428 2.945 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000177418797 521630008 /nfs/dbraw/zinc/63/00/08/521630008.db2.gz MSLJKSSWPHWULD-XJKSGUPXSA-N 1 1 334.420 2.782 10 5 EFBEMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000179659963 521750756 /nfs/dbraw/zinc/75/07/56/521750756.db2.gz QXQUXXXFXOGRCO-CYBMUJFWSA-N 1 1 335.429 2.627 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000246171292 523318003 /nfs/dbraw/zinc/31/80/03/523318003.db2.gz LIQRCVUOPJDIKM-RDJZCZTQSA-N 1 1 331.416 2.613 10 5 EFBEMO CO[C@@H]1CC[C@@H]2OCC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])[C@H]2C1 ZINC000245754067 523710343 /nfs/dbraw/zinc/71/03/43/523710343.db2.gz HJLCFGJDDBMYIK-ZAEOYNBNSA-N 1 1 332.400 2.876 10 5 EFBEMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])[C@H]2C1 ZINC000245754067 523710355 /nfs/dbraw/zinc/71/03/55/523710355.db2.gz HJLCFGJDDBMYIK-ZAEOYNBNSA-N 1 1 332.400 2.876 10 5 EFBEMO C[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](c2ccco2)C1 ZINC000245573529 524507937 /nfs/dbraw/zinc/50/79/37/524507937.db2.gz CZUOWZAKXKBDAW-UKRRQHHQSA-N 1 1 331.372 2.823 10 5 EFBEMO C[C@H]1C[N@H+]2CCC[C@H]2CN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000245907785 524689720 /nfs/dbraw/zinc/68/97/20/524689720.db2.gz QVBVILFWDRCIQJ-GUYCJALGSA-N 1 1 342.399 2.918 10 5 EFBEMO O=C1[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CCN1Cc1ccc(F)cc1 ZINC000191758476 534830648 /nfs/dbraw/zinc/83/06/48/534830648.db2.gz BJEMGONZBJGHIZ-AWEZNQCLSA-N 1 1 349.387 2.686 10 5 EFBEMO C[C@@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1cn[nH]c1 ZINC000229631258 525517018 /nfs/dbraw/zinc/51/70/18/525517018.db2.gz GKMXOCZFKVISRH-MRVPVSSYSA-N 1 1 325.166 2.931 10 5 EFBEMO O=C(CC1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1)N1CCCC1 ZINC000192994937 526365748 /nfs/dbraw/zinc/36/57/48/526365748.db2.gz DTTTYEYYEGYKFE-UHFFFAOYSA-N 1 1 349.406 2.958 10 5 EFBEMO Cc1nc(C[C@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)no1 ZINC000195518370 526922661 /nfs/dbraw/zinc/92/26/61/526922661.db2.gz IKFAQPQDNYTQRU-CQSZACIVSA-N 1 1 346.387 2.620 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000246225912 527394495 /nfs/dbraw/zinc/39/44/95/527394495.db2.gz FIGDBJOYJPJDGG-AYOQOUSVSA-N 1 1 345.443 2.577 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)c1 ZINC000246225912 527394522 /nfs/dbraw/zinc/39/45/22/527394522.db2.gz FIGDBJOYJPJDGG-AYOQOUSVSA-N 1 1 345.443 2.577 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)c1 ZINC000246225912 527394528 /nfs/dbraw/zinc/39/45/28/527394528.db2.gz FIGDBJOYJPJDGG-AYOQOUSVSA-N 1 1 345.443 2.577 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000183298715 527526772 /nfs/dbraw/zinc/52/67/72/527526772.db2.gz CQVFMCFVLQUZOI-DTXSUPOZSA-N 1 1 343.427 2.941 10 5 EFBEMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@@H]1CCC(=O)N1 ZINC000412074431 535093891 /nfs/dbraw/zinc/09/38/91/535093891.db2.gz JQWXOMDJPMLZPC-LBPRGKRZSA-N 1 1 325.796 2.737 10 5 EFBEMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@@H]1CCC(=O)N1 ZINC000412074431 535093899 /nfs/dbraw/zinc/09/38/99/535093899.db2.gz JQWXOMDJPMLZPC-LBPRGKRZSA-N 1 1 325.796 2.737 10 5 EFBEMO C[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@@H]1c1cccs1 ZINC000357218585 536363900 /nfs/dbraw/zinc/36/39/00/536363900.db2.gz HYTIKJNHGLZUHT-XHDPSFHLSA-N 1 1 348.428 2.797 10 5 EFBEMO COc1cc(C[N@@H+]2CCCN(c3nccs3)CC2)ccc1[N+](=O)[O-] ZINC000351972024 536751154 /nfs/dbraw/zinc/75/11/54/536751154.db2.gz ZCOOTWFSGQPJNU-UHFFFAOYSA-N 1 1 348.428 2.772 10 5 EFBEMO COc1cc(C[N@H+]2CCCN(c3nccs3)CC2)ccc1[N+](=O)[O-] ZINC000351972024 536751158 /nfs/dbraw/zinc/75/11/58/536751158.db2.gz ZCOOTWFSGQPJNU-UHFFFAOYSA-N 1 1 348.428 2.772 10 5 EFBEMO COc1cccc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000342310108 537126541 /nfs/dbraw/zinc/12/65/41/537126541.db2.gz VLLIRHSANMZOCA-GFCCVEGCSA-N 1 1 329.356 2.893 10 5 EFBEMO C[N@@H+]1CCC[C@@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000681996150 549675249 /nfs/dbraw/zinc/67/52/49/549675249.db2.gz JNGNQCCCWFKFDV-CQSZACIVSA-N 1 1 335.407 2.505 10 5 EFBEMO C[N@H+]1CCC[C@@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000681996150 549675253 /nfs/dbraw/zinc/67/52/53/549675253.db2.gz JNGNQCCCWFKFDV-CQSZACIVSA-N 1 1 335.407 2.505 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000754255467 575411543 /nfs/dbraw/zinc/41/15/43/575411543.db2.gz CBLRPHNZUKWQSA-MLFXKNMZSA-N 1 1 329.400 2.693 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(C(=O)/C(C)=C/c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000754414744 575433301 /nfs/dbraw/zinc/43/33/01/575433301.db2.gz KCGQEYHLBLDJHX-XGWPRKDGSA-N 1 1 331.416 2.939 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCO[C@H](C3CCCCC3)C2)cc1 ZINC000755306908 575572907 /nfs/dbraw/zinc/57/29/07/575572907.db2.gz KKPMUFXZYULXBM-MSOLQXFVSA-N 1 1 334.416 2.909 10 5 EFBEMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCO[C@H](C3CCCCC3)C2)cc1 ZINC000755306908 575572908 /nfs/dbraw/zinc/57/29/08/575572908.db2.gz KKPMUFXZYULXBM-MSOLQXFVSA-N 1 1 334.416 2.909 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@@H]4COCC[C@H]43)c2)cc1 ZINC000756892436 575797460 /nfs/dbraw/zinc/79/74/60/575797460.db2.gz WXJDLKHZERHJRO-CRAIPNDOSA-N 1 1 342.399 2.917 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(OCCCO)CC1 ZINC000756907107 575800021 /nfs/dbraw/zinc/80/00/21/575800021.db2.gz IIBOIMPXAPETKZ-UHFFFAOYSA-N 1 1 328.796 2.612 10 5 EFBEMO Cn1c(C(=O)OCCC[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000757955114 575856736 /nfs/dbraw/zinc/85/67/36/575856736.db2.gz ODIMPMMQXCMXGT-UHFFFAOYSA-N 1 1 331.372 2.612 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000761294602 576142001 /nfs/dbraw/zinc/14/20/01/576142001.db2.gz YFVNJAZXWGRXRH-CJNGLKHVSA-N 1 1 330.388 2.711 10 5 EFBEMO CC[N@@H+](CCNc1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-])C(C)C ZINC000726594477 577374835 /nfs/dbraw/zinc/37/48/35/577374835.db2.gz AYGFVXIPPSPYIJ-CLFYSBASSA-N 1 1 335.404 2.923 10 5 EFBEMO COc1cc(F)c([N+](=O)[O-])c(N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c1 ZINC000771240997 581191935 /nfs/dbraw/zinc/19/19/35/581191935.db2.gz UUGUOICBNJKIPV-ZDUSSCGKSA-N 1 1 337.395 2.911 10 5 EFBEMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000771576169 581224396 /nfs/dbraw/zinc/22/43/96/581224396.db2.gz NTABHKWZOUAEHR-LLVKDONJSA-N 1 1 325.796 2.851 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CNC(=S)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000774579675 581494568 /nfs/dbraw/zinc/49/45/68/581494568.db2.gz HKYPCINFYQQZEA-QWHCGFSZSA-N 1 1 336.461 2.604 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CNC(=S)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000774579657 581494576 /nfs/dbraw/zinc/49/45/76/581494576.db2.gz HKYPCINFYQQZEA-CHWSQXEVSA-N 1 1 336.461 2.604 10 5 EFBEMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)C[C@@]2(C)C1 ZINC000823754708 1265424860 /nfs/dbraw/zinc/42/48/60/1265424860.db2.gz GDEVYTPQUSVSKT-IYBDPMFKSA-N 1 1 337.807 2.662 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1scnc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001691009500 1247921015 /nfs/dbraw/zinc/92/10/15/1247921015.db2.gz AFJMKLDNYAKGKU-UHFFFAOYSA-N 1 1 348.428 2.612 10 5 EFBEMO CC[N@H+]1C[C@@H](C)N(C(=O)NCc2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC001687333883 1248260302 /nfs/dbraw/zinc/26/03/02/1248260302.db2.gz NNENIKSJKDYKMW-UONOGXRCSA-N 1 1 334.420 2.527 10 5 EFBEMO [NH3+]C[C@H]1CC2(CO1)CCN(Cc1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000923448262 1261669449 /nfs/dbraw/zinc/66/94/49/1261669449.db2.gz ANSJQWXIFOITMX-CQSZACIVSA-N 1 1 339.823 2.578 10 5 EFBEMO [NH3+]C[C@H]1CC2(CO1)CCN(Cc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC000923450876 1261687547 /nfs/dbraw/zinc/68/75/47/1261687547.db2.gz XUODNUDNXUDLQR-CQSZACIVSA-N 1 1 339.823 2.578 10 5 EFBEMO C[C@H]1CN(Cc2cc([N+](=O)[O-])ccc2Br)CC[C@@H]1C[NH3+] ZINC000923494416 1261779943 /nfs/dbraw/zinc/77/99/43/1261779943.db2.gz WYRJFBOKXSIWFZ-WDEREUQCSA-N 1 1 342.237 2.774 10 5 EFBEMO Cc1[nH+]ccn1CCOC(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000923594127 1263548567 /nfs/dbraw/zinc/54/85/67/1263548567.db2.gz GRVXMSICFLNTJM-UHFFFAOYSA-N 1 1 337.763 2.929 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H]([C@@H](O)C(F)(F)F)C2)ccc1Cl ZINC000825124448 1278420727 /nfs/dbraw/zinc/42/07/27/1278420727.db2.gz QAEYMWYIOSPQPF-JOYOIKCWSA-N 1 1 338.713 2.993 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H]([C@@H](O)C(F)(F)F)C2)ccc1Cl ZINC000825124448 1278420733 /nfs/dbraw/zinc/42/07/33/1278420733.db2.gz QAEYMWYIOSPQPF-JOYOIKCWSA-N 1 1 338.713 2.993 10 5 EFBEMO COC(=O)/C=C/c1ccc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000742412365 1270039193 /nfs/dbraw/zinc/03/91/93/1270039193.db2.gz PUNJFXNVONRXBM-LFHSMUGYSA-N 1 1 333.388 2.676 10 5 EFBEMO 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NKRVSEFJISAIAL-CQSZACIVSA-N 1 1 343.305 2.794 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1COC(=O)[C@H]1CCCC[N@@H+]1CC ZINC000746985247 1277975239 /nfs/dbraw/zinc/97/52/39/1277975239.db2.gz QDTAHPRGFMRGSC-OAHLLOKOSA-N 1 1 336.388 2.911 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1COC(=O)[C@H]1CCCC[N@H+]1CC ZINC000746985247 1277975243 /nfs/dbraw/zinc/97/52/43/1277975243.db2.gz QDTAHPRGFMRGSC-OAHLLOKOSA-N 1 1 336.388 2.911 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CC[C@]4(CC4(F)F)C3)n2)c1 ZINC000844759499 1279226095 /nfs/dbraw/zinc/22/60/95/1279226095.db2.gz ZKWWJQKWCXVYAT-AWEZNQCLSA-N 1 1 335.314 2.542 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@]4(CC4(F)F)C3)n2)c1 ZINC000844759499 1279226105 /nfs/dbraw/zinc/22/61/05/1279226105.db2.gz ZKWWJQKWCXVYAT-AWEZNQCLSA-N 1 1 335.314 2.542 10 5 EFBEMO C[C@@]12CC[N@H+](Cn3cnc(-c4ccc([N+](=O)[O-])cc4)n3)C[C@@H]1C2(F)F ZINC000793532845 1279753304 /nfs/dbraw/zinc/75/33/04/1279753304.db2.gz RUJXPORMWOOEMA-DZGCQCFKSA-N 1 1 349.341 2.788 10 5 EFBEMO C[C@@]12CC[N@@H+](Cn3cnc(-c4ccc([N+](=O)[O-])cc4)n3)C[C@@H]1C2(F)F ZINC000793532845 1279753308 /nfs/dbraw/zinc/75/33/08/1279753308.db2.gz RUJXPORMWOOEMA-DZGCQCFKSA-N 1 1 349.341 2.788 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1C[C@@H]2C[N@@H+](C)CC[C@@H]2C1 ZINC000793936349 1279940694 /nfs/dbraw/zinc/94/06/94/1279940694.db2.gz MHVFWLLIKHNBPG-NEPJUHHUSA-N 1 1 337.807 2.580 10 5 EFBEMO C[C@H]([NH2+]C1CCN([C@@H]2CCOC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872088402 1287425002 /nfs/dbraw/zinc/42/50/02/1287425002.db2.gz NYAWAZARDQZODC-GXTWGEPZSA-N 1 1 337.395 2.638 10 5 EFBEMO C[C@@H](CN(C)CCC[NH+](C)C)N[C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872086006 1287424689 /nfs/dbraw/zinc/42/46/89/1287424689.db2.gz SWIYXGGDHOYJBV-KBPBESRZSA-N 1 1 340.443 2.657 10 5 EFBEMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1 ZINC000846989781 1280675464 /nfs/dbraw/zinc/67/54/64/1280675464.db2.gz USAIIKVCWPXZFW-WCRPCQDQSA-N 1 1 331.416 2.941 10 5 EFBEMO O=C(C[N@H+]1CC[C@H](C2CCCC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001171332913 1281631450 /nfs/dbraw/zinc/63/14/50/1281631450.db2.gz UWAVKBVHQRCUQW-INIZCTEOSA-N 1 1 343.427 2.996 10 5 EFBEMO C[C@H]1OCC[C@H]1[N@H+](CCO)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809997924 1282733569 /nfs/dbraw/zinc/73/35/69/1282733569.db2.gz IZKJEYYXCDKPSE-NOZJJQNGSA-N 1 1 349.214 2.873 10 5 EFBEMO C[C@H]1OCC[C@H]1[N@@H+](CCO)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809997924 1282733578 /nfs/dbraw/zinc/73/35/78/1282733578.db2.gz IZKJEYYXCDKPSE-NOZJJQNGSA-N 1 1 349.214 2.873 10 5 EFBEMO C[C@H]([NH2+]Cc1nccn1CC(F)(F)F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815575257 1287631773 /nfs/dbraw/zinc/63/17/73/1287631773.db2.gz MYAKEJZFTIGSOA-VIFPVBQESA-N 1 1 343.309 2.787 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000810556550 1283337488 /nfs/dbraw/zinc/33/74/88/1283337488.db2.gz PUBOEKFTKFMZAT-MRXNPFEDSA-N 1 1 342.342 2.990 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000810537975 1283359613 /nfs/dbraw/zinc/35/96/13/1283359613.db2.gz PEZOVHBQJAEFJJ-HNNXBMFYSA-N 1 1 327.331 2.885 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCc2c(F)cccc2[N+](=O)[O-])C1 ZINC000811444851 1284320247 /nfs/dbraw/zinc/32/02/47/1284320247.db2.gz MOZMUGPYCZLZKI-INIZCTEOSA-N 1 1 342.342 2.990 10 5 EFBEMO CC(C)[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)[C@@H]1CCOC1 ZINC000812290173 1285025294 /nfs/dbraw/zinc/02/52/94/1285025294.db2.gz AUBJNGQHJDTMTG-QGZVFWFLSA-N 1 1 330.388 2.915 10 5 EFBEMO C[C@@H](COC(=O)[C@H](C)[NH+]1CCC(Cc2ccccc2)CC1)[N+](=O)[O-] ZINC000813101906 1285651814 /nfs/dbraw/zinc/65/18/14/1285651814.db2.gz LFMNCEAHHNWJQY-GJZGRUSLSA-N 1 1 334.416 2.538 10 5 EFBEMO O=C(CC[C@@H]1CCOC1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813170691 1285701320 /nfs/dbraw/zinc/70/13/20/1285701320.db2.gz UOMPPOWTLAZKEG-PBHICJAKSA-N 1 1 348.399 2.529 10 5 EFBEMO O=C(CC[C@@H]1CCOC1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813170691 1285701329 /nfs/dbraw/zinc/70/13/29/1285701329.db2.gz UOMPPOWTLAZKEG-PBHICJAKSA-N 1 1 348.399 2.529 10 5 EFBEMO O=C(C[C@@H]1CCCOC1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172076 1285702448 /nfs/dbraw/zinc/70/24/48/1285702448.db2.gz FUXVWAOLTRCDNU-RDJZCZTQSA-N 1 1 348.399 2.529 10 5 EFBEMO O=C(C[C@@H]1CCCOC1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172076 1285702455 /nfs/dbraw/zinc/70/24/55/1285702455.db2.gz FUXVWAOLTRCDNU-RDJZCZTQSA-N 1 1 348.399 2.529 10 5 EFBEMO CCOCCCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171665 1285703258 /nfs/dbraw/zinc/70/32/58/1285703258.db2.gz PPKGYOUXEBRHGC-INIZCTEOSA-N 1 1 336.388 2.529 10 5 EFBEMO CCOCCCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171665 1285703259 /nfs/dbraw/zinc/70/32/59/1285703259.db2.gz PPKGYOUXEBRHGC-INIZCTEOSA-N 1 1 336.388 2.529 10 5 EFBEMO O=C(COC1CCCC1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172834 1285703264 /nfs/dbraw/zinc/70/32/64/1285703264.db2.gz OMADJOJUAQOYQX-KRWDZBQOSA-N 1 1 348.399 2.672 10 5 EFBEMO O=C(COC1CCCC1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172834 1285703266 /nfs/dbraw/zinc/70/32/66/1285703266.db2.gz OMADJOJUAQOYQX-KRWDZBQOSA-N 1 1 348.399 2.672 10 5 EFBEMO CC[C@H](C)OCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173875 1285703653 /nfs/dbraw/zinc/70/36/53/1285703653.db2.gz LTBQQAMWDODULS-BBRMVZONSA-N 1 1 336.388 2.527 10 5 EFBEMO CC[C@H](C)OCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173875 1285703659 /nfs/dbraw/zinc/70/36/59/1285703659.db2.gz LTBQQAMWDODULS-BBRMVZONSA-N 1 1 336.388 2.527 10 5 EFBEMO O=C(CC[C@@H]1CCCO1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173489 1285705288 /nfs/dbraw/zinc/70/52/88/1285705288.db2.gz COXHMVIABJJWNK-IRXDYDNUSA-N 1 1 348.399 2.672 10 5 EFBEMO O=C(CC[C@@H]1CCCO1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173489 1285705297 /nfs/dbraw/zinc/70/52/97/1285705297.db2.gz COXHMVIABJJWNK-IRXDYDNUSA-N 1 1 348.399 2.672 10 5 EFBEMO CC(C)[N@H+]1CCC[C@H](C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC001179398716 1289122188 /nfs/dbraw/zinc/12/21/88/1289122188.db2.gz MDWGXVWXXGOKJV-GJZGRUSLSA-N 1 1 333.432 2.935 10 5 EFBEMO CCOc1cc(C[N@H+]2CCC[C@H](c3cn(C)nn3)C2)ccc1[N+](=O)[O-] ZINC001176879583 1288158738 /nfs/dbraw/zinc/15/87/38/1288158738.db2.gz LUHLTPQQQURSCN-AWEZNQCLSA-N 1 1 345.403 2.502 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@H]1[C@@H]1CCCO1 ZINC001176927563 1288176181 /nfs/dbraw/zinc/17/61/81/1288176181.db2.gz SVLHFSMTXPKWFE-IRXDYDNUSA-N 1 1 347.415 2.875 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@H]1[C@@H]1CCCO1 ZINC001176927563 1288176183 /nfs/dbraw/zinc/17/61/83/1288176183.db2.gz SVLHFSMTXPKWFE-IRXDYDNUSA-N 1 1 347.415 2.875 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCO1 ZINC001176927564 1288176903 /nfs/dbraw/zinc/17/69/03/1288176903.db2.gz SVLHFSMTXPKWFE-SJORKVTESA-N 1 1 347.415 2.875 10 5 EFBEMO 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CC[N@H+]1CC[C@H](N(C)C(=O)Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000245898116 243169348 /nfs/dbraw/zinc/16/93/48/243169348.db2.gz AEVKNLXWPDJVFK-BBRMVZONSA-N 1 1 333.432 2.634 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000246516499 243264951 /nfs/dbraw/zinc/26/49/51/243264951.db2.gz ULXOBNQEGRNHBK-WMLDXEAASA-N 1 1 348.447 2.509 10 5 EFBEMO COc1cc(CNCc2ccc([C@H](C)[NH3+])cc2)c([N+](=O)[O-])cc1OC ZINC000414808978 244361900 /nfs/dbraw/zinc/36/19/00/244361900.db2.gz LPVBYNVSPDHIIZ-LBPRGKRZSA-N 1 1 345.399 2.922 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](c4nnc[nH]4)C3)o2)cc1 ZINC000425353507 247055188 /nfs/dbraw/zinc/05/51/88/247055188.db2.gz JEOPOROXEFEMBY-CYBMUJFWSA-N 1 1 339.355 2.962 10 5 EFBEMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@@H](c3nnc[nH]3)C2)c1 ZINC000425527495 247122687 /nfs/dbraw/zinc/12/26/87/247122687.db2.gz AOVNETQESDRTJJ-SECBINFHSA-N 1 1 341.293 2.721 10 5 EFBEMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H](c3nnc[nH]3)C2)c1 ZINC000425527495 247122690 /nfs/dbraw/zinc/12/26/90/247122690.db2.gz AOVNETQESDRTJJ-SECBINFHSA-N 1 1 341.293 2.721 10 5 EFBEMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CCN(c2cnccn2)CC1 ZINC000434740289 248185070 /nfs/dbraw/zinc/18/50/70/248185070.db2.gz ZGNAHFOBEJZCOY-UHFFFAOYSA-N 1 1 333.417 2.547 10 5 EFBEMO CNC(=O)[C@H]1CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000092098174 218118495 /nfs/dbraw/zinc/11/84/95/218118495.db2.gz TVLFXQQSNMTOPJ-OAHLLOKOSA-N 1 1 329.356 2.565 10 5 EFBEMO CNC(=O)[C@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000092098174 218118498 /nfs/dbraw/zinc/11/84/98/218118498.db2.gz TVLFXQQSNMTOPJ-OAHLLOKOSA-N 1 1 329.356 2.565 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441198691 250006410 /nfs/dbraw/zinc/00/64/10/250006410.db2.gz NNGAXRSRHLKXIM-CABCVRRESA-N 1 1 347.415 2.590 10 5 EFBEMO COC[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444672515 250325184 /nfs/dbraw/zinc/32/51/84/250325184.db2.gz KEGNNLFGOVSOGA-MRXNPFEDSA-N 1 1 326.356 2.948 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[N@@H+]2CCCC[C@H]2C1 ZINC000094062865 218263429 /nfs/dbraw/zinc/26/34/29/218263429.db2.gz OKTLVOCSRRYQNP-HNNXBMFYSA-N 1 1 331.416 2.830 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000094062865 218263430 /nfs/dbraw/zinc/26/34/30/218263430.db2.gz OKTLVOCSRRYQNP-HNNXBMFYSA-N 1 1 331.416 2.830 10 5 EFBEMO CC(C)[N@@H+](C)CCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445183624 250393777 /nfs/dbraw/zinc/39/37/77/250393777.db2.gz XXAIKFNPPIVIAM-UHFFFAOYSA-N 1 1 337.423 2.751 10 5 EFBEMO CCc1ccc(NC(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000095403812 218338253 /nfs/dbraw/zinc/33/82/53/218338253.db2.gz SDSTWVOFIPWWSY-ZDUSSCGKSA-N 1 1 334.420 2.963 10 5 EFBEMO C[C@H]1OCC[C@H]1[N@@H+](CCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000449676089 251113710 /nfs/dbraw/zinc/11/37/10/251113710.db2.gz FBUAAJAQOURHEB-CXAGYDPISA-N 1 1 346.383 2.827 10 5 EFBEMO COC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000449779408 251152042 /nfs/dbraw/zinc/15/20/42/251152042.db2.gz TZAWCNIHECZEJN-CYBMUJFWSA-N 1 1 336.388 2.710 10 5 EFBEMO Cc1nc(NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)ncc1[N+](=O)[O-] ZINC000450347092 251354528 /nfs/dbraw/zinc/35/45/28/251354528.db2.gz GVMNLPBMUGPTGP-IUODEOHRSA-N 1 1 347.444 2.672 10 5 EFBEMO CN(C(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000268631375 252084670 /nfs/dbraw/zinc/08/46/70/252084670.db2.gz ZYWZXTHXEADBCS-SFHVURJKSA-N 1 1 339.395 2.941 10 5 EFBEMO COc1ccc(OCC[N@@H+](C(C)C)C2CCOCC2)c([N+](=O)[O-])c1 ZINC000173517491 533012741 /nfs/dbraw/zinc/01/27/41/533012741.db2.gz FGEPUDUVCCBWJU-UHFFFAOYSA-N 1 1 338.404 2.872 10 5 EFBEMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000119812844 221407253 /nfs/dbraw/zinc/40/72/53/221407253.db2.gz OTUADTOBPBEKQR-ZDUSSCGKSA-N 1 1 344.415 2.784 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(Cc2[nH+]ccn2C)CC1 ZINC000162701002 141371370 /nfs/dbraw/zinc/37/13/70/141371370.db2.gz SRILDOKAHWACAD-UHFFFAOYSA-N 1 1 342.399 2.732 10 5 EFBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@H]1CCCO1 ZINC000245383356 141382988 /nfs/dbraw/zinc/38/29/88/141382988.db2.gz OXEOIULBVYCFPY-SMDDNHRTSA-N 1 1 332.360 2.817 10 5 EFBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@H]1CCCO1 ZINC000245383356 141382989 /nfs/dbraw/zinc/38/29/89/141382989.db2.gz OXEOIULBVYCFPY-SMDDNHRTSA-N 1 1 332.360 2.817 10 5 EFBEMO CC(C)[N@@H+](C)CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000356804910 147340340 /nfs/dbraw/zinc/34/03/40/147340340.db2.gz JEMYSWMBXMXXBK-UHFFFAOYSA-N 1 1 330.182 2.636 10 5 EFBEMO Cc1sc(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000344626534 142051491 /nfs/dbraw/zinc/05/14/91/142051491.db2.gz YJFIRLVYNPVBDK-ZDUSSCGKSA-N 1 1 325.434 2.815 10 5 EFBEMO O=C(NC[C@H]1CCCC[N@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000346145113 142154637 /nfs/dbraw/zinc/15/46/37/142154637.db2.gz KIAVUBZIFYHFIW-OAHLLOKOSA-N 1 1 342.399 2.707 10 5 EFBEMO C[N@@H+](CCNc1ncnc2cccc([N+](=O)[O-])c21)C1CCCCC1 ZINC000347436780 142216324 /nfs/dbraw/zinc/21/63/24/142216324.db2.gz VBNZAWGFFBABBS-UHFFFAOYSA-N 1 1 329.404 2.636 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNc1ncnc2cccc([N+](=O)[O-])c21 ZINC000347451058 142218804 /nfs/dbraw/zinc/21/88/04/142218804.db2.gz PUEWDOAOSKCGBA-BETUJISGSA-N 1 1 329.404 2.635 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCc1ccc3c(c1)CCO3)CC2 ZINC000347793371 142272582 /nfs/dbraw/zinc/27/25/82/142272582.db2.gz XCNSXQFUMRDXFK-UHFFFAOYSA-N 1 1 325.368 2.526 10 5 EFBEMO C[C@H](C(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000347843172 142280723 /nfs/dbraw/zinc/28/07/23/142280723.db2.gz JGOYOVXUMBHEGG-SMDDNHRTSA-N 1 1 335.379 2.533 10 5 EFBEMO Cc1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc(C)c1O ZINC000347865865 142284460 /nfs/dbraw/zinc/28/44/60/142284460.db2.gz ZWWFMCNAFASZNS-OAHLLOKOSA-N 1 1 342.399 2.999 10 5 EFBEMO C[C@H]1c2ccccc2C[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000343601582 145249473 /nfs/dbraw/zinc/24/94/73/145249473.db2.gz HCIBNLAPGAOEIH-DZGCQCFKSA-N 1 1 328.368 2.911 10 5 EFBEMO C[C@H]1c2ccccc2C[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000343601582 145249474 /nfs/dbraw/zinc/24/94/74/145249474.db2.gz HCIBNLAPGAOEIH-DZGCQCFKSA-N 1 1 328.368 2.911 10 5 EFBEMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000350686591 146080919 /nfs/dbraw/zinc/08/09/19/146080919.db2.gz XOVARLSFFSZLQK-KRWDZBQOSA-N 1 1 330.388 2.809 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H](CO)c3ccc(Cl)cc3)nc2c1 ZINC000351948932 146245703 /nfs/dbraw/zinc/24/57/03/146245703.db2.gz JTXHHUIFEKDFKQ-HNNXBMFYSA-N 1 1 346.774 2.948 10 5 EFBEMO Cc1sc(C(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000352871822 146336395 /nfs/dbraw/zinc/33/63/95/146336395.db2.gz CBPVZXSVGHSDMV-UHFFFAOYSA-N 1 1 345.424 2.921 10 5 EFBEMO C[C@@H]1C[C@H](C)[C@H](C)[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000355791895 147065259 /nfs/dbraw/zinc/06/52/59/147065259.db2.gz XYTFJAUZVKAGKX-WOPDTQHZSA-N 1 1 349.387 2.628 10 5 EFBEMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000355791895 147065261 /nfs/dbraw/zinc/06/52/61/147065261.db2.gz XYTFJAUZVKAGKX-WOPDTQHZSA-N 1 1 349.387 2.628 10 5 EFBEMO C[C@@H]1CC[C@@]2(CC[N@@H+](C[C@H](O)COc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000359540598 148116179 /nfs/dbraw/zinc/11/61/79/148116179.db2.gz CNRODHMHJWPBLD-UWWQBHOKSA-N 1 1 334.416 2.847 10 5 EFBEMO C[C@H]1CC[C@@]2(CC[N@@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C2)C1 ZINC000359555928 148120939 /nfs/dbraw/zinc/12/09/39/148120939.db2.gz LFMJNSMLRVYNEI-IFXJQAMLSA-N 1 1 343.427 2.996 10 5 EFBEMO C[C@@H]1CC[C@@]2(CC[N@@H+](CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)C2)C1 ZINC000359563502 148124608 /nfs/dbraw/zinc/12/46/08/148124608.db2.gz SPECMNDMJPOQPG-AUUYWEPGSA-N 1 1 343.427 2.996 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N(C)CC[C@H]2CCCC[N@H+]2C)c1 ZINC000360115957 148275969 /nfs/dbraw/zinc/27/59/69/148275969.db2.gz FXHFGJIOIIOYOC-CQSZACIVSA-N 1 1 335.404 2.692 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000360341983 148335867 /nfs/dbraw/zinc/33/58/67/148335867.db2.gz HNUCXUIARDBWEN-MRXNPFEDSA-N 1 1 327.384 2.933 10 5 EFBEMO Nc1nccc([C@H]2CCC[N@@H+](CC=Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC000368046101 150019357 /nfs/dbraw/zinc/01/93/57/150019357.db2.gz XJKKPNNUIXAKHQ-VFQAQYNWSA-N 1 1 339.399 2.690 10 5 EFBEMO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCc3[nH]cnc3C2)cc1[N+](=O)[O-] ZINC000368102910 150038517 /nfs/dbraw/zinc/03/85/17/150038517.db2.gz QRDHMUAJKIXCGT-DGCLKSJQSA-N 1 1 330.388 2.925 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(CCN2CCOCC2)CC1 ZINC000368211504 150066874 /nfs/dbraw/zinc/06/68/74/150066874.db2.gz GSGRZWPYSXXHAO-UHFFFAOYSA-N 1 1 347.459 2.838 10 5 EFBEMO COCC[C@@H]1CCCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000368656640 150172457 /nfs/dbraw/zinc/17/24/57/150172457.db2.gz ZJRSTMMSZACZJD-HNNXBMFYSA-N 1 1 349.431 2.696 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000373911898 151248062 /nfs/dbraw/zinc/24/80/62/151248062.db2.gz SSCZVLZMMYTJFW-AWEZNQCLSA-N 1 1 342.355 2.963 10 5 EFBEMO CSc1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000123115198 222218872 /nfs/dbraw/zinc/21/88/72/222218872.db2.gz GHLJXRPZVJUPOA-WCQYABFASA-N 1 1 337.445 2.871 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000123853327 222341580 /nfs/dbraw/zinc/34/15/80/222341580.db2.gz LKIUJNGLRQGUNA-NEPJUHHUSA-N 1 1 337.445 2.871 10 5 EFBEMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1F ZINC000181338875 544932444 /nfs/dbraw/zinc/93/24/44/544932444.db2.gz CHRCFVYRULYKKT-NSHDSACASA-N 1 1 331.347 2.992 10 5 EFBEMO C[C@@H]1C(=O)NCCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000189076323 265171373 /nfs/dbraw/zinc/17/13/73/265171373.db2.gz UJQAFSMWXJAJQN-GFCCVEGCSA-N 1 1 329.356 2.565 10 5 EFBEMO C[C@@H]1C(=O)NCCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000189076323 265171376 /nfs/dbraw/zinc/17/13/76/265171376.db2.gz UJQAFSMWXJAJQN-GFCCVEGCSA-N 1 1 329.356 2.565 10 5 EFBEMO CO[C@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[C@H]1C ZINC000189264458 265181342 /nfs/dbraw/zinc/18/13/42/265181342.db2.gz DBGDHDGMYYAXIA-RISCZKNCSA-N 1 1 332.360 2.502 10 5 EFBEMO CO[C@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[C@H]1C ZINC000189264458 265181345 /nfs/dbraw/zinc/18/13/45/265181345.db2.gz DBGDHDGMYYAXIA-RISCZKNCSA-N 1 1 332.360 2.502 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1ccc(C)o1 ZINC000193637394 265338111 /nfs/dbraw/zinc/33/81/11/265338111.db2.gz JAJHCEVGLBQWBK-LLVKDONJSA-N 1 1 333.344 2.794 10 5 EFBEMO CC[C@@H](NC(=O)NCC1=CC[N@@H+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271944512 266103486 /nfs/dbraw/zinc/10/34/86/266103486.db2.gz XDSROJGMVMSKST-MRXNPFEDSA-N 1 1 332.404 2.607 10 5 EFBEMO C[C@H]1C[C@H](N(C)C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000272158175 266171283 /nfs/dbraw/zinc/17/12/83/266171283.db2.gz DQWIPVKBHMVYGZ-SMDDNHRTSA-N 1 1 341.358 2.628 10 5 EFBEMO C[N@@H+](CCO)C1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000272179822 266178795 /nfs/dbraw/zinc/17/87/95/266178795.db2.gz IUDIBRNDJMEYOA-UHFFFAOYSA-N 1 1 347.337 2.507 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000272324076 266229936 /nfs/dbraw/zinc/22/99/36/266229936.db2.gz LPPKSHIEMZCTFT-GDBMZVCRSA-N 1 1 349.431 2.571 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000272324076 266229940 /nfs/dbraw/zinc/22/99/40/266229940.db2.gz LPPKSHIEMZCTFT-GDBMZVCRSA-N 1 1 349.431 2.571 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[NH+](C(C)C)CC1 ZINC000276579122 267017157 /nfs/dbraw/zinc/01/71/57/267017157.db2.gz LLQFDTQZCSTDBS-UHFFFAOYSA-N 1 1 325.796 2.723 10 5 EFBEMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000277556840 267197038 /nfs/dbraw/zinc/19/70/38/267197038.db2.gz OWJVCGKKGQOBKK-CQSZACIVSA-N 1 1 342.399 2.823 10 5 EFBEMO C[C@H]1C[N@@H+](CCCNc2ncc(Cl)cc2[N+](=O)[O-])CCCO1 ZINC000277579104 267203082 /nfs/dbraw/zinc/20/30/82/267203082.db2.gz BRWRZERBQVYHKS-NSHDSACASA-N 1 1 328.800 2.556 10 5 EFBEMO NC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000271237039 273102699 /nfs/dbraw/zinc/10/26/99/273102699.db2.gz BFCJDHGEJDKKRP-LLVKDONJSA-N 1 1 346.412 2.566 10 5 EFBEMO COCC[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCOC1 ZINC000339137555 274024985 /nfs/dbraw/zinc/02/49/85/274024985.db2.gz UXTVRRYLRBIVQC-CYBMUJFWSA-N 1 1 348.321 2.851 10 5 EFBEMO COCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCOC1 ZINC000339137555 274024986 /nfs/dbraw/zinc/02/49/86/274024986.db2.gz UXTVRRYLRBIVQC-CYBMUJFWSA-N 1 1 348.321 2.851 10 5 EFBEMO CS(=O)(=O)C1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCCC1 ZINC000285636034 274042761 /nfs/dbraw/zinc/04/27/61/274042761.db2.gz YZVSCCDGUJUMLB-UHFFFAOYSA-N 1 1 346.836 2.695 10 5 EFBEMO O=[N+]([O-])c1cnc(N[C@H]2CCc3[nH+]c[nH]c3C2)c(C(F)(F)F)c1 ZINC000413310981 275041686 /nfs/dbraw/zinc/04/16/86/275041686.db2.gz OECUBPRMXXYAPK-ZETCQYMHSA-N 1 1 327.266 2.701 10 5 EFBEMO O=[N+]([O-])c1cnc(N[C@H]2CCc3[nH]c[nH+]c3C2)c(C(F)(F)F)c1 ZINC000413310981 275041687 /nfs/dbraw/zinc/04/16/87/275041687.db2.gz OECUBPRMXXYAPK-ZETCQYMHSA-N 1 1 327.266 2.701 10 5 EFBEMO CC[N@@H+]1CCO[C@@H](C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000356729785 276390671 /nfs/dbraw/zinc/39/06/71/276390671.db2.gz GNUPJBKUBFCURJ-OAHLLOKOSA-N 1 1 335.404 2.552 10 5 EFBEMO CC[N@H+]1CCO[C@@H](C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000356729785 276390673 /nfs/dbraw/zinc/39/06/73/276390673.db2.gz GNUPJBKUBFCURJ-OAHLLOKOSA-N 1 1 335.404 2.552 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000180183988 277137284 /nfs/dbraw/zinc/13/72/84/277137284.db2.gz MAPZNPMBEHBYRN-SJORKVTESA-N 1 1 325.368 2.770 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000248040771 277169026 /nfs/dbraw/zinc/16/90/26/277169026.db2.gz MAPZNPMBEHBYRN-DLBZAZTESA-N 1 1 325.368 2.770 10 5 EFBEMO CC(C)c1ccc(C[N@H+]2C[C@@H](C)[C@@H](N3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000180230805 278036708 /nfs/dbraw/zinc/03/67/08/278036708.db2.gz SUIDUBCXRVWDFZ-BEFAXECRSA-N 1 1 347.459 2.871 10 5 EFBEMO C[N@H+]1CCO[C@@H]2CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])C[C@@H]21 ZINC000408027667 290087183 /nfs/dbraw/zinc/08/71/83/290087183.db2.gz ORLDTUJZRFRGCL-QWHCGFSZSA-N 1 1 346.214 2.811 10 5 EFBEMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000130229762 293158428 /nfs/dbraw/zinc/15/84/28/293158428.db2.gz WKYMSTLYNSCRCY-LLVKDONJSA-N 1 1 341.371 2.647 10 5 EFBEMO CC[N@H+]1CCC[C@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C1 ZINC000134069841 293276532 /nfs/dbraw/zinc/27/65/32/293276532.db2.gz CKTBOBXHRFYGKY-HNNXBMFYSA-N 1 1 346.431 2.753 10 5 EFBEMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000290696506 294160436 /nfs/dbraw/zinc/16/04/36/294160436.db2.gz VLTRHKCXTRVALJ-GFCCVEGCSA-N 1 1 332.404 2.926 10 5 EFBEMO C[C@@]1(F)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000295285742 295293176 /nfs/dbraw/zinc/29/31/76/295293176.db2.gz DHPCPCGPLDOBBI-OAHLLOKOSA-N 1 1 327.331 2.887 10 5 EFBEMO COC(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)nc1 ZINC000299105740 311051210 /nfs/dbraw/zinc/05/12/10/311051210.db2.gz VBYWGNUTZOKPNY-LBPRGKRZSA-N 1 1 329.356 2.936 10 5 EFBEMO NC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCC[N@H+](C2CCCCC2)C1 ZINC000301166756 311122345 /nfs/dbraw/zinc/12/23/45/311122345.db2.gz DYHWOZCTKYMDOG-CYBMUJFWSA-N 1 1 346.431 2.903 10 5 EFBEMO COc1cc(F)c([N+](=O)[O-])c(NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000301345076 311132332 /nfs/dbraw/zinc/13/23/32/311132332.db2.gz KCFQCIDMMAZLLB-TXEJJXNPSA-N 1 1 341.383 2.654 10 5 EFBEMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ncc([N+](=O)[O-])c(N)n2)cc1 ZINC000301562332 311144613 /nfs/dbraw/zinc/14/46/13/311144613.db2.gz VAAUGGLDGBHHKF-SNVBAGLBSA-N 1 1 339.359 2.634 10 5 EFBEMO COc1cc(NC[C@H]2C[N@@H+](CC(C)C)CCO2)c([N+](=O)[O-])cc1F ZINC000301608694 311147478 /nfs/dbraw/zinc/14/74/78/311147478.db2.gz ACTHVJQKIVHNGX-LBPRGKRZSA-N 1 1 341.383 2.511 10 5 EFBEMO O=[N+]([O-])c1ccc(N2C[C@H]3OCC[N@H+](Cc4ccccc4)[C@@H]3C2)cc1 ZINC000301625647 311148354 /nfs/dbraw/zinc/14/83/54/311148354.db2.gz HDHQVXYOEYFUBJ-RTBURBONSA-N 1 1 339.395 2.684 10 5 EFBEMO O=[N+]([O-])c1ccc(N2C[C@H]3OCC[N@@H+](Cc4ccccc4)[C@@H]3C2)cc1 ZINC000301625647 311148356 /nfs/dbraw/zinc/14/83/56/311148356.db2.gz HDHQVXYOEYFUBJ-RTBURBONSA-N 1 1 339.395 2.684 10 5 EFBEMO COc1cc(N2CCC[C@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1F ZINC000301715303 311154159 /nfs/dbraw/zinc/15/41/59/311154159.db2.gz MPASHSPIIKSICL-GFCCVEGCSA-N 1 1 348.378 2.935 10 5 EFBEMO Cc1ccc(N2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c([N+](=O)[O-])c1 ZINC000301878594 311164296 /nfs/dbraw/zinc/16/42/96/311164296.db2.gz ZBKUQEUDTNGFGV-SJPCQFCGSA-N 1 1 344.459 2.650 10 5 EFBEMO C[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000301981401 311170099 /nfs/dbraw/zinc/17/00/99/311170099.db2.gz BASGEPGJCRYZFU-CYBMUJFWSA-N 1 1 340.387 2.570 10 5 EFBEMO C[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000301981403 311170139 /nfs/dbraw/zinc/17/01/39/311170139.db2.gz BASGEPGJCRYZFU-ZDUSSCGKSA-N 1 1 340.387 2.570 10 5 EFBEMO COCC[N@H+]1CCN(c2cc(C)nc3c2cccc3[N+](=O)[O-])C[C@H]1C ZINC000301979726 311170232 /nfs/dbraw/zinc/17/02/32/311170232.db2.gz AJWJHKUCFRIZRY-CQSZACIVSA-N 1 1 344.415 2.608 10 5 EFBEMO CCCC[N@H+]1CCCC[C@@H]1CNc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000302002993 311171317 /nfs/dbraw/zinc/17/13/17/311171317.db2.gz REKOGGIBOZSPTO-CYBMUJFWSA-N 1 1 332.408 2.704 10 5 EFBEMO Cc1cc(NC[C@@H](C)[N@@H+]2CCOC[C@@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000302003724 311171440 /nfs/dbraw/zinc/17/14/40/311171440.db2.gz JZRZCMUTBQAINZ-KGLIPLIRSA-N 1 1 344.415 2.973 10 5 EFBEMO Cc1cc(NC[C@@H](C)[N@H+]2CCOC[C@@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000302003724 311171442 /nfs/dbraw/zinc/17/14/42/311171442.db2.gz JZRZCMUTBQAINZ-KGLIPLIRSA-N 1 1 344.415 2.973 10 5 EFBEMO Cc1cc(NC[C@H](C)[NH+]2CCOCC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302015224 311172251 /nfs/dbraw/zinc/17/22/51/311172251.db2.gz LLZXJXAJRHTLEU-ZDUSSCGKSA-N 1 1 330.388 2.584 10 5 EFBEMO Cc1cccc(N2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c1[N+](=O)[O-] ZINC000302499640 311191700 /nfs/dbraw/zinc/19/17/00/311191700.db2.gz ODNNNMFNFZXJBE-SJPCQFCGSA-N 1 1 344.459 2.650 10 5 EFBEMO COCC[N@@H+]1CCN(c2c(C)cc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000302672489 311196029 /nfs/dbraw/zinc/19/60/29/311196029.db2.gz LCKRXVPVAQZKSK-LBPRGKRZSA-N 1 1 327.812 2.714 10 5 EFBEMO COCC[N@H+]1CCN(c2c(C)cc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000302672489 311196031 /nfs/dbraw/zinc/19/60/31/311196031.db2.gz LCKRXVPVAQZKSK-LBPRGKRZSA-N 1 1 327.812 2.714 10 5 EFBEMO O=[N+]([O-])c1ccc(F)cc1N1CC[NH+](CCOc2ccccc2)CC1 ZINC000302854158 311204178 /nfs/dbraw/zinc/20/41/78/311204178.db2.gz KCRGZWVDYYOXLT-UHFFFAOYSA-N 1 1 345.374 2.935 10 5 EFBEMO CC(C)(C[NH+]1CCOCC1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000308668480 311228184 /nfs/dbraw/zinc/22/81/84/311228184.db2.gz REKLJSDRTMMAOE-UHFFFAOYSA-N 1 1 330.388 2.666 10 5 EFBEMO CC[NH+](CC)[C@H](C)CN[C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000475330866 313221685 /nfs/dbraw/zinc/22/16/85/313221685.db2.gz DMQHSRHRUIJLQT-UONOGXRCSA-N 1 1 336.436 2.632 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2CC[C@@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000475714853 313224968 /nfs/dbraw/zinc/22/49/68/313224968.db2.gz JUZNCAAYHRFYMF-CQSZACIVSA-N 1 1 336.388 2.625 10 5 EFBEMO Cc1ccc([C@@H](C)NC(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000493253042 314292525 /nfs/dbraw/zinc/29/25/25/314292525.db2.gz JGDWRGKDYAHDEK-CJNGLKHVSA-N 1 1 346.431 2.842 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(c2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)C[C@@H]1C ZINC000497515961 315393116 /nfs/dbraw/zinc/39/31/16/315393116.db2.gz PZAKNGRVWNYNDK-STQMWFEESA-N 1 1 335.404 2.609 10 5 EFBEMO C[NH+](C)Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cn2)cc1Cl ZINC000527021428 316322416 /nfs/dbraw/zinc/32/24/16/316322416.db2.gz KCTOXORLEVTJJZ-UHFFFAOYSA-N 1 1 334.763 2.957 10 5 EFBEMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cn2)C1 ZINC000531627859 317293478 /nfs/dbraw/zinc/29/34/78/317293478.db2.gz RAAUUWVIBPZGQM-ZDUSSCGKSA-N 1 1 334.420 2.620 10 5 EFBEMO CCCC[N@@H+](C)CC1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC1 ZINC000531888493 317328075 /nfs/dbraw/zinc/32/80/75/317328075.db2.gz CAOWXBCPHREDNT-UHFFFAOYSA-N 1 1 334.420 2.574 10 5 EFBEMO C[C@@H](CCNC(=O)c1ccc([N+](=O)[O-])cn1)[N@@H+](C)Cc1ccccc1 ZINC000532141865 317362051 /nfs/dbraw/zinc/36/20/51/317362051.db2.gz XNEJPLGSYQTGJC-AWEZNQCLSA-N 1 1 342.399 2.630 10 5 EFBEMO C[C@H](NC(=O)Cn1c[nH+]c2c1CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000541775630 317789891 /nfs/dbraw/zinc/78/98/91/317789891.db2.gz ZSYHZPUAFIHTBS-LBPRGKRZSA-N 1 1 328.372 2.548 10 5 EFBEMO COC(=O)c1ccccc1CC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000547833743 318046822 /nfs/dbraw/zinc/04/68/22/318046822.db2.gz IACAHMSBOXGFDM-UHFFFAOYSA-N 1 1 340.379 2.982 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](OC(F)F)C1 ZINC000555073842 318344646 /nfs/dbraw/zinc/34/46/46/318344646.db2.gz TYEGUOCCJSTXAU-LBPRGKRZSA-N 1 1 343.330 2.545 10 5 EFBEMO Cc1ccccc1C[C@@H](C)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000556056524 318377092 /nfs/dbraw/zinc/37/70/92/318377092.db2.gz RASWRNVXXMENDG-OAHLLOKOSA-N 1 1 329.400 2.628 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC3(C2)Oc2ccccc2O3)c1 ZINC000565797997 319003522 /nfs/dbraw/zinc/00/35/22/319003522.db2.gz IUJODZQSESZRGL-UHFFFAOYSA-N 1 1 342.351 2.847 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC3(C2)Oc2ccccc2O3)c1 ZINC000565797997 319003525 /nfs/dbraw/zinc/00/35/25/319003525.db2.gz IUJODZQSESZRGL-UHFFFAOYSA-N 1 1 342.351 2.847 10 5 EFBEMO C[N@@H+]1CCO[C@@H](CSCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000566214956 319047583 /nfs/dbraw/zinc/04/75/83/319047583.db2.gz ZXMVBBMYEHNJSG-OAHLLOKOSA-N 1 1 349.412 2.814 10 5 EFBEMO C[N@H+]1CCO[C@@H](CSCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000566214956 319047586 /nfs/dbraw/zinc/04/75/86/319047586.db2.gz ZXMVBBMYEHNJSG-OAHLLOKOSA-N 1 1 349.412 2.814 10 5 EFBEMO CCc1nc(NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)cc(C)[nH+]1 ZINC000569523796 319388082 /nfs/dbraw/zinc/38/80/82/319388082.db2.gz GAUWBJBFQGNTKW-UHFFFAOYSA-N 1 1 325.372 2.813 10 5 EFBEMO CCc1nc(C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])cs1 ZINC000576272157 320000391 /nfs/dbraw/zinc/00/03/91/320000391.db2.gz RQLPFJGGDLBUJK-UHFFFAOYSA-N 1 1 334.401 2.732 10 5 EFBEMO COC[C@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000181672689 323243456 /nfs/dbraw/zinc/24/34/56/323243456.db2.gz BQHWJQCUMUTWSN-KRWDZBQOSA-N 1 1 343.383 2.819 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000183301073 323328425 /nfs/dbraw/zinc/32/84/25/323328425.db2.gz INBGFUDPARHABL-JTDSTZFVSA-N 1 1 347.459 2.977 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H]1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000183301073 323328429 /nfs/dbraw/zinc/32/84/29/323328429.db2.gz INBGFUDPARHABL-JTDSTZFVSA-N 1 1 347.459 2.977 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H]1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000183301073 323328434 /nfs/dbraw/zinc/32/84/34/323328434.db2.gz INBGFUDPARHABL-JTDSTZFVSA-N 1 1 347.459 2.977 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)CC(C)(C)CN1CCOCC1 ZINC000183381361 323332696 /nfs/dbraw/zinc/33/26/96/323332696.db2.gz NONJEPXDARRAKP-UHFFFAOYSA-N 1 1 335.448 2.693 10 5 EFBEMO C[C@H](C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000184199735 323358754 /nfs/dbraw/zinc/35/87/54/323358754.db2.gz IUUYYJKWGQFDOS-FRRDWIJNSA-N 1 1 337.395 2.779 10 5 EFBEMO C[C@H](C(=O)NCC[N@H+]1CCCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000185003427 323379923 /nfs/dbraw/zinc/37/99/23/323379923.db2.gz USIROKGOBDTJSC-STQMWFEESA-N 1 1 337.395 2.828 10 5 EFBEMO CCOc1cc(CSC[C@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-] ZINC000581190030 324324495 /nfs/dbraw/zinc/32/44/95/324324495.db2.gz 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Cc1nn(C)c(C)c1NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000340911173 474771889 /nfs/dbraw/zinc/77/18/89/474771889.db2.gz KWJYTPRKZHTJAY-JQWIXIFHSA-N 1 1 345.403 2.623 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@H](c3nc(C4CC4)no3)C2)cc1[N+](=O)[O-] ZINC000344849532 474800555 /nfs/dbraw/zinc/80/05/55/474800555.db2.gz DNNZTDAVLWGXRU-ZDUSSCGKSA-N 1 1 344.371 2.853 10 5 EFBEMO Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000338999682 474819724 /nfs/dbraw/zinc/81/97/24/474819724.db2.gz IZXPMFYTDUXCSC-LQDVMPOASA-N 1 1 342.399 2.945 10 5 EFBEMO CC(C)n1cnnc1[C@H]1CCC[N@@H+](Cc2cc([O-])ccc2[N+](=O)[O-])C1 ZINC000339040239 474866464 /nfs/dbraw/zinc/86/64/64/474866464.db2.gz DQRCIGBAZCQQHG-ZDUSSCGKSA-N 1 1 345.403 2.852 10 5 EFBEMO CCC[N@@H+](C)C[C@H]1CCN(c2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000268230131 474874287 /nfs/dbraw/zinc/87/42/87/474874287.db2.gz VCBWBDROGAJSGJ-GFCCVEGCSA-N 1 1 325.384 2.911 10 5 EFBEMO CCC[N@@H+](C)C[C@@H]1CCN(c2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000268230133 474874955 /nfs/dbraw/zinc/87/49/55/474874955.db2.gz VCBWBDROGAJSGJ-LBPRGKRZSA-N 1 1 325.384 2.911 10 5 EFBEMO CC[C@@H](NC(=O)N1CC[C@]2(CC[N@@H+](C)C2)C1)c1cccc([N+](=O)[O-])c1 ZINC000293229802 474878450 /nfs/dbraw/zinc/87/84/50/474878450.db2.gz FVSRFDNKSDOPDE-AEFFLSMTSA-N 1 1 346.431 2.783 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255615386 474880965 /nfs/dbraw/zinc/88/09/65/474880965.db2.gz AZWDLXKMQPSZLK-BXYJRTLCSA-N 1 1 329.400 2.693 10 5 EFBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000292232214 474917233 /nfs/dbraw/zinc/91/72/33/474917233.db2.gz VYKKGTHJTMYNFU-SFHVURJKSA-N 1 1 333.432 2.910 10 5 EFBEMO O=C(CC[N@H+](CCO)CC1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000337355607 474931184 /nfs/dbraw/zinc/93/11/84/474931184.db2.gz BZEQILKWQGZOJL-UHFFFAOYSA-N 1 1 349.431 2.798 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000341124322 475001363 /nfs/dbraw/zinc/00/13/63/475001363.db2.gz VITLENZRJLTCAR-OKILXGFUSA-N 1 1 334.420 2.657 10 5 EFBEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000341402512 475047106 /nfs/dbraw/zinc/04/71/06/475047106.db2.gz MOICIGZVPALQFI-GASCZTMLSA-N 1 1 348.447 2.999 10 5 EFBEMO Cn1cc(C[N@H+]2CCOCC3(CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000341537444 475125698 /nfs/dbraw/zinc/12/56/98/475125698.db2.gz VGTBZFLEVRBYJD-UHFFFAOYSA-N 1 1 342.399 2.608 10 5 EFBEMO CCC[N@H+]1CCC[C@H]1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000352378866 475233283 /nfs/dbraw/zinc/23/32/83/475233283.db2.gz MUZZLORCOSJQHQ-INIZCTEOSA-N 1 1 348.447 2.696 10 5 EFBEMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000352400662 475258299 /nfs/dbraw/zinc/25/82/99/475258299.db2.gz SLNVQQKDDIRKNU-OAHLLOKOSA-N 1 1 349.431 2.732 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN(Cc2nccn2C)CC1 ZINC000352406506 475263184 /nfs/dbraw/zinc/26/31/84/475263184.db2.gz QENRUPGQBCMKAZ-OAHLLOKOSA-N 1 1 343.431 2.516 10 5 EFBEMO COc1ccc([C@H](CO)[N@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000352415315 475272433 /nfs/dbraw/zinc/27/24/33/475272433.db2.gz AKEIMDITVZFBSL-KRWDZBQOSA-N 1 1 346.383 2.777 10 5 EFBEMO COc1ccc([C@H](CO)[N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000352415315 475272437 /nfs/dbraw/zinc/27/24/37/475272437.db2.gz AKEIMDITVZFBSL-KRWDZBQOSA-N 1 1 346.383 2.777 10 5 EFBEMO CC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC1 ZINC000361230453 475288134 /nfs/dbraw/zinc/28/81/34/475288134.db2.gz UITZOPRHRVVEHI-MRXNPFEDSA-N 1 1 330.388 2.606 10 5 EFBEMO CC[N@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])[C@H]1CCOC1 ZINC000361239502 475295755 /nfs/dbraw/zinc/29/57/55/475295755.db2.gz VASVBSRFPBVLNJ-NSHDSACASA-N 1 1 346.330 2.816 10 5 EFBEMO CC[N@@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])[C@H]1CCOC1 ZINC000361239502 475295757 /nfs/dbraw/zinc/29/57/57/475295757.db2.gz VASVBSRFPBVLNJ-NSHDSACASA-N 1 1 346.330 2.816 10 5 EFBEMO COc1cc(C[NH+]2CCC(N3CCCCC3=O)CC2)ccc1[N+](=O)[O-] ZINC000352526564 475380610 /nfs/dbraw/zinc/38/06/10/475380610.db2.gz PAXWDVKFNCHXOK-UHFFFAOYSA-N 1 1 347.415 2.580 10 5 EFBEMO CN1C[C@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1=O ZINC000352568448 475420593 /nfs/dbraw/zinc/42/05/93/475420593.db2.gz ZOGSCDNPWLZRDQ-CRAIPNDOSA-N 1 1 325.368 2.505 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CCCCC[C@@H]2CCO)c2c(c1)COCO2 ZINC000342025062 475513709 /nfs/dbraw/zinc/51/37/09/475513709.db2.gz TVFXNGXJIUFIDE-OAHLLOKOSA-N 1 1 336.388 2.588 10 5 EFBEMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000348247510 475521350 /nfs/dbraw/zinc/52/13/50/475521350.db2.gz SSAAYWSYBCUTBW-UTUOFQBUSA-N 1 1 348.321 2.607 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCCC[C@@H]3CCO)n2)cc1 ZINC000342071461 475546970 /nfs/dbraw/zinc/54/69/70/475546970.db2.gz XSKMFASVMPRZHQ-CQSZACIVSA-N 1 1 346.387 2.772 10 5 EFBEMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000358300104 475572662 /nfs/dbraw/zinc/57/26/62/475572662.db2.gz HHILRKGTUDDCFQ-ZDUSSCGKSA-N 1 1 337.420 2.844 10 5 EFBEMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000358300103 475572931 /nfs/dbraw/zinc/57/29/31/475572931.db2.gz HHILRKGTUDDCFQ-CYBMUJFWSA-N 1 1 337.420 2.844 10 5 EFBEMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(S(C)(=O)=O)c1 ZINC000297030196 475582663 /nfs/dbraw/zinc/58/26/63/475582663.db2.gz XKMRKOLSUUMMMD-UHFFFAOYSA-N 1 1 348.424 2.673 10 5 EFBEMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(S(C)(=O)=O)c1 ZINC000297030196 475582671 /nfs/dbraw/zinc/58/26/71/475582671.db2.gz XKMRKOLSUUMMMD-UHFFFAOYSA-N 1 1 348.424 2.673 10 5 EFBEMO CC1=CC[N@@H+](CCNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1 ZINC000358344280 475606711 /nfs/dbraw/zinc/60/67/11/475606711.db2.gz OFHVZEBEPLQDAD-UHFFFAOYSA-N 1 1 330.388 2.543 10 5 EFBEMO CCOc1ccc(C(=O)NCC[N@@H+](C)C2CCCC2)cc1[N+](=O)[O-] ZINC000355205669 475742492 /nfs/dbraw/zinc/74/24/92/475742492.db2.gz ZLUKLYKSGOCTPU-UHFFFAOYSA-N 1 1 335.404 2.598 10 5 EFBEMO O=[N+]([O-])c1cnccc1NC[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000340153037 475806153 /nfs/dbraw/zinc/80/61/53/475806153.db2.gz VRGZBWGDUCSVMX-INIZCTEOSA-N 1 1 326.400 2.878 10 5 EFBEMO Nc1nccc([C@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000338365274 475829531 /nfs/dbraw/zinc/82/95/31/475829531.db2.gz LXNLKHDJENHEAI-LBPRGKRZSA-N 1 1 347.806 2.830 10 5 EFBEMO Nc1nccc([C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000338365274 475829534 /nfs/dbraw/zinc/82/95/34/475829534.db2.gz LXNLKHDJENHEAI-LBPRGKRZSA-N 1 1 347.806 2.830 10 5 EFBEMO Cc1c(CNC(=O)NCC[N@H+](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000358690035 475862590 /nfs/dbraw/zinc/86/25/90/475862590.db2.gz MTNUZSRYMTYFKU-UHFFFAOYSA-N 1 1 348.447 2.967 10 5 EFBEMO CC[N@H+]1CCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H](C)C1 ZINC000343265791 475904891 /nfs/dbraw/zinc/90/48/91/475904891.db2.gz CEAZCTHUWDVFIL-AWEZNQCLSA-N 1 1 341.415 2.891 10 5 EFBEMO COc1ccc(OCC[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)c([N+](=O)[O-])c1 ZINC000298245697 476032876 /nfs/dbraw/zinc/03/28/76/476032876.db2.gz JQHNFPYXTBIYLV-LSDHHAIUSA-N 1 1 342.342 2.959 10 5 EFBEMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000347017496 476038010 /nfs/dbraw/zinc/03/80/10/476038010.db2.gz OXNAELRBVNAQRE-SWLSCSKDSA-N 1 1 349.456 2.771 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@@H]1c1ccc(Cl)cc1 ZINC000340581131 476119207 /nfs/dbraw/zinc/11/92/07/476119207.db2.gz WTOUPMTWZQCMRZ-HIFRSBDPSA-N 1 1 348.790 2.752 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@@H]1c1ccc(Cl)cc1 ZINC000340581131 476119215 /nfs/dbraw/zinc/11/92/15/476119215.db2.gz WTOUPMTWZQCMRZ-HIFRSBDPSA-N 1 1 348.790 2.752 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000359079566 476171810 /nfs/dbraw/zinc/17/18/10/476171810.db2.gz CCMNIUALAFGWDY-UHFFFAOYSA-N 1 1 326.400 2.929 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H]4COCC[C@@H]43)n2)c1 ZINC000362453263 476262494 /nfs/dbraw/zinc/26/24/94/476262494.db2.gz WWVNWVYNXRVRIW-ZFWWWQNUSA-N 1 1 344.371 2.646 10 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ZINC000377675452 476513513 /nfs/dbraw/zinc/51/35/13/476513513.db2.gz OTTOOQHWEBLNGD-CQSZACIVSA-N 1 1 346.305 2.831 10 5 EFBEMO COC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000377675452 476513518 /nfs/dbraw/zinc/51/35/18/476513518.db2.gz OTTOOQHWEBLNGD-CQSZACIVSA-N 1 1 346.305 2.831 10 5 EFBEMO Cc1ccc(C[N@H+](C)C2CCN(c3cnccn3)CC2)cc1[N+](=O)[O-] ZINC000370043762 476645662 /nfs/dbraw/zinc/64/56/62/476645662.db2.gz VPYXKLNWGCBNLW-UHFFFAOYSA-N 1 1 341.415 2.794 10 5 EFBEMO CC[C@H](NC(=O)N1CCC[N@H+]2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000363312514 476647399 /nfs/dbraw/zinc/64/73/99/476647399.db2.gz LUOMKWDHGPEPTK-IRXDYDNUSA-N 1 1 346.431 2.926 10 5 EFBEMO CO[C@H](C)C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000354447066 476668186 /nfs/dbraw/zinc/66/81/86/476668186.db2.gz GHLJVYQHDRQAEE-LLVKDONJSA-N 1 1 343.811 2.932 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000451902678 476712875 /nfs/dbraw/zinc/71/28/75/476712875.db2.gz OQUONBZRLKFSOE-SFHVURJKSA-N 1 1 347.415 2.734 10 5 EFBEMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@]3(CCOC3)C2)cccc1[N+](=O)[O-] ZINC000451905844 476716092 /nfs/dbraw/zinc/71/60/92/476716092.db2.gz SLSQBQZLMYPDAO-RDTXWAMCSA-N 1 1 347.415 2.733 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC2(CCOCC2)[C@@H]1C ZINC000375240011 476733199 /nfs/dbraw/zinc/73/31/99/476733199.db2.gz HFSNIROPFXUPCR-KGLIPLIRSA-N 1 1 347.415 2.813 10 5 EFBEMO CNC(=O)C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1ccccc1 ZINC000430245282 476791128 /nfs/dbraw/zinc/79/11/28/476791128.db2.gz ORTXTSXRPQQNOK-MRXNPFEDSA-N 1 1 343.383 2.570 10 5 EFBEMO C[C@H](CN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[N@@H+](C)Cc1ccccc1 ZINC000390650214 476795040 /nfs/dbraw/zinc/79/50/40/476795040.db2.gz VVEGJXDIICCDNR-CYBMUJFWSA-N 1 1 339.399 2.825 10 5 EFBEMO COc1ccc(NC(=O)CC[N@@H+]2CC(C)=C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000430290893 476805735 /nfs/dbraw/zinc/80/57/35/476805735.db2.gz SLYBCWZOXAMVBB-LBPRGKRZSA-N 1 1 333.388 2.830 10 5 EFBEMO COC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000452075728 476808496 /nfs/dbraw/zinc/80/84/96/476808496.db2.gz AYPSTOIBZCJRFS-HUUCEWRRSA-N 1 1 349.431 2.979 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCNC(C)(C)C[NH+]1CCCC1 ZINC000452098419 476822928 /nfs/dbraw/zinc/82/29/28/476822928.db2.gz TXLOFGMTZMVLNP-UHFFFAOYSA-N 1 1 348.447 2.696 10 5 EFBEMO O=C(c1ccc([N+](=O)[O-])cn1)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000366142438 476880544 /nfs/dbraw/zinc/88/05/44/476880544.db2.gz MGQCPNMIUNSMNQ-UHFFFAOYSA-N 1 1 346.431 2.718 10 5 EFBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@@H]2CCc3[nH]cnc3C2)c1 ZINC000370730651 476956604 /nfs/dbraw/zinc/95/66/04/476956604.db2.gz PSHKWWCQQBGWBO-SNVBAGLBSA-N 1 1 338.314 2.566 10 5 EFBEMO NC1(C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)CCCCCC1 ZINC000423208097 476963632 /nfs/dbraw/zinc/96/36/32/476963632.db2.gz YVKKPNZHXRLJTI-CABCVRRESA-N 1 1 335.452 2.916 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H]1C[C@@H](O)c1cnn(C)c1 ZINC000375781494 477002236 /nfs/dbraw/zinc/00/22/36/477002236.db2.gz XRRCFPPKQWVSTF-MZMPZRCHSA-N 1 1 344.415 2.977 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[N@H+](C3CC3)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000452569355 477003230 /nfs/dbraw/zinc/00/32/30/477003230.db2.gz IZCHRJCRJFCEGT-ZDUSSCGKSA-N 1 1 347.415 2.550 10 5 EFBEMO C[N@H+]1CC[C@]2(CCN(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)C2)C1 ZINC000366533525 477056307 /nfs/dbraw/zinc/05/63/07/477056307.db2.gz HRFRRTSILRIMBP-SFHVURJKSA-N 1 1 342.399 2.777 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccnn3-c3ccccc3)nc2c1 ZINC000448368616 477166615 /nfs/dbraw/zinc/16/66/15/477166615.db2.gz VSEIJHZHXXCNLR-UHFFFAOYSA-N 1 1 348.366 2.947 10 5 EFBEMO CC(C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCOCC1 ZINC000411396383 477219384 /nfs/dbraw/zinc/21/93/84/477219384.db2.gz WZYLDDMJRBHOGD-UHFFFAOYSA-N 1 1 335.404 2.813 10 5 EFBEMO O=C(CC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)Nc1ccccc1F ZINC000411482149 477251849 /nfs/dbraw/zinc/25/18/49/477251849.db2.gz RZPYWVHGHFIFSR-UHFFFAOYSA-N 1 1 344.346 2.516 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@@H](C2CCC2)C1 ZINC000411842907 477390452 /nfs/dbraw/zinc/39/04/52/477390452.db2.gz HNBMAWJFUNNZBC-QGZVFWFLSA-N 1 1 347.415 2.733 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@H](C2CCC2)C1 ZINC000411846653 477392582 /nfs/dbraw/zinc/39/25/82/477392582.db2.gz LVZIRWFWANOLLU-QGZVFWFLSA-N 1 1 347.415 2.733 10 5 EFBEMO CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NCc1ccccc1[N+](=O)[O-])C2 ZINC000376622226 477432179 /nfs/dbraw/zinc/43/21/79/477432179.db2.gz INPBFFCQEPUZCX-GFCCVEGCSA-N 1 1 342.399 2.863 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436384786 477473378 /nfs/dbraw/zinc/47/33/78/477473378.db2.gz GRCQROUVZBZIDB-JTQLQIEISA-N 1 1 332.326 2.929 10 5 EFBEMO Cc1ccc([C@@H]2CC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000371746600 477475229 /nfs/dbraw/zinc/47/52/29/477475229.db2.gz KPHIBBJLSPOYJZ-MRXNPFEDSA-N 1 1 327.384 2.554 10 5 EFBEMO Cc1ccc([C@H]2CC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000371746599 477475884 /nfs/dbraw/zinc/47/58/84/477475884.db2.gz KPHIBBJLSPOYJZ-INIZCTEOSA-N 1 1 327.384 2.554 10 5 EFBEMO CC[N@H+]1CCC[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000436422931 477478541 /nfs/dbraw/zinc/47/85/41/477478541.db2.gz PLTZVNUVTODMOP-HNNXBMFYSA-N 1 1 349.434 2.895 10 5 EFBEMO COCC[N@H+]1CCC[C@H]1CNc1nccc2ccc([N+](=O)[O-])cc21 ZINC000413116875 477528215 /nfs/dbraw/zinc/52/82/15/477528215.db2.gz ICPJNMGTJPUTDN-HNNXBMFYSA-N 1 1 330.388 2.666 10 5 EFBEMO CN(c1ncc([N+](=O)[O-])cc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000413193267 477563633 /nfs/dbraw/zinc/56/36/33/477563633.db2.gz HDHOPOZHWHZGCN-AWEZNQCLSA-N 1 1 330.363 2.840 10 5 EFBEMO C[C@@H](c1ccccc1)[C@H](O)C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000450690437 477683438 /nfs/dbraw/zinc/68/34/38/477683438.db2.gz GVINFEXKANHVAZ-SCLBCKFNSA-N 1 1 327.384 2.513 10 5 EFBEMO C[C@@H](c1ccccc1)[C@H](O)C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000450690437 477683444 /nfs/dbraw/zinc/68/34/44/477683444.db2.gz GVINFEXKANHVAZ-SCLBCKFNSA-N 1 1 327.384 2.513 10 5 EFBEMO CN(C)c1nc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc[nH+]1 ZINC000450769048 477710991 /nfs/dbraw/zinc/71/09/91/477710991.db2.gz VSKILNSYHRKAOM-AWEZNQCLSA-N 1 1 327.388 2.835 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000372301456 477745537 /nfs/dbraw/zinc/74/55/37/477745537.db2.gz NFEAGUMIHZSQDL-UHFFFAOYSA-N 1 1 328.372 2.506 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000426914247 477759424 /nfs/dbraw/zinc/75/94/24/477759424.db2.gz OHBOCMSILYFTAE-BETUJISGSA-N 1 1 335.404 2.596 10 5 EFBEMO CCOc1cc(C[NH2+][C@](C)(CO)c2cccc(O)c2)ccc1[N+](=O)[O-] ZINC000451044040 477800068 /nfs/dbraw/zinc/80/00/68/477800068.db2.gz UOMJLPHCRJJKIJ-GOSISDBHSA-N 1 1 346.383 2.696 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@H](O)CC34CCC4)n2)c1 ZINC000420995623 477884449 /nfs/dbraw/zinc/88/44/49/477884449.db2.gz PJIXQHFIRASLBW-CQSZACIVSA-N 1 1 344.371 2.524 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@@H](O)CC34CCC4)n2)c1 ZINC000420995623 477884459 /nfs/dbraw/zinc/88/44/59/477884459.db2.gz PJIXQHFIRASLBW-CQSZACIVSA-N 1 1 344.371 2.524 10 5 EFBEMO O=[N+]([O-])c1ccc(CC[N@H+]2C[C@H](c3ccccc3)[C@](F)(CO)C2)cc1 ZINC000451261934 477915487 /nfs/dbraw/zinc/91/54/87/477915487.db2.gz KEUKRXULGLSCPR-RTBURBONSA-N 1 1 344.386 2.937 10 5 EFBEMO O=[N+]([O-])c1ccc(CC[N@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)cc1 ZINC000451261933 477916376 /nfs/dbraw/zinc/91/63/76/477916376.db2.gz KEUKRXULGLSCPR-RBUKOAKNSA-N 1 1 344.386 2.937 10 5 EFBEMO Cc1c(CC(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000438990209 477917899 /nfs/dbraw/zinc/91/78/99/477917899.db2.gz XIXPNQJZGSBCOD-OKILXGFUSA-N 1 1 333.432 2.825 10 5 EFBEMO CN(C(=O)C[N@H+]1C[C@H]2[C@@H]3C=C[C@@H](C3)[C@]2(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000451377872 477983160 /nfs/dbraw/zinc/98/31/60/477983160.db2.gz XMDYWORMNALWRQ-BDFQZXNOSA-N 1 1 341.411 2.702 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CCCC[C@H]2C2(O)CC2)cccc1[N+](=O)[O-] ZINC000516955972 478021565 /nfs/dbraw/zinc/02/15/65/478021565.db2.gz WSUMACZOKUUFGE-INIZCTEOSA-N 1 1 347.415 2.611 10 5 EFBEMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000495062347 478113965 /nfs/dbraw/zinc/11/39/65/478113965.db2.gz FFVWSJSZNNYCKS-CYBMUJFWSA-N 1 1 336.388 2.637 10 5 EFBEMO CC(C)C[N@H+]1CC[C@@H](CNc2c3ccccc3ncc2[N+](=O)[O-])C1 ZINC000488084667 478116340 /nfs/dbraw/zinc/11/63/40/478116340.db2.gz RRCNDPJTNMHSCR-AWEZNQCLSA-N 1 1 328.416 2.955 10 5 EFBEMO COc1ccc(C[NH2+][C@@H](c2ccccc2F)[C@H](C)O)cc1[N+](=O)[O-] ZINC000518989583 478203305 /nfs/dbraw/zinc/20/33/05/478203305.db2.gz VDWZLKSXMIUNNQ-APPDUMDISA-N 1 1 334.347 2.954 10 5 EFBEMO CS(=O)(=O)CCCC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590757624 478323148 /nfs/dbraw/zinc/32/31/48/478323148.db2.gz PNODRDVZCKABFK-HNNXBMFYSA-N 1 1 340.445 2.599 10 5 EFBEMO CS(=O)(=O)CCCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590757624 478323159 /nfs/dbraw/zinc/32/31/59/478323159.db2.gz PNODRDVZCKABFK-HNNXBMFYSA-N 1 1 340.445 2.599 10 5 EFBEMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000594417181 478374273 /nfs/dbraw/zinc/37/42/73/478374273.db2.gz AXOZHQNFEIVFGW-DLBZAZTESA-N 1 1 342.399 2.823 10 5 EFBEMO C[C@@H](C(=O)NC[C@H]1CC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000600472483 478382765 /nfs/dbraw/zinc/38/27/65/478382765.db2.gz ZNYSRDLASZDAAT-CXAGYDPISA-N 1 1 331.416 2.831 10 5 EFBEMO O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000600470058 478382925 /nfs/dbraw/zinc/38/29/25/478382925.db2.gz DZPDNVJMNAZZJH-OAHLLOKOSA-N 1 1 349.456 2.820 10 5 EFBEMO O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000600471480 478383058 /nfs/dbraw/zinc/38/30/58/478383058.db2.gz KYXRECPHBKYPNQ-QGZVFWFLSA-N 1 1 331.416 2.661 10 5 EFBEMO C[C@H](C(=O)NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000600474529 478384409 /nfs/dbraw/zinc/38/44/09/478384409.db2.gz XWRQZZPLFLCOKX-SWLSCSKDSA-N 1 1 349.406 2.971 10 5 EFBEMO CC[C@H](NC(=O)N1CC[N@@H+](C)C[C@@H]1CC)c1cccc([N+](=O)[O-])c1 ZINC000590928051 478401674 /nfs/dbraw/zinc/40/16/74/478401674.db2.gz OZRKNBQAZPHNFC-HOCLYGCPSA-N 1 1 334.420 2.782 10 5 EFBEMO Cc1[nH+]cn(CCCCc2noc(-c3cc([N+](=O)[O-])c[nH]3)n2)c1C ZINC000594535174 478428393 /nfs/dbraw/zinc/42/83/93/478428393.db2.gz VJMFVCBQKHIBAT-UHFFFAOYSA-N 1 1 330.348 2.809 10 5 EFBEMO COc1cc(NC[C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000594591823 478451945 /nfs/dbraw/zinc/45/19/45/478451945.db2.gz MKFRUJUGUPTHHN-SDDRHHMPSA-N 1 1 341.383 2.652 10 5 EFBEMO COc1cc(NC[C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000594591823 478451952 /nfs/dbraw/zinc/45/19/52/478451952.db2.gz MKFRUJUGUPTHHN-SDDRHHMPSA-N 1 1 341.383 2.652 10 5 EFBEMO COC(=O)c1cc(C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)c(C)o1 ZINC000594616580 478472671 /nfs/dbraw/zinc/47/26/71/478472671.db2.gz SXTMINPPHQWPHN-UHFFFAOYSA-N 1 1 334.328 2.581 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000597858849 478544391 /nfs/dbraw/zinc/54/43/91/478544391.db2.gz POLUEHBKRZHTHW-LBPRGKRZSA-N 1 1 330.388 2.679 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000597859639 478546452 /nfs/dbraw/zinc/54/64/52/478546452.db2.gz WUKSCFSDOURBQQ-OAHLLOKOSA-N 1 1 333.432 2.861 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000597859647 478546750 /nfs/dbraw/zinc/54/67/50/478546750.db2.gz WXYWPOYVSAAOQJ-GFCCVEGCSA-N 1 1 342.399 2.746 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000600965342 478588420 /nfs/dbraw/zinc/58/84/20/478588420.db2.gz NQTKWEWCJMBCMY-INIZCTEOSA-N 1 1 331.416 2.617 10 5 EFBEMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000600999476 478606694 /nfs/dbraw/zinc/60/66/94/478606694.db2.gz CIJJEYKVYPKDSP-NVXWUHKLSA-N 1 1 343.427 2.760 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601006408 478611877 /nfs/dbraw/zinc/61/18/77/478611877.db2.gz WOMSCTQJWDRIPW-AWEZNQCLSA-N 1 1 343.427 2.617 10 5 EFBEMO COc1cc(C[NH2+]Cc2c(C3CCC3)cnn2C)c([N+](=O)[O-])cc1O ZINC000594985573 478618908 /nfs/dbraw/zinc/61/89/08/478618908.db2.gz XOKKAJHZWPMLIV-UHFFFAOYSA-N 1 1 346.387 2.600 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](N2CCOCC2)CC1 ZINC000571580887 478630798 /nfs/dbraw/zinc/63/07/98/478630798.db2.gz CLXDWOUBELFHKL-KRWDZBQOSA-N 1 1 333.432 2.590 10 5 EFBEMO O=[N+]([O-])c1cc(F)cnc1N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000601101608 478657547 /nfs/dbraw/zinc/65/75/47/478657547.db2.gz TZRPJHAODAVHJC-UHFFFAOYSA-N 1 1 330.363 2.841 10 5 EFBEMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(c2ncc(F)cc2[N+](=O)[O-])C1 ZINC000601120711 478668324 /nfs/dbraw/zinc/66/83/24/478668324.db2.gz MXADGRKPOWPSTH-HNNXBMFYSA-N 1 1 330.363 2.840 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CCOC[C@@H]2C)CC1 ZINC000564156513 478698828 /nfs/dbraw/zinc/69/88/28/478698828.db2.gz 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CC[C@@H](NC(=O)[C@H]1CCc2c[nH+]c(C)n2C1)c1cccc([N+](=O)[O-])c1 ZINC000590443495 479648432 /nfs/dbraw/zinc/64/84/32/479648432.db2.gz VVBZKJWWQQATIJ-WMLDXEAASA-N 1 1 342.399 2.930 10 5 EFBEMO C[C@H]1CC[N@@H+](CC(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000579244542 479678583 /nfs/dbraw/zinc/67/85/83/479678583.db2.gz ORVYRRPCCGGTDN-LRDDRELGSA-N 1 1 335.429 2.511 10 5 EFBEMO O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000619252426 479733305 /nfs/dbraw/zinc/73/33/05/479733305.db2.gz LCWOOPBNMXCOMZ-NEPJUHHUSA-N 1 1 341.770 2.507 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000610002477 480227068 /nfs/dbraw/zinc/22/70/68/480227068.db2.gz MQTYGCDJWDZRQL-QAPCUYQASA-N 1 1 333.432 2.843 10 5 EFBEMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3nnc4n3CCC4)CC2)c(F)c1 ZINC000610476339 480315515 /nfs/dbraw/zinc/31/55/15/480315515.db2.gz NSSCONGXGMKCEQ-UHFFFAOYSA-N 1 1 345.378 2.651 10 5 EFBEMO CC(C)(C)OCCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000610681981 480364106 /nfs/dbraw/zinc/36/41/06/480364106.db2.gz ALVWNHIHQAWHQO-UHFFFAOYSA-N 1 1 349.431 2.558 10 5 EFBEMO CC(C)NC(=O)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180011969 519708477 /nfs/dbraw/zinc/70/84/77/519708477.db2.gz IWCIKLPRSIKENK-SFHVURJKSA-N 1 1 327.384 2.798 10 5 EFBEMO CCOc1ccc(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)cc1[N+](=O)[O-] ZINC000119103139 520895262 /nfs/dbraw/zinc/89/52/62/520895262.db2.gz DZURBCUNOFRJTL-HUUCEWRRSA-N 1 1 347.415 2.550 10 5 EFBEMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000356981178 534540702 /nfs/dbraw/zinc/54/07/02/534540702.db2.gz VEECNKSWOCDUTD-UHFFFAOYSA-N 1 1 345.443 2.932 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000245420196 521629219 /nfs/dbraw/zinc/62/92/19/521629219.db2.gz MSLJKSSWPHWULD-CZUORRHYSA-N 1 1 334.420 2.782 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000176967072 521650473 /nfs/dbraw/zinc/65/04/73/521650473.db2.gz 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CNC(=O)[C@@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC000178950013 524081360 /nfs/dbraw/zinc/08/13/60/524081360.db2.gz QDISNSFEHKTBCU-AWEZNQCLSA-N 1 1 348.428 2.579 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1C1CC1 ZINC000363384044 525465190 /nfs/dbraw/zinc/46/51/90/525465190.db2.gz FKQZMMLMPVCPSQ-OAHLLOKOSA-N 1 1 333.388 2.806 10 5 EFBEMO O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000062229206 526506773 /nfs/dbraw/zinc/50/67/73/526506773.db2.gz ZCVZJAKNSHWQOK-HNNXBMFYSA-N 1 1 343.383 2.972 10 5 EFBEMO O=C(C[NH+]1CCC(C2CCOCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000153486819 526726653 /nfs/dbraw/zinc/72/66/53/526726653.db2.gz BBKGNOSUNLJHKC-UHFFFAOYSA-N 1 1 347.415 2.672 10 5 EFBEMO O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000195222233 527261981 /nfs/dbraw/zinc/26/19/81/527261981.db2.gz KOJYBUADRJTCKA-LBPRGKRZSA-N 1 1 338.795 2.950 10 5 EFBEMO CC(C)([NH2+]Cc1csc([N+](=O)[O-])c1)C(=O)NCC1CCCC1 ZINC000136042647 527296153 /nfs/dbraw/zinc/29/61/53/527296153.db2.gz YVPJACZZOFYVHS-UHFFFAOYSA-N 1 1 325.434 2.831 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000246225927 527393567 /nfs/dbraw/zinc/39/35/67/527393567.db2.gz FIGDBJOYJPJDGG-ZYSHUDEJSA-N 1 1 345.443 2.577 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)c1 ZINC000246225927 527393596 /nfs/dbraw/zinc/39/35/96/527393596.db2.gz FIGDBJOYJPJDGG-ZYSHUDEJSA-N 1 1 345.443 2.577 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)c1 ZINC000246225927 527393601 /nfs/dbraw/zinc/39/36/01/527393601.db2.gz FIGDBJOYJPJDGG-ZYSHUDEJSA-N 1 1 345.443 2.577 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1[N+](=O)[O-] ZINC000356249287 535702276 /nfs/dbraw/zinc/70/22/76/535702276.db2.gz CRCSQEBQKZTCHQ-GOSISDBHSA-N 1 1 347.415 2.551 10 5 EFBEMO CCC[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2C)CC[N@H+]1CCOC ZINC000349958273 535741384 /nfs/dbraw/zinc/74/13/84/535741384.db2.gz AUUZQDRLPCQMPY-SFHVURJKSA-N 1 1 335.448 2.836 10 5 EFBEMO CCn1cc(CN2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000105870133 536055696 /nfs/dbraw/zinc/05/56/96/536055696.db2.gz ZXCXDXCEERKPRN-UHFFFAOYSA-N 1 1 343.431 2.519 10 5 EFBEMO CCn1cc(C[N@@H+]2CCCN(Cc3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000105870133 536055699 /nfs/dbraw/zinc/05/56/99/536055699.db2.gz ZXCXDXCEERKPRN-UHFFFAOYSA-N 1 1 343.431 2.519 10 5 EFBEMO CCn1cc(C[N@H+]2CCCN(Cc3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000105870133 536055705 /nfs/dbraw/zinc/05/57/05/536055705.db2.gz ZXCXDXCEERKPRN-UHFFFAOYSA-N 1 1 343.431 2.519 10 5 EFBEMO COc1cc(C[N@@H+](C)C[C@@H](O)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000433057281 536746919 /nfs/dbraw/zinc/74/69/19/536746919.db2.gz GJOPYQPXCZQTSS-INIZCTEOSA-N 1 1 330.384 2.639 10 5 EFBEMO COCC[N@@H+](C)CCCC1CCN(c2ccncc2[N+](=O)[O-])CC1 ZINC000346679094 536779857 /nfs/dbraw/zinc/77/98/57/536779857.db2.gz YWWQDTKKCIPOHO-UHFFFAOYSA-N 1 1 336.436 2.565 10 5 EFBEMO COC(=O)/C=C\c1ccc(N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000754025065 575377036 /nfs/dbraw/zinc/37/70/36/575377036.db2.gz OJVWFEQSXABDOP-HKGVJKBXSA-N 1 1 345.399 2.818 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(C(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000754414740 575433388 /nfs/dbraw/zinc/43/33/88/575433388.db2.gz KCGQEYHLBLDJHX-GHRAKNKNSA-N 1 1 331.416 2.939 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000755297995 575571658 /nfs/dbraw/zinc/57/16/58/575571658.db2.gz WFYQNQWECGJMHE-DDKJEQMHSA-N 1 1 329.400 2.599 10 5 EFBEMO Cc1cn(C[N@H+]2CC[C@@H](C(C)C)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000755924565 575657604 /nfs/dbraw/zinc/65/76/04/575657604.db2.gz OBDFKFAPGQQGJW-OAHLLOKOSA-N 1 1 344.415 2.791 10 5 EFBEMO Cc1cn(C[N@@H+]2CC[C@@H](C(C)C)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000755924565 575657607 /nfs/dbraw/zinc/65/76/07/575657607.db2.gz OBDFKFAPGQQGJW-OAHLLOKOSA-N 1 1 344.415 2.791 10 5 EFBEMO CSc1ccc(C(=O)OCC[NH+]2CCSCC2)cc1[N+](=O)[O-] ZINC000757928118 575856086 /nfs/dbraw/zinc/85/60/86/575856086.db2.gz VAMUKECKNDJRKL-UHFFFAOYSA-N 1 1 342.442 2.522 10 5 EFBEMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c3nonc32)[C@H]1c1ccccc1 ZINC000758251272 575864877 /nfs/dbraw/zinc/86/48/77/575864877.db2.gz IPOOSSZYAIVCDG-SUMWQHHRSA-N 1 1 339.355 2.988 10 5 EFBEMO Cc1cc(F)cc(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-] ZINC000758507616 575871152 /nfs/dbraw/zinc/87/11/52/575871152.db2.gz UWZBSQXMDNFINZ-AGUYFDCRSA-N 1 1 335.379 2.787 10 5 EFBEMO O=[N+]([O-])c1cccc(Br)c1C[NH2+][C@H]1C[C@H](O)C12CCC2 ZINC000850388131 1250459662 /nfs/dbraw/zinc/45/96/62/1250459662.db2.gz IGBTXWAYFYLZTA-STQMWFEESA-N 1 1 341.205 2.750 10 5 EFBEMO CC[N@@H+](CCNC(=O)[C@H]1C[C@H]2C[C@H]2C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001691035579 1248031531 /nfs/dbraw/zinc/03/15/31/1248031531.db2.gz HGWXOVAGIMRXTB-ZSHCYNCHSA-N 1 1 331.416 2.579 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(C(=O)NCc2ccc(C)c([N+](=O)[O-])c2)C[C@H]1C ZINC001687333882 1248259942 /nfs/dbraw/zinc/25/99/42/1248259942.db2.gz NNENIKSJKDYKMW-KGLIPLIRSA-N 1 1 334.420 2.527 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[NH2+][C@@H]1C[C@H](O)c3ccccc31)OCCO2 ZINC000850371566 1250452614 /nfs/dbraw/zinc/45/26/14/1250452614.db2.gz KUHCRTBVKGPSDA-ZBFHGGJFSA-N 1 1 342.351 2.634 10 5 EFBEMO COc1cc(C[NH2+][C@H]2C[C@@H](O)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000850372491 1250453195 /nfs/dbraw/zinc/45/31/95/1250453195.db2.gz VJDRHBZMOBCKES-GOEBONIOSA-N 1 1 344.367 2.880 10 5 EFBEMO COc1cc(C[NH2+][C@@H]2C[C@@H](O)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000850372490 1250453257 /nfs/dbraw/zinc/45/32/57/1250453257.db2.gz VJDRHBZMOBCKES-GDBMZVCRSA-N 1 1 344.367 2.880 10 5 EFBEMO CO[C@@H]1CC[C@@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000851035536 1250766045 /nfs/dbraw/zinc/76/60/45/1250766045.db2.gz QDESCTGNJYSJOM-OIISXLGYSA-N 1 1 348.399 2.527 10 5 EFBEMO CO[C@@H]1CC[C@@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000851035536 1250766060 /nfs/dbraw/zinc/76/60/60/1250766060.db2.gz QDESCTGNJYSJOM-OIISXLGYSA-N 1 1 348.399 2.527 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@@H+](C)Cc2ccccc21 ZINC001127741016 1255450037 /nfs/dbraw/zinc/45/00/37/1255450037.db2.gz SGEHVFSNLLZFJI-MRXNPFEDSA-N 1 1 343.358 2.959 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@H+](C)Cc2ccccc21 ZINC001127741016 1255450042 /nfs/dbraw/zinc/45/00/42/1255450042.db2.gz SGEHVFSNLLZFJI-MRXNPFEDSA-N 1 1 343.358 2.959 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)cc1Cl ZINC000824655844 1278222957 /nfs/dbraw/zinc/22/29/57/1278222957.db2.gz ZZFJNYFVYNJYOM-IOASZLSFSA-N 1 1 340.807 2.610 10 5 EFBEMO C[C@@](CO)([NH2+]Cc1cccc2c1OCC2)c1cccc([N+](=O)[O-])c1 ZINC000922305336 1265405910 /nfs/dbraw/zinc/40/59/10/1265405910.db2.gz FQIFKWVYCOESDL-SFHVURJKSA-N 1 1 328.368 2.527 10 5 EFBEMO O=C(Cc1ccccc1[N+](=O)[O-])O[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000735220270 1267241025 /nfs/dbraw/zinc/24/10/25/1267241025.db2.gz KGEGDBFFQIPALD-KRWDZBQOSA-N 1 1 340.379 2.955 10 5 EFBEMO CNc1ccc([N+](=O)[O-])cc1NC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC000843963891 1278683833 /nfs/dbraw/zinc/68/38/33/1278683833.db2.gz GNBPYDUCNMWCRD-MRXNPFEDSA-N 1 1 338.383 2.788 10 5 EFBEMO CC[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCCOC1 ZINC000844403165 1278952821 /nfs/dbraw/zinc/95/28/21/1278952821.db2.gz DEXSKJYKJZZTFT-LBPRGKRZSA-N 1 1 341.795 2.688 10 5 EFBEMO CC[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCCOC1 ZINC000844403165 1278952832 /nfs/dbraw/zinc/95/28/32/1278952832.db2.gz DEXSKJYKJZZTFT-LBPRGKRZSA-N 1 1 341.795 2.688 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CC[NH+]3CCC2CC3)c(Br)c1 ZINC000786819282 1275553520 /nfs/dbraw/zinc/55/35/20/1275553520.db2.gz PZRYHBQBFKBMOO-UHFFFAOYSA-N 1 1 326.194 2.642 10 5 EFBEMO Cc1ccsc1[C@H](CO)[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792880794 1279233391 /nfs/dbraw/zinc/23/33/91/1279233391.db2.gz VXKCZHHAXICUPU-LBPRGKRZSA-N 1 1 337.357 2.696 10 5 EFBEMO CC(C)C[N@H+]1CCO[C@@H](CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872017816 1287400321 /nfs/dbraw/zinc/40/03/21/1287400321.db2.gz FHYSWOTYYNFRBZ-KGLIPLIRSA-N 1 1 339.411 2.741 10 5 EFBEMO C[C@@](CO)([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001175323073 1287401335 /nfs/dbraw/zinc/40/13/35/1287401335.db2.gz HIAYGQQSRLBLBA-INIZCTEOSA-N 1 1 331.328 2.500 10 5 EFBEMO C[C@H]([NH2+][C@@H]1CCCc2c1cnn2CCO)c1c(F)cccc1[N+](=O)[O-] ZINC000872026769 1287404883 /nfs/dbraw/zinc/40/48/83/1287404883.db2.gz HIXXEJARXOMXEM-SMDDNHRTSA-N 1 1 348.378 2.651 10 5 EFBEMO C[C@H]([NH2+]C[C@]1(N(C)C)CCSC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872039484 1287408487 /nfs/dbraw/zinc/40/84/87/1287408487.db2.gz FXCVOCUAFAKCLA-XHDPSFHLSA-N 1 1 327.425 2.822 10 5 EFBEMO C[C@H]([NH2+][C@H]1COc2ccccc2[C@H]1O)c1c(F)cccc1[N+](=O)[O-] ZINC000872074269 1287420076 /nfs/dbraw/zinc/42/00/76/1287420076.db2.gz ZTCAJOLVGNYGKP-SIMVJXQJSA-N 1 1 332.331 2.879 10 5 EFBEMO Cc1ccnc([C@@H]2CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000846969233 1280669050 /nfs/dbraw/zinc/66/90/50/1280669050.db2.gz MRXUXAVYCQWITG-QAPCUYQASA-N 1 1 327.384 2.821 10 5 EFBEMO Cc1ccnc([C@@H]2CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000846969229 1280670239 /nfs/dbraw/zinc/67/02/39/1280670239.db2.gz MRXUXAVYCQWITG-CRAIPNDOSA-N 1 1 327.384 2.821 10 5 EFBEMO Cc1nccnc1[C@@H](C)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC001175925348 1287615488 /nfs/dbraw/zinc/61/54/88/1287615488.db2.gz JJYOBQMSPRUKDL-SNVBAGLBSA-N 1 1 349.778 2.636 10 5 EFBEMO CC(C)(O)[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001175973577 1287629551 /nfs/dbraw/zinc/62/95/51/1287629551.db2.gz NUIWYWAGLIWEMM-LBPRGKRZSA-N 1 1 346.387 2.628 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](c3ccccn3)C2)c1 ZINC000811500748 1284383444 /nfs/dbraw/zinc/38/34/44/1284383444.db2.gz MDTJWRZUYKCIKP-CQSZACIVSA-N 1 1 341.367 2.766 10 5 EFBEMO Cc1ccccc1[C@@H](CO)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC001176177187 1287729081 /nfs/dbraw/zinc/72/90/81/1287729081.db2.gz UATIBJWJNDHDJR-GOSISDBHSA-N 1 1 330.384 2.947 10 5 EFBEMO CN(CCc1ccc2c(c1)OCO2)Cc1cc([O-])ccc1[N+](=O)[O-] ZINC001176183439 1287730150 /nfs/dbraw/zinc/73/01/50/1287730150.db2.gz CTDIDIWGKAEFGB-UHFFFAOYSA-N 1 1 330.340 2.704 10 5 EFBEMO C[C@@H](OCC1CC1)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171009 1285702178 /nfs/dbraw/zinc/70/21/78/1285702178.db2.gz QFBBTYDPJQSJNY-DYVFJYSZSA-N 1 1 348.399 2.527 10 5 EFBEMO C[C@@H](OCC1CC1)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171009 1285702188 /nfs/dbraw/zinc/70/21/88/1285702188.db2.gz QFBBTYDPJQSJNY-DYVFJYSZSA-N 1 1 348.399 2.527 10 5 EFBEMO CC[C@@H]1CC[C@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)O1 ZINC000813173889 1285702932 /nfs/dbraw/zinc/70/29/32/1285702932.db2.gz LXPULRQPRRKYED-IXDOHACOSA-N 1 1 348.399 2.670 10 5 EFBEMO CC[C@@H]1CC[C@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)O1 ZINC000813173889 1285702939 /nfs/dbraw/zinc/70/29/39/1285702939.db2.gz LXPULRQPRRKYED-IXDOHACOSA-N 1 1 348.399 2.670 10 5 EFBEMO CC[C@@H](C)OCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173876 1285703486 /nfs/dbraw/zinc/70/34/86/1285703486.db2.gz LTBQQAMWDODULS-CJNGLKHVSA-N 1 1 336.388 2.527 10 5 EFBEMO CC[C@@H](C)OCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173876 1285703490 /nfs/dbraw/zinc/70/34/90/1285703490.db2.gz LTBQQAMWDODULS-CJNGLKHVSA-N 1 1 336.388 2.527 10 5 EFBEMO O=C(C[C@@H]1CCCCO1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174603 1285704577 /nfs/dbraw/zinc/70/45/77/1285704577.db2.gz ZOBOGVYZNGDHMA-IRXDYDNUSA-N 1 1 348.399 2.672 10 5 EFBEMO O=C(C[C@@H]1CCCCO1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174603 1285704582 /nfs/dbraw/zinc/70/45/82/1285704582.db2.gz ZOBOGVYZNGDHMA-IRXDYDNUSA-N 1 1 348.399 2.672 10 5 EFBEMO C[N@H+]1CCCC[C@H]1CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001134555992 1286910517 /nfs/dbraw/zinc/91/05/17/1286910517.db2.gz KBKFJYXAYHIPDL-ZDUSSCGKSA-N 1 1 342.399 2.544 10 5 EFBEMO CC(C)[N@H+]1CCC[C@H](C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC001179398715 1289122003 /nfs/dbraw/zinc/12/20/03/1289122003.db2.gz MDWGXVWXXGOKJV-CABCVRRESA-N 1 1 333.432 2.935 10 5 EFBEMO CC[N@H+]1CC[C@H]2OCCN(c3nc4ccc([N+](=O)[O-])cc4s3)[C@H]2C1 ZINC000814905535 1287145910 /nfs/dbraw/zinc/14/59/10/1287145910.db2.gz JHYCBJDCLKCPPK-UONOGXRCSA-N 1 1 348.428 2.504 10 5 EFBEMO CN(C(=O)C[N@H+]1C[C@H]2[C@H]3C=C[C@H](C3)[C@@]2(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC001176621058 1288050269 /nfs/dbraw/zinc/05/02/69/1288050269.db2.gz XMDYWORMNALWRQ-BDEJMISXSA-N 1 1 341.411 2.702 10 5 EFBEMO C[N@H+]1C[C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C(C)(C)C1 ZINC001178710235 1288882454 /nfs/dbraw/zinc/88/24/54/1288882454.db2.gz YCPMUUIZUIHZNO-AWEZNQCLSA-N 1 1 333.413 2.880 10 5 EFBEMO CC[N@H+]1C[C@@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C(C)(C)C1 ZINC001178856158 1288944966 /nfs/dbraw/zinc/94/49/66/1288944966.db2.gz IBLDITRAIZHGOV-CYBMUJFWSA-N 1 1 325.796 2.708 10 5 EFBEMO CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000824634883 1289733733 /nfs/dbraw/zinc/73/37/33/1289733733.db2.gz CJUGNNJGESJZSQ-ZWNOBZJWSA-N 1 1 343.221 2.950 10 5 EFBEMO CCc1c[nH]c2nc[nH+]c(NCc3nc4cc([N+](=O)[O-])ccc4[nH]3)c12 ZINC001186285200 1290924539 /nfs/dbraw/zinc/92/45/39/1290924539.db2.gz NZVHLNQMCIISBZ-UHFFFAOYSA-N 1 1 337.343 2.917 10 5 EFBEMO CCC[N@@H+](CC)C[C@H](C)Nc1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC001186633908 1291002363 /nfs/dbraw/zinc/00/23/63/1291002363.db2.gz YJMRTZXTVDXELX-VIFPVBQESA-N 1 1 337.346 2.879 10 5 EFBEMO Cn1cc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)c([N+](=O)[O-])n1 ZINC000877095731 1291134846 /nfs/dbraw/zinc/13/48/46/1291134846.db2.gz SQOBLMVNJCJSNW-CQSZACIVSA-N 1 1 328.372 2.864 10 5 EFBEMO CCOC(=O)[C@@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2)C[C@H]1C(F)(F)F ZINC000877839691 1291402198 /nfs/dbraw/zinc/40/21/98/1291402198.db2.gz XGBBPTPHGAOGBI-CHWSQXEVSA-N 1 1 346.305 2.768 10 5 EFBEMO CCOC(=O)[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C[C@H]1C(F)(F)F ZINC000877839691 1291402202 /nfs/dbraw/zinc/40/22/02/1291402202.db2.gz XGBBPTPHGAOGBI-CHWSQXEVSA-N 1 1 346.305 2.768 10 5 EFBEMO Cn1cc[nH+]c1[C@H]1CCCN(c2nc3c(cc2[N+](=O)[O-])CCCC3)C1 ZINC000826010331 1291478458 /nfs/dbraw/zinc/47/84/58/1291478458.db2.gz NUGXHAZBOKELSM-AWEZNQCLSA-N 1 1 341.415 2.986 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H]1CC3(CO1)CCOCC3)C2 ZINC000878302992 1291613664 /nfs/dbraw/zinc/61/36/64/1291613664.db2.gz DDQYHCUFRXNJIW-HNNXBMFYSA-N 1 1 332.400 2.539 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1CC3(CO1)CCOCC3)C2 ZINC000878302992 1291613671 /nfs/dbraw/zinc/61/36/71/1291613671.db2.gz DDQYHCUFRXNJIW-HNNXBMFYSA-N 1 1 332.400 2.539 10 5 EFBEMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](C)CN1CCOCC1 ZINC001190527911 1292201976 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CC1(C)CC(C(=O)NCC2([NH2+]Cc3csc([N+](=O)[O-])c3)CC2)C1 ZINC001323436708 1329543487 /nfs/dbraw/zinc/54/34/87/1329543487.db2.gz YUTRSRDUQVKZFA-UHFFFAOYSA-N 1 1 337.445 2.831 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2ccc(N)cc2[N+](=O)[O-])cc1 ZINC001329760162 1330734114 /nfs/dbraw/zinc/73/41/14/1330734114.db2.gz UHCUOMULYBVKIT-OAHLLOKOSA-N 1 1 342.399 2.872 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@@H]2CNc2nc(C)ccc2[N+](=O)[O-])cc1 ZINC001331313082 1330820259 /nfs/dbraw/zinc/82/02/59/1330820259.db2.gz RLEOLXWEYPYDKB-OAHLLOKOSA-N 1 1 342.399 2.993 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2nc(C)ccc2[N+](=O)[O-])cc1 ZINC001331313082 1330820263 /nfs/dbraw/zinc/82/02/63/1330820263.db2.gz RLEOLXWEYPYDKB-OAHLLOKOSA-N 1 1 342.399 2.993 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1C ZINC001339664937 1331926064 /nfs/dbraw/zinc/92/60/64/1331926064.db2.gz XKENOIPVQHFQTO-HNNXBMFYSA-N 1 1 331.416 2.958 10 5 EFBEMO CCN(C(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1 ZINC001345746433 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XOUWCBMRGHJRSY-GUYCJALGSA-N 1 1 330.388 2.773 10 5 EFBEMO CO[C@H]1C[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)CC[C@@H]1C ZINC000848485812 1334742255 /nfs/dbraw/zinc/74/22/55/1334742255.db2.gz XOUWCBMRGHJRSY-GUYCJALGSA-N 1 1 330.388 2.773 10 5 EFBEMO CC[N@@H+](CC1CCC1)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848486631 1334743520 /nfs/dbraw/zinc/74/35/20/1334743520.db2.gz HVUINGXCEMHQGH-QGZVFWFLSA-N 1 1 331.416 2.990 10 5 EFBEMO C[C@@H]1C[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)[C@@H](C)[C@H]1C ZINC000848489099 1334745725 /nfs/dbraw/zinc/74/57/25/1334745725.db2.gz PZYBNLSACXAENN-XJIUQZFPSA-N 1 1 331.416 2.845 10 5 EFBEMO Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CCC[N@H+]2Cc2ccccc21 ZINC001355880593 1334896907 /nfs/dbraw/zinc/89/69/07/1334896907.db2.gz DOPXEFDIKYYKPO-AWEZNQCLSA-N 1 1 340.383 2.558 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ccc(C)nc1)Cc1cccc([N+](=O)[O-])c1 ZINC001492913011 1363812397 /nfs/dbraw/zinc/81/23/97/1363812397.db2.gz AYYOYBFEZHFJAT-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 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336.335 2.828 10 5 EFBEMO C[C@@H](O)C[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001473439282 1397301944 /nfs/dbraw/zinc/30/19/44/1397301944.db2.gz BQEYCKVAONSFJZ-CHWSQXEVSA-N 1 1 346.387 2.770 10 5 EFBEMO CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1C[N@@H+]2CCc1ccc([N+](=O)[O-])cc1 ZINC001473697331 1397322262 /nfs/dbraw/zinc/32/22/62/1397322262.db2.gz AWZOSQCHNILOAD-HOTGVXAUSA-N 1 1 347.415 2.831 10 5 EFBEMO CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1C[N@H+]2CCc1ccc([N+](=O)[O-])cc1 ZINC001473697331 1397322263 /nfs/dbraw/zinc/32/22/63/1397322263.db2.gz AWZOSQCHNILOAD-HOTGVXAUSA-N 1 1 347.415 2.831 10 5 EFBEMO Cc1cc(C(=O)NCCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])co1 ZINC001479767753 1397829947 /nfs/dbraw/zinc/82/99/47/1397829947.db2.gz MVWVGMQVUZVDDJ-UHFFFAOYSA-N 1 1 331.372 2.748 10 5 EFBEMO CC(C)(F)C(=O)NCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001479862453 1397967829 /nfs/dbraw/zinc/96/78/29/1397967829.db2.gz MOTGKTXGDZINQM-UHFFFAOYSA-N 1 1 337.395 2.814 10 5 EFBEMO 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CC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCC[N@@H+]2CCSC[C@@H]12 ZINC000895569838 724205099 /nfs/dbraw/zinc/20/50/99/724205099.db2.gz NSBDQGBBJLPASO-HOTGVXAUSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000895569838 724205104 /nfs/dbraw/zinc/20/51/04/724205104.db2.gz NSBDQGBBJLPASO-HOTGVXAUSA-N 1 1 335.429 2.789 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@](CO)(C(F)(F)F)C1 ZINC000895846564 724348163 /nfs/dbraw/zinc/34/81/63/724348163.db2.gz QKBXLJITCBKABD-LYKUJDHUSA-N 1 1 330.306 2.855 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@@](CO)(C(F)(F)F)C1 ZINC000895846564 724348167 /nfs/dbraw/zinc/34/81/67/724348167.db2.gz QKBXLJITCBKABD-LYKUJDHUSA-N 1 1 330.306 2.855 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000913760142 725851165 /nfs/dbraw/zinc/85/11/65/725851165.db2.gz HGXJLPBISZDJMM-SKDRFNHKSA-N 1 1 341.770 2.554 10 5 EFBEMO CC[N@H+]1CCN(C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C 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QXRRQYMJECLZHJ-OAHLLOKOSA-N 1 1 345.443 2.959 10 5 EFBEMO CC[N@H+]1CCCN(C(=O)/C(C)=C/c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000910285333 727427474 /nfs/dbraw/zinc/42/74/74/727427474.db2.gz XNHGYPVEVSVLGJ-OKFGHLOFSA-N 1 1 331.416 2.941 10 5 EFBEMO CC[N@H+]1CCCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)[C@H](C)C1 ZINC000910285433 727427496 /nfs/dbraw/zinc/42/74/96/727427496.db2.gz BVMYDMMHZFGDCI-GFCCVEGCSA-N 1 1 330.388 2.632 10 5 EFBEMO CN(C[C@H]1CCC[N@H+]1C)C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000911201299 727509727 /nfs/dbraw/zinc/50/97/27/727509727.db2.gz PFRZFMURGUTQSZ-CQSZACIVSA-N 1 1 339.823 2.733 10 5 EFBEMO O=C(NCc1cc([N+](=O)[O-])c(F)cc1F)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC000911471970 727543248 /nfs/dbraw/zinc/54/32/48/727543248.db2.gz AJSIURZMSBWLEF-BXUZGUMPSA-N 1 1 339.342 2.506 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000912030987 727637935 /nfs/dbraw/zinc/63/79/35/727637935.db2.gz KKMHQIDKXQLBPT-MRXNPFEDSA-N 1 1 349.431 2.796 10 5 EFBEMO C[N@H+]1C[C@@]2(C)CN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)C[C@@]2(C)C1 ZINC000913281826 727814959 /nfs/dbraw/zinc/81/49/59/727814959.db2.gz CPGGQJDFTRHAMG-KDURUIRLSA-N 1 1 345.443 2.673 10 5 EFBEMO COC(=O)/C=C/c1ccc(NC[C@H](C)[N@@H+](C)C2CC2)c([N+](=O)[O-])c1 ZINC000068913295 729765498 /nfs/dbraw/zinc/76/54/98/729765498.db2.gz LYJYPULTBLCVDZ-LHXVZLOVSA-N 1 1 333.388 2.676 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(C[NH+](C)C)o1 ZINC001570015070 1085862143 /nfs/dbraw/zinc/86/21/43/1085862143.db2.gz VQPDVYZFOASSBO-UHFFFAOYSA-N 1 1 333.344 2.900 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001570196240 1086046706 /nfs/dbraw/zinc/04/67/06/1086046706.db2.gz CTKFTVQUOYTUTI-QZTJIDSGSA-N 1 1 345.443 2.510 10 5 EFBEMO CN(CCC[N@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001570196240 1086046717 /nfs/dbraw/zinc/04/67/17/1086046717.db2.gz CTKFTVQUOYTUTI-QZTJIDSGSA-N 1 1 345.443 2.510 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001570196240 1086046728 /nfs/dbraw/zinc/04/67/28/1086046728.db2.gz CTKFTVQUOYTUTI-QZTJIDSGSA-N 1 1 345.443 2.510 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C[C@@H]1C ZINC001570899724 1086600257 /nfs/dbraw/zinc/60/02/57/1086600257.db2.gz CERWJTMSXBWODG-PHIMTYICSA-N 1 1 325.796 2.803 10 5 EFBEMO CC(C)(C)C(=O)NCC1=CC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001571698335 1087067477 /nfs/dbraw/zinc/06/74/77/1087067477.db2.gz DCAWJYIGTHYISL-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO CC(C)(C)C(=O)NCC1=CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001571698335 1087067485 /nfs/dbraw/zinc/06/74/85/1087067485.db2.gz DCAWJYIGTHYISL-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO C[C@@]1(NCC[N+](=O)[O-])C[N@@H+](Cc2ccccc2)C[C@H]1c1ccccc1 ZINC001648482238 1092221973 /nfs/dbraw/zinc/22/19/73/1092221973.db2.gz YFTGPVLVUMZVLL-VQTJNVASSA-N 1 1 339.439 2.911 10 5 EFBEMO CC(C)[C@@H]1C[C@H](N2CCCC2)C[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC001648591954 1092237175 /nfs/dbraw/zinc/23/71/75/1092237175.db2.gz SWDJBOYQUCYZBC-GBESFXJTSA-N 1 1 347.459 2.823 10 5 EFBEMO CC(C)[C@@H]1C[C@H](N2CCCC2)C[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC001648591954 1092237186 /nfs/dbraw/zinc/23/71/86/1092237186.db2.gz SWDJBOYQUCYZBC-GBESFXJTSA-N 1 1 347.459 2.823 10 5 EFBEMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@]2(CO)c2ccccc2)cc1 ZINC001648634704 1092243175 /nfs/dbraw/zinc/24/31/75/1092243175.db2.gz JIODEFFRSJFTGP-OALUTQOASA-N 1 1 342.395 2.612 10 5 EFBEMO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001587795277 1092854026 /nfs/dbraw/zinc/85/40/26/1092854026.db2.gz DKFIFTNBZYPCLD-QGZVFWFLSA-N 1 1 339.395 2.908 10 5 EFBEMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CC[N@@H+](C)[C@H]2C1 ZINC001587870352 1092861783 /nfs/dbraw/zinc/86/17/83/1092861783.db2.gz YQDJEEARCWHSAN-DOMZBBRYSA-N 1 1 349.456 2.873 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC001587990219 1092879458 /nfs/dbraw/zinc/87/94/58/1092879458.db2.gz KSVQTKBRFVZSBR-KGLIPLIRSA-N 1 1 347.415 2.550 10 5 EFBEMO CC(C)SCC(=O)NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC001670751285 1092967439 /nfs/dbraw/zinc/96/74/39/1092967439.db2.gz NOIRUDQCAPUWSC-UHFFFAOYSA-N 1 1 343.474 2.536 10 5 EFBEMO CC(C)c1ccc(C[NH+]2CCN(c3nn(C)cc3[N+](=O)[O-])CC2)cc1 ZINC001651111057 1093528599 /nfs/dbraw/zinc/52/85/99/1093528599.db2.gz ACJKGGVDIBSJHQ-UHFFFAOYSA-N 1 1 343.431 2.774 10 5 EFBEMO Nc1c(C(=O)Nc2cc[nH+]c(N3CCCCC3)c2)cccc1[N+](=O)[O-] ZINC001598108359 1094656903 /nfs/dbraw/zinc/65/69/03/1094656903.db2.gz DVOWYQIFLCEFEN-UHFFFAOYSA-N 1 1 341.371 2.815 10 5 EFBEMO CCC[N@H+](CCNC(=O)CC(F)(F)F)Cc1ccccc1[N+](=O)[O-] ZINC001481131294 1094892845 /nfs/dbraw/zinc/89/28/45/1094892845.db2.gz BNGKFZQDKWWSAI-UHFFFAOYSA-N 1 1 347.337 2.875 10 5 EFBEMO CCC[N@@H+](CCNC(=O)CC(F)(F)F)Cc1ccccc1[N+](=O)[O-] ZINC001481131294 1094892858 /nfs/dbraw/zinc/89/28/58/1094892858.db2.gz BNGKFZQDKWWSAI-UHFFFAOYSA-N 1 1 347.337 2.875 10 5 EFBEMO Cc1cc(C(=O)NCC[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)co1 ZINC001481166053 1095083410 /nfs/dbraw/zinc/08/34/10/1095083410.db2.gz ICJBVELISMYBQH-UHFFFAOYSA-N 1 1 343.383 2.891 10 5 EFBEMO Cc1cc(C(=O)NCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)co1 ZINC001481166053 1095083423 /nfs/dbraw/zinc/08/34/23/1095083423.db2.gz ICJBVELISMYBQH-UHFFFAOYSA-N 1 1 343.383 2.891 10 5 EFBEMO CC(C)(C)/C=C\C(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001267679384 1095430855 /nfs/dbraw/zinc/43/08/55/1095430855.db2.gz PGBVZUONQMLYGE-FPLPWBNLSA-N 1 1 331.416 2.745 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cccs1 ZINC001268230097 1096139729 /nfs/dbraw/zinc/13/97/29/1096139729.db2.gz LAPWJDPTECZJJP-UHFFFAOYSA-N 1 1 333.413 2.860 10 5 EFBEMO Cc1ccc(C(=O)N(C)CC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)cn1 ZINC001268230121 1096140258 /nfs/dbraw/zinc/14/02/58/1096140258.db2.gz GPDZFDLOYBDTKQ-UHFFFAOYSA-N 1 1 342.399 2.502 10 5 EFBEMO Cc1ccc(C(=O)N(C)CC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cn1 ZINC001268230121 1096140261 /nfs/dbraw/zinc/14/02/61/1096140261.db2.gz GPDZFDLOYBDTKQ-UHFFFAOYSA-N 1 1 342.399 2.502 10 5 EFBEMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(CC[NH2+]CCC2=CCCCC2)CC1 ZINC001481998388 1097065615 /nfs/dbraw/zinc/06/56/15/1097065615.db2.gz UTPQFKJCYYUNSS-QZTJIDSGSA-N 1 1 349.475 2.760 10 5 EFBEMO CC(F)(F)CCC(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001268842846 1097679637 /nfs/dbraw/zinc/67/96/37/1097679637.db2.gz BTFXMKWNYJDOQM-UHFFFAOYSA-N 1 1 341.358 2.578 10 5 EFBEMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC001611165643 1098985837 /nfs/dbraw/zinc/98/58/37/1098985837.db2.gz QYGKZYXVGDHYGS-YOEHRIQHSA-N 1 1 333.432 2.887 10 5 EFBEMO CC(C)[N@H+]1CCC[C@H](NC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001611179005 1098987214 /nfs/dbraw/zinc/98/72/14/1098987214.db2.gz YEWJXHJZXUJVNU-ZDUSSCGKSA-N 1 1 339.823 2.780 10 5 EFBEMO 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ZINC000444672514 250325379 /nfs/dbraw/zinc/32/53/79/250325379.db2.gz KEGNNLFGOVSOGA-INIZCTEOSA-N 1 1 326.356 2.948 10 5 EFBEMO Cc1ccsc1[C@@H](CO)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444682180 250327118 /nfs/dbraw/zinc/32/71/18/250327118.db2.gz YXNRZIIAMWLJCH-CYBMUJFWSA-N 1 1 332.385 2.664 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1C[C@H]2CCC[N@@H+]2C[C@@H]1C ZINC000094139738 218266716 /nfs/dbraw/zinc/26/67/16/218266716.db2.gz JIVZOBBLRKUKOZ-DZGCQCFKSA-N 1 1 331.416 2.829 10 5 EFBEMO C[N@@H+]1CC=C(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC1 ZINC000445130849 250387518 /nfs/dbraw/zinc/38/75/18/250387518.db2.gz CIRRZUOKZAFODW-UHFFFAOYSA-N 1 1 347.418 2.673 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)c(Cl)c1 ZINC000449433467 251026851 /nfs/dbraw/zinc/02/68/51/251026851.db2.gz MMRDQTUJSUSZSN-XPKDYRNWSA-N 1 1 340.807 2.610 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)c(Cl)c1 ZINC000449433465 251027534 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330.359 2.895 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[N@H+]1C[C@@H](c2ccccc2)[C@@](F)(CO)C1 ZINC000449429528 285160904 /nfs/dbraw/zinc/16/09/04/285160904.db2.gz VDPPOFRQGSQIHY-WMZOPIPTSA-N 1 1 330.359 2.895 10 5 EFBEMO O=[N+]([O-])c1cnccc1N1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000336937395 285187885 /nfs/dbraw/zinc/18/78/85/285187885.db2.gz VIQDMIVPIUPMSN-ZDUSSCGKSA-N 1 1 327.388 2.907 10 5 EFBEMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1ncc(Cl)cc1[N+](=O)[O-] ZINC000154193037 224216962 /nfs/dbraw/zinc/21/69/62/224216962.db2.gz QSJLUNCSTDWZQV-UHFFFAOYSA-N 1 1 349.778 2.927 10 5 EFBEMO Cc1sc(C(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000119747078 221391903 /nfs/dbraw/zinc/39/19/03/221391903.db2.gz RIVXZAOXMLEGRH-LBPRGKRZSA-N 1 1 325.434 2.672 10 5 EFBEMO C[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000119685346 141362846 /nfs/dbraw/zinc/36/28/46/141362846.db2.gz GSJRTZJLXYNBGZ-VIFPVBQESA-N 1 1 335.310 2.823 10 5 EFBEMO Cc1ccc2nc(C[NH2+][C@H](C)c3ccccc3[N+](=O)[O-])cc(=O)n2c1 ZINC000342288658 145094277 /nfs/dbraw/zinc/09/42/77/145094277.db2.gz ZKFBXZNCILVOJC-CYBMUJFWSA-N 1 1 338.367 2.762 10 5 EFBEMO Cc1cccn2c(=O)cc(C[NH2+][C@H](C)c3ccccc3[N+](=O)[O-])nc12 ZINC000342290315 145094660 /nfs/dbraw/zinc/09/46/60/145094660.db2.gz BOPDXMIVNDZUMC-CYBMUJFWSA-N 1 1 338.367 2.762 10 5 EFBEMO C[N@@H+](CCNC(=O)CCNc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000342816487 145200420 /nfs/dbraw/zinc/20/04/20/145200420.db2.gz WBUJWOLEHGOLTA-UHFFFAOYSA-N 1 1 348.447 2.778 10 5 EFBEMO COC(=O)c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)nc1C1CC1 ZINC000349131602 146056937 /nfs/dbraw/zinc/05/69/37/146056937.db2.gz QEXGRWRYGAOEQI-UHFFFAOYSA-N 1 1 341.367 2.944 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000351604319 146157646 /nfs/dbraw/zinc/15/76/46/146157646.db2.gz UKQWBVFAZKRCSN-GFCCVEGCSA-N 1 1 330.340 2.850 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2C[C@H](C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000355730838 147046639 /nfs/dbraw/zinc/04/66/39/147046639.db2.gz PKQIXOOWHFEIOA-OLZOCXBDSA-N 1 1 336.388 2.767 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2C[C@H](C)CC2(C)C)cc1[N+](=O)[O-] ZINC000355766379 147056786 /nfs/dbraw/zinc/05/67/86/147056786.db2.gz DIPKHJWRZBPPJG-GFCCVEGCSA-N 1 1 336.388 2.767 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 ZINC000356279511 147198422 /nfs/dbraw/zinc/19/84/22/147198422.db2.gz MGKKJBPXXDMLFE-UHFFFAOYSA-N 1 1 332.335 2.716 10 5 EFBEMO CCNc1ccc(C(=O)N(C)[C@H]2CC[N@@H+](CC)C[C@H]2C)cc1[N+](=O)[O-] ZINC000356286018 147200949 /nfs/dbraw/zinc/20/09/49/147200949.db2.gz QRAYJVYIWAQJDI-CJNGLKHVSA-N 1 1 348.447 2.829 10 5 EFBEMO C[C@@H]1C[C@@H](N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000356340705 147217267 /nfs/dbraw/zinc/21/72/67/147217267.db2.gz PDFJKPYOFXNJEW-CJNGLKHVSA-N 1 1 333.432 2.814 10 5 EFBEMO Cc1nc(CC[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)n[nH]1 ZINC000356785422 147335210 /nfs/dbraw/zinc/33/52/10/147335210.db2.gz NGQVXITYUAVZBO-GOSISDBHSA-N 1 1 337.383 2.943 10 5 EFBEMO Cc1nnc(CC[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)[nH]1 ZINC000356785422 147335213 /nfs/dbraw/zinc/33/52/13/147335213.db2.gz NGQVXITYUAVZBO-GOSISDBHSA-N 1 1 337.383 2.943 10 5 EFBEMO CCC(=O)c1ccc(NC[C@@H]2CCC[N@H+]2CCOC)c([N+](=O)[O-])c1 ZINC000359479550 148097197 /nfs/dbraw/zinc/09/71/97/148097197.db2.gz GWXKQBHXJSXSHO-AWEZNQCLSA-N 1 1 335.404 2.710 10 5 EFBEMO C[C@@H]1CC[C@]2(CC[N@@H+](CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)C2)C1 ZINC000359563513 148124411 /nfs/dbraw/zinc/12/44/11/148124411.db2.gz SPECMNDMJPOQPG-KUHUBIRLSA-N 1 1 343.427 2.996 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NCCCCn2cc[nH+]c2C)c1 ZINC000360111481 148275212 /nfs/dbraw/zinc/27/52/12/148275212.db2.gz JDEFTUQSSNFTND-UHFFFAOYSA-N 1 1 332.360 2.779 10 5 EFBEMO O=[N+]([O-])c1ccn(CC[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)n1 ZINC000364311983 149121795 /nfs/dbraw/zinc/12/17/95/149121795.db2.gz YFOBKIRFCYGVSZ-UHFFFAOYSA-N 1 1 333.779 2.629 10 5 EFBEMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N[C@H]1CCc2nc[nH]c2C1 ZINC000368092169 150033758 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ZINC000273396458 266491691 /nfs/dbraw/zinc/49/16/91/266491691.db2.gz LCIRRMDQWWOXPM-UHFFFAOYSA-N 1 1 341.415 2.632 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](n2cc(C)cn2)C1 ZINC000105899526 273004854 /nfs/dbraw/zinc/00/48/54/273004854.db2.gz BHAVBUBNFVQCHL-INIZCTEOSA-N 1 1 330.388 2.945 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](n2cc(C)cn2)C1 ZINC000105899526 273004856 /nfs/dbraw/zinc/00/48/56/273004856.db2.gz BHAVBUBNFVQCHL-INIZCTEOSA-N 1 1 330.388 2.945 10 5 EFBEMO Cc1cc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)ccc1[N+](=O)[O-] ZINC000175052586 273028117 /nfs/dbraw/zinc/02/81/17/273028117.db2.gz QFZAHDBZPPFPPO-CVEARBPZSA-N 1 1 331.416 2.991 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000175073826 273028415 /nfs/dbraw/zinc/02/84/15/273028415.db2.gz NQQHPGWVHBZTJB-ZBFHGGJFSA-N 1 1 331.416 2.991 10 5 EFBEMO COCCC[N@H+]1CCCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000071922337 274020846 /nfs/dbraw/zinc/02/08/46/274020846.db2.gz KTEFXKIKPNHLNN-UHFFFAOYSA-N 1 1 344.415 2.692 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCCNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000286024903 274119427 /nfs/dbraw/zinc/11/94/27/274119427.db2.gz GAOHEQIYKOBDDY-GFCCVEGCSA-N 1 1 345.403 2.920 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)c2ncnc3sc([N+](=O)[O-])cc32)[C@H](C)C1 ZINC000286650097 274243552 /nfs/dbraw/zinc/24/35/52/274243552.db2.gz CGXXFMSVMXTVDX-PWSUYJOCSA-N 1 1 335.433 2.766 10 5 EFBEMO O=[N+]([O-])c1ccc(CC[N@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)cc1 ZINC000451261931 275035138 /nfs/dbraw/zinc/03/51/38/275035138.db2.gz KEUKRXULGLSCPR-OALUTQOASA-N 1 1 344.386 2.937 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1 ZINC000183076019 275399976 /nfs/dbraw/zinc/39/99/76/275399976.db2.gz SPHHVGXABSVVJT-AMWPYFQMSA-N 1 1 329.400 2.740 10 5 EFBEMO CC(C)c1ccc(CN2C[C@H](C)[N@@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-] ZINC000418121184 276053149 /nfs/dbraw/zinc/05/31/49/276053149.db2.gz WXWDESOBLATHEU-LSDHHAIUSA-N 1 1 335.448 2.605 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000175333191 276183470 /nfs/dbraw/zinc/18/34/70/276183470.db2.gz DNLBREBFNOURBA-HNNXBMFYSA-N 1 1 345.403 2.561 10 5 EFBEMO C[N@H+]1CCO[C@H]2CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])C[C@@H]21 ZINC000408027668 277129249 /nfs/dbraw/zinc/12/92/49/277129249.db2.gz ORLDTUJZRFRGCL-STQMWFEESA-N 1 1 346.214 2.811 10 5 EFBEMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000157181409 277182568 /nfs/dbraw/zinc/18/25/68/277182568.db2.gz QDHQRRMJUOURDZ-PXAZEXFGSA-N 1 1 342.399 2.632 10 5 EFBEMO COc1cc(F)c([N+](=O)[O-])c(N2CCN(c3cc(C)cc[nH+]3)CC2)c1 ZINC000153076357 277822681 /nfs/dbraw/zinc/82/26/81/277822681.db2.gz QEFASOUJEJBLTI-UHFFFAOYSA-N 1 1 346.362 2.773 10 5 EFBEMO C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339149545 280060229 /nfs/dbraw/zinc/06/02/29/280060229.db2.gz SBKLGVZYASPWDD-YGRLFVJLSA-N 1 1 348.321 2.585 10 5 EFBEMO O=C1C[C@@H]([C@H]2CCCC[N@@H+]2Cc2ccc(Cl)cc2[N+](=O)[O-])CN1 ZINC000125768531 280269337 /nfs/dbraw/zinc/26/93/37/280269337.db2.gz YILVZTLPAVQDGJ-TZMCWYRMSA-N 1 1 337.807 2.739 10 5 EFBEMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000291022028 294249905 /nfs/dbraw/zinc/24/99/05/294249905.db2.gz VLTRHKCXTRVALJ-LBPRGKRZSA-N 1 1 332.404 2.926 10 5 EFBEMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)C2)C1 ZINC000293852727 295063877 /nfs/dbraw/zinc/06/38/77/295063877.db2.gz DGEOAVZAKYCHRE-GOSISDBHSA-N 1 1 342.399 2.634 10 5 EFBEMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)C2)C1 ZINC000293852729 295064101 /nfs/dbraw/zinc/06/41/01/295064101.db2.gz DGEOAVZAKYCHRE-SFHVURJKSA-N 1 1 342.399 2.634 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[C@]2(CC[N@H+](C)C2)C1 ZINC000294002226 295096649 /nfs/dbraw/zinc/09/66/49/295096649.db2.gz XJXLTWDBBKTWSM-INIZCTEOSA-N 1 1 337.807 2.724 10 5 EFBEMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)C1 ZINC000294970446 295252436 /nfs/dbraw/zinc/25/24/36/295252436.db2.gz XKGWWBIZEWCNDD-NSHDSACASA-N 1 1 325.796 2.628 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@](C)(F)C1 ZINC000295504854 295332062 /nfs/dbraw/zinc/33/20/62/295332062.db2.gz SSZPCBQWBYVKPD-INIZCTEOSA-N 1 1 339.367 2.756 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000298625130 311009080 /nfs/dbraw/zinc/00/90/80/311009080.db2.gz ALLHMEOZINGHIZ-LLVKDONJSA-N 1 1 325.796 2.852 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCCNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000301081525 311118026 /nfs/dbraw/zinc/11/80/26/311118026.db2.gz LBVMTQWAGSVFHL-LBPRGKRZSA-N 1 1 348.403 2.602 10 5 EFBEMO Cc1cc(N(C)C[C@@H]2CC[N@@H+](C)C2)nc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000301232791 311125920 /nfs/dbraw/zinc/12/59/20/311125920.db2.gz KGFGIRDVGPGZDJ-CQSZACIVSA-N 1 1 341.415 2.748 10 5 EFBEMO COc1cc(F)c([N+](=O)[O-])c(NC[C@@H]2C[N@@H+](CC(C)C)CCO2)c1 ZINC000301498534 311141023 /nfs/dbraw/zinc/14/10/23/311141023.db2.gz CKISYJVZOJIPRC-CYBMUJFWSA-N 1 1 341.383 2.511 10 5 EFBEMO COc1cc(NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000301624774 311148321 /nfs/dbraw/zinc/14/83/21/311148321.db2.gz PKSZKTAZLKHYDQ-TXEJJXNPSA-N 1 1 341.383 2.654 10 5 EFBEMO COC(=O)c1cc(NCC[N@H+]2CCCC[C@@H]2C)cc(C)c1[N+](=O)[O-] ZINC000301685702 311152250 /nfs/dbraw/zinc/15/22/50/311152250.db2.gz LMTZANZZBMQGBL-ZDUSSCGKSA-N 1 1 335.404 2.976 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1N1CCC[C@@H]1C[N@@H+]1CCC[C@@H]1CO ZINC000301728109 311155289 /nfs/dbraw/zinc/15/52/89/311155289.db2.gz RATMFQXIHOHMCH-ZIAGYGMSSA-N 1 1 339.823 2.674 10 5 EFBEMO COC(=O)c1cc(N2CCC([N@H+]3CCC[C@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000301768972 311157455 /nfs/dbraw/zinc/15/74/55/311157455.db2.gz IIWFEIHPKHPEQX-CYBMUJFWSA-N 1 1 347.415 2.835 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1N1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000301880008 311164489 /nfs/dbraw/zinc/16/44/89/311164489.db2.gz ZMHLUFYIGSUTNA-BYICEURKSA-N 1 1 344.459 2.650 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCCCNc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000301935325 311167353 /nfs/dbraw/zinc/16/73/53/311167353.db2.gz QXNRGFNKQASROC-ZDUSSCGKSA-N 1 1 332.408 2.704 10 5 EFBEMO Cc1ccc(N2CCC(Nc3cc(CO)ccc3[N+](=O)[O-])CC2)[nH+]c1 ZINC000302035601 311173820 /nfs/dbraw/zinc/17/38/20/311173820.db2.gz LRUXNPZKQCYNQE-UHFFFAOYSA-N 1 1 342.399 2.871 10 5 EFBEMO C[N@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])cn2)[C@@H]1c1cccs1 ZINC000302169600 311182091 /nfs/dbraw/zinc/18/20/91/311182091.db2.gz TYZSWDVBPSKOGP-SMDDNHRTSA-N 1 1 333.417 2.941 10 5 EFBEMO C[C@H](C[NH+]1CCOCC1)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000330623148 311325283 /nfs/dbraw/zinc/32/52/83/311325283.db2.gz DMAOLBDAIDYUTK-CYBMUJFWSA-N 1 1 349.431 2.799 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000330708159 311330185 /nfs/dbraw/zinc/33/01/85/311330185.db2.gz NJFCEAWROYBCOX-WQVCFCJDSA-N 1 1 349.431 2.651 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000330708159 311330186 /nfs/dbraw/zinc/33/01/86/311330186.db2.gz NJFCEAWROYBCOX-WQVCFCJDSA-N 1 1 349.431 2.651 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000330719081 311330895 /nfs/dbraw/zinc/33/08/95/311330895.db2.gz WBBCKNPSMXDVLS-WQVCFCJDSA-N 1 1 349.431 2.651 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000330719081 311330896 /nfs/dbraw/zinc/33/08/96/311330896.db2.gz WBBCKNPSMXDVLS-WQVCFCJDSA-N 1 1 349.431 2.651 10 5 EFBEMO CC(C)(C)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1O ZINC000330832089 311337385 /nfs/dbraw/zinc/33/73/85/311337385.db2.gz HJAHQZLUAFKCFR-HZPDHXFCSA-N 1 1 349.431 2.652 10 5 EFBEMO CCN1C[C@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1=O ZINC000453375603 312894347 /nfs/dbraw/zinc/89/43/47/312894347.db2.gz XHDAVPJREZUBJO-APWZRJJASA-N 1 1 339.395 2.895 10 5 EFBEMO CCC(=O)N[C@@H]1CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000470182009 313130235 /nfs/dbraw/zinc/13/02/35/313130235.db2.gz IONKRDRUZIMCHE-HFQYIWAZSA-N 1 1 331.416 2.989 10 5 EFBEMO COc1c(C(=O)NCC[N@@H+](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000475255954 313219996 /nfs/dbraw/zinc/21/99/96/313219996.db2.gz PAGOVTLPGKDXSY-UHFFFAOYSA-N 1 1 335.404 2.598 10 5 EFBEMO CC[N@H+]1C[C@@H](C)N(c2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)C[C@@H]1C ZINC000497515960 315393176 /nfs/dbraw/zinc/39/31/76/315393176.db2.gz PZAKNGRVWNYNDK-QWHCGFSZSA-N 1 1 335.404 2.609 10 5 EFBEMO CNc1ccc(C(=O)N2CCC(n3c[nH+]cc3C)CC2)cc1[N+](=O)[O-] ZINC000530296523 317103516 /nfs/dbraw/zinc/10/35/16/317103516.db2.gz JJSVHNBIQFQBKG-UHFFFAOYSA-N 1 1 343.387 2.619 10 5 EFBEMO COC(=O)c1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)o1 ZINC000554848628 318338028 /nfs/dbraw/zinc/33/80/28/318338028.db2.gz PSSALABHQNEZLE-UHFFFAOYSA-N 1 1 332.356 2.957 10 5 EFBEMO Cc1ccccc1C[C@H](C)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000556056523 318376976 /nfs/dbraw/zinc/37/69/76/318376976.db2.gz RASWRNVXXMENDG-HNNXBMFYSA-N 1 1 329.400 2.628 10 5 EFBEMO CCC[N@H+]1CCC[C@@H]1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000580123082 324100418 /nfs/dbraw/zinc/10/04/18/324100418.db2.gz ALMZQVYQUZSARF-QGZVFWFLSA-N 1 1 344.415 2.609 10 5 EFBEMO CCC[N@H+]1CCC[C@H]1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000580123081 324100486 /nfs/dbraw/zinc/10/04/86/324100486.db2.gz ALMZQVYQUZSARF-KRWDZBQOSA-N 1 1 344.415 2.609 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](c3nnc4n3CCC4)C2)cs1 ZINC000161410486 473233779 /nfs/dbraw/zinc/23/37/79/473233779.db2.gz LMEPDNYGUNCCAN-LBPRGKRZSA-N 1 1 333.417 2.574 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](c3nnc4n3CCC4)C2)cs1 ZINC000161410486 473233783 /nfs/dbraw/zinc/23/37/83/473233783.db2.gz LMEPDNYGUNCCAN-LBPRGKRZSA-N 1 1 333.417 2.574 10 5 EFBEMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CC[C@H](CCO)C1 ZINC000124330986 473233931 /nfs/dbraw/zinc/23/39/31/473233931.db2.gz ZCFJGOJHMHKCRA-SNVBAGLBSA-N 1 1 329.194 2.562 10 5 EFBEMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CC[C@H](CCO)C1 ZINC000124330986 473233934 /nfs/dbraw/zinc/23/39/34/473233934.db2.gz ZCFJGOJHMHKCRA-SNVBAGLBSA-N 1 1 329.194 2.562 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000124366237 473237872 /nfs/dbraw/zinc/23/78/72/473237872.db2.gz VXWJQKDAKLCXAD-OKILXGFUSA-N 1 1 349.431 2.521 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000124366237 473237875 /nfs/dbraw/zinc/23/78/75/473237875.db2.gz VXWJQKDAKLCXAD-OKILXGFUSA-N 1 1 349.431 2.521 10 5 EFBEMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1C ZINC000124514944 473254814 /nfs/dbraw/zinc/25/48/14/473254814.db2.gz CHCQVIIJJAZKRD-MNOVXSKESA-N 1 1 325.796 2.803 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000083026649 473313210 /nfs/dbraw/zinc/31/32/10/473313210.db2.gz CEMZIWNTPFONHM-GASCZTMLSA-N 1 1 349.431 2.522 10 5 EFBEMO Cc1sc(C(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000148552947 473320244 /nfs/dbraw/zinc/32/02/44/473320244.db2.gz STOPUYSJJWXTGO-WDEREUQCSA-N 1 1 325.434 2.815 10 5 EFBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1cccc([N+](=O)[O-])c1C ZINC000177212644 473334385 /nfs/dbraw/zinc/33/43/85/473334385.db2.gz UQSJMTKHAQXQMX-AWEZNQCLSA-N 1 1 328.372 2.713 10 5 EFBEMO CC(C)(C)OC(=O)[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083243445 473336845 /nfs/dbraw/zinc/33/68/45/473336845.db2.gz AGNLJRBKVDKWCC-LLVKDONJSA-N 1 1 347.371 2.900 10 5 EFBEMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083243445 473336858 /nfs/dbraw/zinc/33/68/58/473336858.db2.gz AGNLJRBKVDKWCC-LLVKDONJSA-N 1 1 347.371 2.900 10 5 EFBEMO CC[C@H]1CCCCC[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000150744904 473345268 /nfs/dbraw/zinc/34/52/68/473345268.db2.gz CKGMPPBHIGKCOT-LBPRGKRZSA-N 1 1 349.387 2.917 10 5 EFBEMO C[C@@H](C(=O)N1CCC[N@H+](C2CC2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185156322 473346456 /nfs/dbraw/zinc/34/64/56/473346456.db2.gz CBYOYALJZYMNNR-GFCCVEGCSA-N 1 1 335.379 2.534 10 5 EFBEMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000113197903 473364745 /nfs/dbraw/zinc/36/47/45/473364745.db2.gz JCFYWZVXVOLQCM-LBPRGKRZSA-N 1 1 325.434 2.959 10 5 EFBEMO Cc1csc(NC(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])n1 ZINC000429270016 478095127 /nfs/dbraw/zinc/09/51/27/478095127.db2.gz WUPNTCQGNMGLFD-UHFFFAOYSA-N 1 1 334.401 2.823 10 5 EFBEMO O=C(N1CC[NH+](CCCF)CC1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601650066 478927216 /nfs/dbraw/zinc/92/72/16/478927216.db2.gz ONQBLEZEPDTTPZ-UHFFFAOYSA-N 1 1 349.406 2.520 10 5 EFBEMO CCOc1ccc(C(=O)NCCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000008351877 471683869 /nfs/dbraw/zinc/68/38/69/471683869.db2.gz ULMFCZWQDZVQDX-AWEZNQCLSA-N 1 1 349.431 2.988 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)CCc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000087324254 472325707 /nfs/dbraw/zinc/32/57/07/472325707.db2.gz MLDXQJONWFSBLY-PBHICJAKSA-N 1 1 333.432 2.716 10 5 EFBEMO CN1CC[NH+](CCCSc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000097164259 472470823 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EFBEMO Cc1cnc(CC[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)s1 ZINC000157338211 472809538 /nfs/dbraw/zinc/80/95/38/472809538.db2.gz COKHQVSVSROPNZ-GFCCVEGCSA-N 1 1 348.428 2.861 10 5 EFBEMO Cc1cnc(CC[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)s1 ZINC000157338211 472809543 /nfs/dbraw/zinc/80/95/43/472809543.db2.gz COKHQVSVSROPNZ-GFCCVEGCSA-N 1 1 348.428 2.861 10 5 EFBEMO Cc1cnc(CC[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])s1 ZINC000157417093 472818561 /nfs/dbraw/zinc/81/85/61/472818561.db2.gz GNHJQCCPWCTCNO-UHFFFAOYSA-N 1 1 348.428 2.863 10 5 EFBEMO CCOCC[N@H+]1CCN(Cc2c(F)cccc2[N+](=O)[O-])C[C@H]1CC ZINC000106116669 472828933 /nfs/dbraw/zinc/82/89/33/472828933.db2.gz AQLWFAJMWYCPSG-CQSZACIVSA-N 1 1 339.411 2.667 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)cn1 ZINC000073869899 472891906 /nfs/dbraw/zinc/89/19/06/472891906.db2.gz GHXIVQUXSWTEKK-UHFFFAOYSA-N 1 1 330.363 2.841 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134607117 472937250 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EFBEMO CCCCNC(=O)[C@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000051058326 473021227 /nfs/dbraw/zinc/02/12/27/473021227.db2.gz BLFPQRJZAGNKQK-ZDUSSCGKSA-N 1 1 325.434 2.785 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000093011112 473026996 /nfs/dbraw/zinc/02/69/96/473026996.db2.gz MUGATZJQVJDWPK-SUQGKYDKSA-N 1 1 345.443 2.795 10 5 EFBEMO C[C@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000159588439 473041944 /nfs/dbraw/zinc/04/19/44/473041944.db2.gz SZUMGPORBXPOFH-STQMWFEESA-N 1 1 343.383 2.941 10 5 EFBEMO COCc1cc([N+](=O)[O-])ccc1N1C[C@@H]2C[N@H+]3CCCC[C@@H]3[C@@H]2C1 ZINC000080648488 473062657 /nfs/dbraw/zinc/06/26/57/473062657.db2.gz LCHVRYNNILLLKV-YXJHDRRASA-N 1 1 331.416 2.662 10 5 EFBEMO Cc1c(CN2CCN(C[C@H]3CCCC[N@@H+]3C)CC2)cccc1[N+](=O)[O-] ZINC000109751175 473117332 /nfs/dbraw/zinc/11/73/32/473117332.db2.gz ZYHVBMVMQJVVQI-GOSISDBHSA-N 1 1 346.475 2.505 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(F)c([N+](=O)[O-])cc2F)[C@H](C)C1 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OLWIKDIUTVNCAV-ZDUSSCGKSA-N 1 1 342.827 2.580 10 5 EFBEMO Cn1cc([C@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000116318950 473651283 /nfs/dbraw/zinc/65/12/83/473651283.db2.gz BPEQBJKGBHHZOM-AWEZNQCLSA-N 1 1 330.388 2.587 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186671553 473721585 /nfs/dbraw/zinc/72/15/85/473721585.db2.gz KVUYRDLIMROORK-GFCCVEGCSA-N 1 1 337.445 2.873 10 5 EFBEMO COc1ccc(OCC[N@H+]2CCC[C@H]2c2cnn(C)c2)c([N+](=O)[O-])c1 ZINC000173655807 473906005 /nfs/dbraw/zinc/90/60/05/473906005.db2.gz PRMXZLHZXYJULM-HNNXBMFYSA-N 1 1 346.387 2.553 10 5 EFBEMO CCc1ccc([C@H]2CCCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000173654239 473906937 /nfs/dbraw/zinc/90/69/37/473906937.db2.gz NECUXBOMNGCQRC-GOEBONIOSA-N 1 1 348.403 2.535 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](C)C1 ZINC000246985391 474023876 /nfs/dbraw/zinc/02/38/76/474023876.db2.gz JWHNRUZRJFNWGH-GUYCJALGSA-N 1 1 349.431 2.623 10 5 EFBEMO 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C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000348249295 475522966 /nfs/dbraw/zinc/52/29/66/475522966.db2.gz WJNDHSSIFDROMD-QKCSRTOESA-N 1 1 348.321 2.607 10 5 EFBEMO COc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H](CO)C2)ccc1[N+](=O)[O-] ZINC000352687284 475531062 /nfs/dbraw/zinc/53/10/62/475531062.db2.gz VNQSNORXIWGONY-RYUDHWBXSA-N 1 1 348.321 2.596 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H](CO)C2)ccc1[N+](=O)[O-] ZINC000352687284 475531066 /nfs/dbraw/zinc/53/10/66/475531066.db2.gz VNQSNORXIWGONY-RYUDHWBXSA-N 1 1 348.321 2.596 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCCC[C@@H]1CCO ZINC000342049881 475533708 /nfs/dbraw/zinc/53/37/08/475533708.db2.gz QDFXTPSKFLWSEX-OAHLLOKOSA-N 1 1 349.431 2.859 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)c2c(c1)COCO2 ZINC000355207472 475743848 /nfs/dbraw/zinc/74/38/48/475743848.db2.gz OCUFMGPFEZZYKO-KBPBESRZSA-N 1 1 348.399 2.710 10 5 EFBEMO COc1cc(C[NH2+]Cc2ccc3cc[nH]c3n2)c([N+](=O)[O-])cc1OC ZINC000353211988 475774593 /nfs/dbraw/zinc/77/45/93/475774593.db2.gz PFMZRZPALRGNSJ-UHFFFAOYSA-N 1 1 342.355 2.778 10 5 EFBEMO Nc1nccc([C@@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000338365273 475830552 /nfs/dbraw/zinc/83/05/52/475830552.db2.gz LXNLKHDJENHEAI-GFCCVEGCSA-N 1 1 347.806 2.830 10 5 EFBEMO Nc1nccc([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000338365273 475830560 /nfs/dbraw/zinc/83/05/60/475830560.db2.gz LXNLKHDJENHEAI-GFCCVEGCSA-N 1 1 347.806 2.830 10 5 EFBEMO CN(Cc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CC[N@H+](C2CC2)C1 ZINC000353326368 475871845 /nfs/dbraw/zinc/87/18/45/475871845.db2.gz BZEDXRGGEZBIDH-AWEZNQCLSA-N 1 1 341.358 2.865 10 5 EFBEMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000297932948 475928380 /nfs/dbraw/zinc/92/83/80/475928380.db2.gz VDGSVBCLKAJBGF-AOOOYVTPSA-N 1 1 345.321 2.778 10 5 EFBEMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000297932948 475928385 /nfs/dbraw/zinc/92/83/85/475928385.db2.gz VDGSVBCLKAJBGF-AOOOYVTPSA-N 1 1 345.321 2.778 10 5 EFBEMO CCOC(=O)CC(C)(C)CC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000346961724 475993681 /nfs/dbraw/zinc/99/36/81/475993681.db2.gz KXYZBVVMYZZVCJ-UHFFFAOYSA-N 1 1 335.404 2.717 10 5 EFBEMO C[C@]12CC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C[C@H]1C2(F)F ZINC000298325579 476056276 /nfs/dbraw/zinc/05/62/76/476056276.db2.gz RCTUVTWBYJWPNM-HIFRSBDPSA-N 1 1 340.326 2.938 10 5 EFBEMO O=C([C@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1)N1CCCC1 ZINC000353564677 476082695 /nfs/dbraw/zinc/08/26/95/476082695.db2.gz DJUBUSYGYQFYKA-AFCDSYGPSA-N 1 1 343.427 2.942 10 5 EFBEMO C[N@@H+](Cc1ccccc1)C1CN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000343637169 476095581 /nfs/dbraw/zinc/09/55/81/476095581.db2.gz XTIIFTACLBLGJS-UHFFFAOYSA-N 1 1 337.383 2.792 10 5 EFBEMO C[N@@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@H]1c1ccc(Cl)cc1 ZINC000340581129 476119832 /nfs/dbraw/zinc/11/98/32/476119832.db2.gz WTOUPMTWZQCMRZ-DZGCQCFKSA-N 1 1 348.790 2.752 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@H]1c1ccc(Cl)cc1 ZINC000340581129 476119839 /nfs/dbraw/zinc/11/98/39/476119839.db2.gz WTOUPMTWZQCMRZ-DZGCQCFKSA-N 1 1 348.790 2.752 10 5 EFBEMO CO[C@@H]1CC[C@@H]([NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000353668086 476172799 /nfs/dbraw/zinc/17/27/99/476172799.db2.gz FPNDNGOXOOBXMP-BMFZPTHFSA-N 1 1 330.388 2.575 10 5 EFBEMO CCOc1ccc(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000347293088 476236709 /nfs/dbraw/zinc/23/67/09/476236709.db2.gz SMEHMILVDYTVJY-HNNXBMFYSA-N 1 1 347.415 2.740 10 5 EFBEMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC3(C2)CCCCC3)c1 ZINC000303955661 476252840 /nfs/dbraw/zinc/25/28/40/476252840.db2.gz XDASBWFYVQPPQC-INIZCTEOSA-N 1 1 334.416 2.991 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H]4COCC[C@H]43)n2)cc1 ZINC000362450312 476261187 /nfs/dbraw/zinc/26/11/87/476261187.db2.gz JPDXXEFDGLSBED-DZGCQCFKSA-N 1 1 344.371 2.646 10 5 EFBEMO C[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@@H]1c1cccs1 ZINC000357218581 476293845 /nfs/dbraw/zinc/29/38/45/476293845.db2.gz HYTIKJNHGLZUHT-IAQYHMDHSA-N 1 1 348.428 2.797 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000360666894 476334551 /nfs/dbraw/zinc/33/45/51/476334551.db2.gz SBZHPBWZLNXMQV-QAPCUYQASA-N 1 1 345.443 2.859 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000360666895 476334599 /nfs/dbraw/zinc/33/45/99/476334599.db2.gz SBZHPBWZLNXMQV-YJBOKZPZSA-N 1 1 345.443 2.859 10 5 EFBEMO COc1cc(Cc2noc([C@H]3CC[N@@H+](C)[C@@H](C)C3)n2)ccc1[N+](=O)[O-] ZINC000351258752 476382457 /nfs/dbraw/zinc/38/24/57/476382457.db2.gz CWHOWEWSRPNISP-AAEUAGOBSA-N 1 1 346.387 2.775 10 5 EFBEMO CSc1cccc(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-] ZINC000362764093 476395732 /nfs/dbraw/zinc/39/57/32/476395732.db2.gz YYLHZLAZUYZJMA-LBPRGKRZSA-N 1 1 335.429 2.625 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H]3OCC[C@H]3C2)ccc1Br ZINC000369684286 476477241 /nfs/dbraw/zinc/47/72/41/476477241.db2.gz TYWOTYIRAJSUJJ-SMDDNHRTSA-N 1 1 341.205 2.968 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H]3OCC[C@H]3C2)ccc1Br ZINC000369684286 476477248 /nfs/dbraw/zinc/47/72/48/476477248.db2.gz TYWOTYIRAJSUJJ-SMDDNHRTSA-N 1 1 341.205 2.968 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1CN(C)[C@@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000377634416 476490595 /nfs/dbraw/zinc/49/05/95/476490595.db2.gz WZADGYBQASYAOS-LJQANCHMSA-N 1 1 346.475 2.504 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1CN(C)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000377634416 476490598 /nfs/dbraw/zinc/49/05/98/476490598.db2.gz WZADGYBQASYAOS-LJQANCHMSA-N 1 1 346.475 2.504 10 5 EFBEMO C[C@@H]1C[N@H+](Cc2cccc(Nc3ccncc3[N+](=O)[O-])c2)C[C@H](C)O1 ZINC000361004725 476536908 /nfs/dbraw/zinc/53/69/08/476536908.db2.gz ZRJVRROTRWMFLN-OKILXGFUSA-N 1 1 342.399 2.765 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1c2c(nn1C)CCCC2 ZINC000361077256 476584868 /nfs/dbraw/zinc/58/48/68/476584868.db2.gz GYCWHVNCBQMAPS-UHFFFAOYSA-N 1 1 344.415 2.896 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](c3ccncn3)C2)c([N+](=O)[O-])c1 ZINC000365486318 476588774 /nfs/dbraw/zinc/58/87/74/476588774.db2.gz BJZJUGRDVQLOSG-GFCCVEGCSA-N 1 1 343.343 2.673 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3ccncn3)C2)c([N+](=O)[O-])c1 ZINC000365486318 476588776 /nfs/dbraw/zinc/58/87/76/476588776.db2.gz BJZJUGRDVQLOSG-GFCCVEGCSA-N 1 1 343.343 2.673 10 5 EFBEMO CC[C@H](NC(=O)N1CCC[N@H+]2CCC[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000363312515 476647604 /nfs/dbraw/zinc/64/76/04/476647604.db2.gz LUOMKWDHGPEPTK-SJORKVTESA-N 1 1 346.431 2.926 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H](C)C1 ZINC000444659966 476727420 /nfs/dbraw/zinc/72/74/20/476727420.db2.gz DVCKEISKEQMIOL-LRDDRELGSA-N 1 1 331.420 2.633 10 5 EFBEMO CC[C@@H]1CC[C@H](C)[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000451950866 476740021 /nfs/dbraw/zinc/74/00/21/476740021.db2.gz ATUSAKKEYCJJAS-UONOGXRCSA-N 1 1 340.445 2.879 10 5 EFBEMO CC[C@@H]1CC[C@H](C)[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000451950866 476740028 /nfs/dbraw/zinc/74/00/28/476740028.db2.gz ATUSAKKEYCJJAS-UONOGXRCSA-N 1 1 340.445 2.879 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000451972865 476753389 /nfs/dbraw/zinc/75/33/89/476753389.db2.gz PKDGVFLTOAKPDG-MRXNPFEDSA-N 1 1 349.337 2.872 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000451972865 476753398 /nfs/dbraw/zinc/75/33/98/476753398.db2.gz PKDGVFLTOAKPDG-MRXNPFEDSA-N 1 1 349.337 2.872 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000451972864 476753792 /nfs/dbraw/zinc/75/37/92/476753792.db2.gz PKDGVFLTOAKPDG-INIZCTEOSA-N 1 1 349.337 2.872 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000451972864 476753798 /nfs/dbraw/zinc/75/37/98/476753798.db2.gz PKDGVFLTOAKPDG-INIZCTEOSA-N 1 1 349.337 2.872 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000375279781 476754202 /nfs/dbraw/zinc/75/42/02/476754202.db2.gz OTPAQLQCOOQFEM-SFHVURJKSA-N 1 1 347.415 2.734 10 5 EFBEMO CC[C@@H]1CC[C@H](C)[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000451973401 476756336 /nfs/dbraw/zinc/75/63/36/476756336.db2.gz XDRCKIGNDQAJIA-NWDGAFQWSA-N 1 1 349.387 2.773 10 5 EFBEMO CC[C@@H]1CC[C@H](C)[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000451973401 476756340 /nfs/dbraw/zinc/75/63/40/476756340.db2.gz XDRCKIGNDQAJIA-NWDGAFQWSA-N 1 1 349.387 2.773 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000370325990 476756965 /nfs/dbraw/zinc/75/69/65/476756965.db2.gz NMWQENNGDAHOEC-SADTYBKJSA-N 1 1 329.400 2.741 10 5 EFBEMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC(C)=C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000430283300 476803577 /nfs/dbraw/zinc/80/35/77/476803577.db2.gz JAXDNOCKEFGBIZ-DGCLKSJQSA-N 1 1 333.388 2.828 10 5 EFBEMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC(C)=C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000430283300 476803584 /nfs/dbraw/zinc/80/35/84/476803584.db2.gz JAXDNOCKEFGBIZ-DGCLKSJQSA-N 1 1 333.388 2.828 10 5 EFBEMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC(C)=C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000430283297 476803625 /nfs/dbraw/zinc/80/36/25/476803625.db2.gz JAXDNOCKEFGBIZ-AAEUAGOBSA-N 1 1 333.388 2.828 10 5 EFBEMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC(C)=C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000430283297 476803633 /nfs/dbraw/zinc/80/36/33/476803633.db2.gz JAXDNOCKEFGBIZ-AAEUAGOBSA-N 1 1 333.388 2.828 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC(C)=C[C@@H](C)C1 ZINC000430287682 476805682 /nfs/dbraw/zinc/80/56/82/476805682.db2.gz YQXKKISRGSYHPF-GFCCVEGCSA-N 1 1 333.388 2.830 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2cc([N+](=O)[O-])c(C)s2)CC1 ZINC000375382469 476807393 /nfs/dbraw/zinc/80/73/93/476807393.db2.gz XQCXQUHGIJWNOS-UHFFFAOYSA-N 1 1 334.401 2.947 10 5 EFBEMO Cc1cc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000456982137 476815877 /nfs/dbraw/zinc/81/58/77/476815877.db2.gz GDLKQHBZERQUBB-MRXNPFEDSA-N 1 1 325.368 2.690 10 5 EFBEMO Cc1cc(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000456982135 476815888 /nfs/dbraw/zinc/81/58/88/476815888.db2.gz GDLKQHBZERQUBB-INIZCTEOSA-N 1 1 325.368 2.690 10 5 EFBEMO COC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000452094449 476819475 /nfs/dbraw/zinc/81/94/75/476819475.db2.gz WFBVNKBDHXTYQP-KGLIPLIRSA-N 1 1 335.404 2.670 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@@H]1C ZINC000446301459 476857465 /nfs/dbraw/zinc/85/74/65/476857465.db2.gz YWFMNWCJQMNVAM-MNOVXSKESA-N 1 1 325.796 2.721 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000446301459 476857472 /nfs/dbraw/zinc/85/74/72/476857472.db2.gz YWFMNWCJQMNVAM-MNOVXSKESA-N 1 1 325.796 2.721 10 5 EFBEMO CCOc1ccc(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000457077341 476862226 /nfs/dbraw/zinc/86/22/26/476862226.db2.gz CHWVPDXFLAEULI-AWEZNQCLSA-N 1 1 335.404 2.548 10 5 EFBEMO Cn1ccnc1[C@H]([NH2+][C@H]1CCC[C@H](CO)C1)c1ccc([N+](=O)[O-])cc1 ZINC000414337154 476879084 /nfs/dbraw/zinc/87/90/84/476879084.db2.gz KNWHNNKJXPKEPC-JLJPHGGASA-N 1 1 344.415 2.558 10 5 EFBEMO O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@H]2CCC[N@H+]2Cc2ccccc21 ZINC000370581358 476882256 /nfs/dbraw/zinc/88/22/56/476882256.db2.gz CQBHPTJNASICAL-OAHLLOKOSA-N 1 1 338.367 2.615 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2CCCC23CCC3)cc1[N+](=O)[O-] ZINC000446848054 476927655 /nfs/dbraw/zinc/92/76/55/476927655.db2.gz DODKKWMGYJOEFH-UHFFFAOYSA-N 1 1 334.372 2.665 10 5 EFBEMO C[C@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000408026543 476936880 /nfs/dbraw/zinc/93/68/80/476936880.db2.gz YRRLMNGKEVYHGE-QWHCGFSZSA-N 1 1 342.399 2.775 10 5 EFBEMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@@H]([NH3+])c1ccccc1 ZINC000423237003 476972601 /nfs/dbraw/zinc/97/26/01/476972601.db2.gz HTRIOZXQOHPGCU-SUMWQHHRSA-N 1 1 342.399 2.602 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H]1C[C@@H](O)c1cnn(C)c1 ZINC000375781496 477002930 /nfs/dbraw/zinc/00/29/30/477002930.db2.gz XRRCFPPKQWVSTF-RPVQJOFSSA-N 1 1 344.415 2.977 10 5 EFBEMO CC[N@H+](CCN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)CCC(F)(F)F ZINC000447675107 477033903 /nfs/dbraw/zinc/03/39/03/477033903.db2.gz KHXDRZCWKKESGN-UHFFFAOYSA-N 1 1 345.325 2.579 10 5 EFBEMO CC[N@@H+](CCN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)CCC(F)(F)F ZINC000447675107 477033910 /nfs/dbraw/zinc/03/39/10/477033910.db2.gz KHXDRZCWKKESGN-UHFFFAOYSA-N 1 1 345.325 2.579 10 5 EFBEMO C[C@H]1CCC[N@@H+](CCCCN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)C1 ZINC000447678609 477034049 /nfs/dbraw/zinc/03/40/49/477034049.db2.gz LALVAUUPFCSCSP-ZDUSSCGKSA-N 1 1 331.420 2.817 10 5 EFBEMO Cc1cc[nH+]c(N2CCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)c1 ZINC000447684725 477036819 /nfs/dbraw/zinc/03/68/19/477036819.db2.gz DFKFNQGXDKIRHY-UHFFFAOYSA-N 1 1 338.371 2.501 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@@H]1CC[N@H+](C(C)C)C1 ZINC000447802246 477060781 /nfs/dbraw/zinc/06/07/81/477060781.db2.gz ITGYKKNDQJOKPE-SNVBAGLBSA-N 1 1 341.795 2.929 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@@H]1CCS(C)(=O)=O ZINC000366553377 477065500 /nfs/dbraw/zinc/06/55/00/477065500.db2.gz KPAAWVSGGGULKJ-OAHLLOKOSA-N 1 1 340.445 2.692 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@@H]1CCS(C)(=O)=O ZINC000366553377 477065503 /nfs/dbraw/zinc/06/55/03/477065503.db2.gz KPAAWVSGGGULKJ-OAHLLOKOSA-N 1 1 340.445 2.692 10 5 EFBEMO CC[C@@H]([NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(=O)NC ZINC000453421327 477228291 /nfs/dbraw/zinc/22/82/91/477228291.db2.gz WMWPHNKLQMXGGX-IAGOWNOFSA-N 1 1 327.384 2.798 10 5 EFBEMO CC[N@H+]1CC[C@H](CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000448761322 477277398 /nfs/dbraw/zinc/27/73/98/477277398.db2.gz IXAOAFWUOJTDLP-SNVBAGLBSA-N 1 1 345.321 2.685 10 5 EFBEMO O=C(CC[N@@H+]1CCCCC[C@H]1CCO)Nc1ccc([N+](=O)[O-])cc1 ZINC000411690458 477330600 /nfs/dbraw/zinc/33/06/00/477330600.db2.gz ATRMXTGCTWGQPI-HNNXBMFYSA-N 1 1 335.404 2.550 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@H](C2CCC2)C1 ZINC000411842904 477390803 /nfs/dbraw/zinc/39/08/03/477390803.db2.gz HNBMAWJFUNNZBC-KRWDZBQOSA-N 1 1 347.415 2.733 10 5 EFBEMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000419009602 477493319 /nfs/dbraw/zinc/49/33/19/477493319.db2.gz WIPJZUNBGRUFAC-QWRGUYRKSA-N 1 1 347.337 2.505 10 5 EFBEMO COCC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)Cc1ccnn1C ZINC000426525378 477713086 /nfs/dbraw/zinc/71/30/86/477713086.db2.gz VSQDGVHOQJEOKY-RVDMUPIBSA-N 1 1 344.415 2.880 10 5 EFBEMO COCC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)Cc1ccnn1C ZINC000426525378 477713093 /nfs/dbraw/zinc/71/30/93/477713093.db2.gz VSQDGVHOQJEOKY-RVDMUPIBSA-N 1 1 344.415 2.880 10 5 EFBEMO COCC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)Cc1ccnn1C ZINC000426525376 477714153 /nfs/dbraw/zinc/71/41/53/477714153.db2.gz VSQDGVHOQJEOKY-PTNGSMBKSA-N 1 1 344.415 2.880 10 5 EFBEMO COCC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)Cc1ccnn1C ZINC000426525376 477714156 /nfs/dbraw/zinc/71/41/56/477714156.db2.gz VSQDGVHOQJEOKY-PTNGSMBKSA-N 1 1 344.415 2.880 10 5 EFBEMO C[C@]1(F)CCC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1 ZINC000451112268 477830671 /nfs/dbraw/zinc/83/06/71/477830671.db2.gz HXRPPEIDJXDMQO-INIZCTEOSA-N 1 1 337.351 2.717 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@@H](C(C)C)C1 ZINC000438478870 477847264 /nfs/dbraw/zinc/84/72/64/477847264.db2.gz AGGWFJKFJAFNNM-QWHCGFSZSA-N 1 1 335.404 2.908 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](C(C)C)C1 ZINC000438509102 477854902 /nfs/dbraw/zinc/85/49/02/477854902.db2.gz XRZWUKZUKVXYOT-CYBMUJFWSA-N 1 1 335.404 2.910 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c1 ZINC000451339681 477961827 /nfs/dbraw/zinc/96/18/27/477961827.db2.gz ITQIPHMLMFSUQB-KSZLIROESA-N 1 1 334.416 2.989 10 5 EFBEMO C[C@@]12C[N@@H+](CC(=O)Nc3ccccc3[N+](=O)[O-])C[C@H]1[C@@H]1C=C[C@H]2C1 ZINC000451368206 477977416 /nfs/dbraw/zinc/97/74/16/477977416.db2.gz LBHOPAMDMFHVNS-COJSNBRMSA-N 1 1 327.384 2.677 10 5 EFBEMO CC[C@@H]1C[C@H]([NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CCO1 ZINC000421370574 478060314 /nfs/dbraw/zinc/06/03/14/478060314.db2.gz BXFDRRPHORSFLT-DJIMGWMZSA-N 1 1 344.415 2.965 10 5 EFBEMO CN(CC[N@@H+]1CCOC(C)(C)C1)c1c2ccccc2ncc1[N+](=O)[O-] ZINC000487767551 478070642 /nfs/dbraw/zinc/07/06/42/478070642.db2.gz GSVDXCASRAKXPB-UHFFFAOYSA-N 1 1 344.415 2.690 10 5 EFBEMO CN(CC[N@H+]1CCOC(C)(C)C1)c1c2ccccc2ncc1[N+](=O)[O-] ZINC000487767551 478070648 /nfs/dbraw/zinc/07/06/48/478070648.db2.gz GSVDXCASRAKXPB-UHFFFAOYSA-N 1 1 344.415 2.690 10 5 EFBEMO O=[N+]([O-])c1cnc2ccccc2c1NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000487764815 478070680 /nfs/dbraw/zinc/07/06/80/478070680.db2.gz WUDUKYJTJAEZTG-CQSZACIVSA-N 1 1 326.400 2.994 10 5 EFBEMO Cc1cc(F)ccc1C[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000487965733 478093769 /nfs/dbraw/zinc/09/37/69/478093769.db2.gz URBCOQKASRQOHQ-KRWDZBQOSA-N 1 1 348.374 2.914 10 5 EFBEMO COc1ccc(C[NH2+]C2(C(=O)Nc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000495154152 478131914 /nfs/dbraw/zinc/13/19/14/478131914.db2.gz GNZHEIMXKKPSNY-UHFFFAOYSA-N 1 1 341.367 2.864 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@H+](C3CCC3)C[C@H](C)C2)c1 ZINC000488753605 478180698 /nfs/dbraw/zinc/18/06/98/478180698.db2.gz RQFMXFFOJAWTBL-ZDUSSCGKSA-N 1 1 347.415 2.692 10 5 EFBEMO O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000600227410 478296886 /nfs/dbraw/zinc/29/68/86/478296886.db2.gz BGWJAWWGTNMEPC-KRWDZBQOSA-N 1 1 331.416 2.661 10 5 EFBEMO O=C(CNc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000600228394 478297955 /nfs/dbraw/zinc/29/79/55/478297955.db2.gz KWTUQEGBSWGTPZ-OAHLLOKOSA-N 1 1 346.431 2.530 10 5 EFBEMO CNc1ccc(C(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000600228398 478298706 /nfs/dbraw/zinc/29/87/06/478298706.db2.gz LDIHBASJLGFDFY-OAHLLOKOSA-N 1 1 346.431 2.773 10 5 EFBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)c1ccc(F)cc1[N+](=O)[O-] ZINC000600228475 478299421 /nfs/dbraw/zinc/29/94/21/478299421.db2.gz BDGQMRPLJCRYRD-AWEZNQCLSA-N 1 1 335.379 2.871 10 5 EFBEMO CC(C)(NC(=O)Cn1c[nH+]c2c1CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000538683879 478373372 /nfs/dbraw/zinc/37/33/72/478373372.db2.gz FQTQVXWYHKDQLU-UHFFFAOYSA-N 1 1 342.399 2.722 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600468734 478381532 /nfs/dbraw/zinc/38/15/32/478381532.db2.gz HCKOSVJDAPNSJA-HNNXBMFYSA-N 1 1 331.416 2.958 10 5 EFBEMO CCc1ccc(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000600474572 478384500 /nfs/dbraw/zinc/38/45/00/478384500.db2.gz YXWCJDJZTIQPBZ-MRXNPFEDSA-N 1 1 331.416 2.904 10 5 EFBEMO Cc1nc2ccc(Cn3c(=O)c([N+](=O)[O-])cc4c3CCCC4)cc2[nH]1 ZINC000563119165 478452739 /nfs/dbraw/zinc/45/27/39/478452739.db2.gz MXOLZNYRQZENPG-UHFFFAOYSA-N 1 1 338.367 2.868 10 5 EFBEMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCC1([NH3+])CCOCC1 ZINC000600707442 478479418 /nfs/dbraw/zinc/47/94/18/478479418.db2.gz HPGKTQKFQNEDRJ-ZDUSSCGKSA-N 1 1 339.461 2.563 10 5 EFBEMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(N)CCOCC1 ZINC000600707442 478479427 /nfs/dbraw/zinc/47/94/27/478479427.db2.gz HPGKTQKFQNEDRJ-ZDUSSCGKSA-N 1 1 339.461 2.563 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(OC3CCC3)CC2)c1 ZINC000591357318 478535372 /nfs/dbraw/zinc/53/53/72/478535372.db2.gz YQBJJFFOAAHQAJ-UHFFFAOYSA-N 1 1 348.399 2.915 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000597856826 478542102 /nfs/dbraw/zinc/54/21/02/478542102.db2.gz AUWNKCBLMJOHPG-CQSZACIVSA-N 1 1 344.415 2.608 10 5 EFBEMO C[C@H](C(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C)c1ccc([N+](=O)[O-])cc1F ZINC000597856844 478542330 /nfs/dbraw/zinc/54/23/30/478542330.db2.gz BFUINLXGWMESLG-AAEUAGOBSA-N 1 1 337.395 2.826 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000597857633 478543807 /nfs/dbraw/zinc/54/38/07/478543807.db2.gz HQPXYBSEWKIRSV-OAHLLOKOSA-N 1 1 344.415 2.539 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000597857316 478544415 /nfs/dbraw/zinc/54/44/15/478544415.db2.gz DDIMQXCVDRQZPY-INIZCTEOSA-N 1 1 348.447 2.776 10 5 EFBEMO CCOc1ccc(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000597859281 478544717 /nfs/dbraw/zinc/54/47/17/478544717.db2.gz SQCOPBXOKBPGNW-ZDUSSCGKSA-N 1 1 335.404 2.596 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000597859095 478544778 /nfs/dbraw/zinc/54/47/78/478544778.db2.gz RUXSOIWVEYDHTF-LBPRGKRZSA-N 1 1 330.388 2.679 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C ZINC000597859736 478545813 /nfs/dbraw/zinc/54/58/13/478545813.db2.gz GLEYZWSWFGAJEY-LBPRGKRZSA-N 1 1 335.404 2.596 10 5 EFBEMO CCN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CC[N@@H+](C)C1 ZINC000597945064 478590019 /nfs/dbraw/zinc/59/00/19/478590019.db2.gz HKSWIBPRWAZYQU-GFCCVEGCSA-N 1 1 345.321 2.780 10 5 EFBEMO CC(C)[N@@H+](C)CCCNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000600995702 478603093 /nfs/dbraw/zinc/60/30/93/478603093.db2.gz LEZLMQKNIOKYHK-UHFFFAOYSA-N 1 1 333.432 2.863 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cccnc1N(C)C ZINC000595005551 478626809 /nfs/dbraw/zinc/62/68/09/478626809.db2.gz AGMDQDDOPYHXAN-LBPRGKRZSA-N 1 1 330.388 2.915 10 5 EFBEMO CCN(C(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@@H+](CC)C1 ZINC000598041272 478629209 /nfs/dbraw/zinc/62/92/09/478629209.db2.gz KUCMRUMHCDVJHX-GFCCVEGCSA-N 1 1 325.796 2.805 10 5 EFBEMO CCN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598040696 478629527 /nfs/dbraw/zinc/62/95/27/478629527.db2.gz QNJYABGMCVPHJL-CYBMUJFWSA-N 1 1 325.796 2.805 10 5 EFBEMO CCN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](CC)C1 ZINC000598042245 478629605 /nfs/dbraw/zinc/62/96/05/478629605.db2.gz WNVZXNAAOTXPKL-YESZJQIVSA-N 1 1 331.416 2.641 10 5 EFBEMO C[C@@H]1C[C@@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC[N@H+]1C ZINC000582585116 478635130 /nfs/dbraw/zinc/63/51/30/478635130.db2.gz CTAITBNREMAQBJ-KGLIPLIRSA-N 1 1 349.434 2.894 10 5 EFBEMO Cc1ccccc1C[NH+]1CCN(c2ncc(F)cc2[N+](=O)[O-])CC1 ZINC000601101530 478656369 /nfs/dbraw/zinc/65/63/69/478656369.db2.gz YSBIMYSRTRJHQP-UHFFFAOYSA-N 1 1 330.363 2.760 10 5 EFBEMO CCc1ccc([C@H]([NH2+]C[C@@H]2CCC(=O)N2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000595090993 478656897 /nfs/dbraw/zinc/65/68/97/478656897.db2.gz QNTCEXNVNBTKBW-SCLBCKFNSA-N 1 1 343.383 2.708 10 5 EFBEMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCN1CCCc3ccccc31)CC2 ZINC000542548187 478661947 /nfs/dbraw/zinc/66/19/47/478661947.db2.gz GUFOZHOLAVEOMB-UHFFFAOYSA-N 1 1 338.411 2.801 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)[C@H](C)C1 ZINC000601119821 478667356 /nfs/dbraw/zinc/66/73/56/478667356.db2.gz WSLJQEFEVXAIJK-ZJUUUORDSA-N 1 1 349.357 2.514 10 5 EFBEMO CCC[N@@H+](C)C[C@@H]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 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CC[C@H](CSC)[N@@H+](C)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000593018991 479127643 /nfs/dbraw/zinc/12/76/43/479127643.db2.gz HLPPQHUBKLBGLN-CYBMUJFWSA-N 1 1 326.418 2.955 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(Cn2c[nH+]c3c2C[C@@H](C)[C@H](C)C3)c1 ZINC000593031741 479134689 /nfs/dbraw/zinc/13/46/89/479134689.db2.gz LRSWQDQBMQJRLI-VXGBXAGGSA-N 1 1 343.383 2.997 10 5 EFBEMO COCC[N@H+]1CCC[C@H]1CNc1cc(OC)c([N+](=O)[O-])cc1Cl ZINC000596109927 479143571 /nfs/dbraw/zinc/14/35/71/479143571.db2.gz HQRPTGIPSXQPQN-NSHDSACASA-N 1 1 343.811 2.780 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](OC(C)C)C2)c1 ZINC000593054661 479147239 /nfs/dbraw/zinc/14/72/39/479147239.db2.gz YPXVMVCGSHVLSP-HNNXBMFYSA-N 1 1 336.388 2.771 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](OC(C)C)C2)c1 ZINC000593054661 479147249 /nfs/dbraw/zinc/14/72/49/479147249.db2.gz YPXVMVCGSHVLSP-HNNXBMFYSA-N 1 1 336.388 2.771 10 5 EFBEMO C[C@@H]1C[N@@H+](CCN(C)c2ccc3cnccc3c2[N+](=O)[O-])C[C@H](C)O1 ZINC000599082973 479154262 /nfs/dbraw/zinc/15/42/62/479154262.db2.gz ZXUGESJIAWDCTF-OKILXGFUSA-N 1 1 344.415 2.688 10 5 EFBEMO C[C@@H]1C[N@H+](CCN(C)c2ccc3cnccc3c2[N+](=O)[O-])C[C@H](C)O1 ZINC000599082973 479154265 /nfs/dbraw/zinc/15/42/65/479154265.db2.gz ZXUGESJIAWDCTF-OKILXGFUSA-N 1 1 344.415 2.688 10 5 EFBEMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCOC1 ZINC000593068890 479156378 /nfs/dbraw/zinc/15/63/78/479156378.db2.gz QEDGUUVOUDZDJU-GFCCVEGCSA-N 1 1 341.795 2.688 10 5 EFBEMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCOC1 ZINC000593068890 479156385 /nfs/dbraw/zinc/15/63/85/479156385.db2.gz QEDGUUVOUDZDJU-GFCCVEGCSA-N 1 1 341.795 2.688 10 5 EFBEMO CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000593070165 479157052 /nfs/dbraw/zinc/15/70/52/479157052.db2.gz UTAJPZBJLAJRNO-GFCCVEGCSA-N 1 1 341.795 2.688 10 5 EFBEMO CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000593070165 479157059 /nfs/dbraw/zinc/15/70/59/479157059.db2.gz UTAJPZBJLAJRNO-GFCCVEGCSA-N 1 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C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593115216 479181890 /nfs/dbraw/zinc/18/18/90/479181890.db2.gz AMUDVZIJJFZSLB-QMTHXVAHSA-N 1 1 325.315 2.653 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593115216 479181894 /nfs/dbraw/zinc/18/18/94/479181894.db2.gz AMUDVZIJJFZSLB-QMTHXVAHSA-N 1 1 325.315 2.653 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c1 ZINC000593115279 479183363 /nfs/dbraw/zinc/18/33/63/479183363.db2.gz CDGRJEKZXLOFDC-CQSZACIVSA-N 1 1 326.299 2.613 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c1 ZINC000593115279 479183366 /nfs/dbraw/zinc/18/33/66/479183366.db2.gz CDGRJEKZXLOFDC-CQSZACIVSA-N 1 1 326.299 2.613 10 5 EFBEMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1 ZINC000596180346 479183798 /nfs/dbraw/zinc/18/37/98/479183798.db2.gz XBXGOMKOAQNXRJ-LBPRGKRZSA-N 1 1 345.378 2.594 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593119348 479187022 /nfs/dbraw/zinc/18/70/22/479187022.db2.gz WFECGTQVGTXBOQ-QMTHXVAHSA-N 1 1 325.315 2.653 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593119348 479187032 /nfs/dbraw/zinc/18/70/32/479187032.db2.gz WFECGTQVGTXBOQ-QMTHXVAHSA-N 1 1 325.315 2.653 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@@]4(CC4(F)F)C3)n2)c1 ZINC000593118827 479187944 /nfs/dbraw/zinc/18/79/44/479187944.db2.gz YRGKRTDHDWLNSI-CQSZACIVSA-N 1 1 336.298 2.876 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@]4(CC4(F)F)C3)n2)c1 ZINC000593118827 479187951 /nfs/dbraw/zinc/18/79/51/479187951.db2.gz YRGKRTDHDWLNSI-CQSZACIVSA-N 1 1 336.298 2.876 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCCC[C@@H]3C3(O)CC3)o2)cc1 ZINC000556780281 479204330 /nfs/dbraw/zinc/20/43/30/479204330.db2.gz VRELRDVQKIFQRJ-CQSZACIVSA-N 1 1 344.371 2.524 10 5 EFBEMO CCOc1cc(N2CCC([N@H+]3CCCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000596267873 479230662 /nfs/dbraw/zinc/23/06/62/479230662.db2.gz ARTYQFUENOGVKG-UHFFFAOYSA-N 1 1 349.431 2.685 10 5 EFBEMO Cc1cc(N2CCC([N@H+]3CCCOCC3)CC2)c(F)cc1[N+](=O)[O-] ZINC000596269648 479232016 /nfs/dbraw/zinc/23/20/16/479232016.db2.gz WNILCUZWTLAHLF-UHFFFAOYSA-N 1 1 337.395 2.733 10 5 EFBEMO C[C@@H]1CN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1CCO ZINC000596275379 479233834 /nfs/dbraw/zinc/23/38/34/479233834.db2.gz RBTRXVFGBNTHCQ-MNOVXSKESA-N 1 1 347.337 2.505 10 5 EFBEMO C[C@H]1CCC[C@H](C)[NH+]1CCNCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000574191855 479238582 /nfs/dbraw/zinc/23/85/82/479238582.db2.gz KBWNNFFMUKGBPI-GJZGRUSLSA-N 1 1 348.447 2.776 10 5 EFBEMO COC(=O)Cc1ccc(NC[C@@H]2CC[N@H+]2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000596309838 479247887 /nfs/dbraw/zinc/24/78/87/479247887.db2.gz XYKYBFJPQAEZNX-ZDUSSCGKSA-N 1 1 335.404 2.595 10 5 EFBEMO C[C@H]1C[C@@H]1C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000599370496 479273883 /nfs/dbraw/zinc/27/38/83/479273883.db2.gz IXZRMFFUJLBFKK-QWHCGFSZSA-N 1 1 329.404 2.639 10 5 EFBEMO COc1ccc(NC(=O)CC[N@H+]2CC[C@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC000611179861 479304472 /nfs/dbraw/zinc/30/44/72/479304472.db2.gz LYLFLOSCWZAQBM-JTQLQIEISA-N 1 1 343.330 2.519 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](C(F)F)C1 ZINC000611180116 479304517 /nfs/dbraw/zinc/30/45/17/479304517.db2.gz SCLNYONJYFNBFT-LLVKDONJSA-N 1 1 327.331 2.819 10 5 EFBEMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(c2ccncc2[N+](=O)[O-])C1 ZINC000596461368 479305039 /nfs/dbraw/zinc/30/50/39/479305039.db2.gz HOCITJAYZPAEGB-INIZCTEOSA-N 1 1 326.400 2.743 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)n1 ZINC000596513690 479323689 /nfs/dbraw/zinc/32/36/89/479323689.db2.gz CWPXZBGCZYPDBO-HUUCEWRRSA-N 1 1 346.431 2.662 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599552921 479331481 /nfs/dbraw/zinc/33/14/81/479331481.db2.gz KTERIODNSZQNMK-UPJWGTAASA-N 1 1 335.429 2.892 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599552921 479331483 /nfs/dbraw/zinc/33/14/83/479331483.db2.gz KTERIODNSZQNMK-UPJWGTAASA-N 1 1 335.429 2.892 10 5 EFBEMO CCC[N@@H+](C)CC(C)(C)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000596539644 479333622 /nfs/dbraw/zinc/33/36/22/479333622.db2.gz AQOFWDAKLWYRFT-UHFFFAOYSA-N 1 1 343.449 2.531 10 5 EFBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@@H]([C@@H]3CCOC3)C1)OCCO2 ZINC000611287571 479338717 /nfs/dbraw/zinc/33/87/17/479338717.db2.gz RTBIFGDWPOXXHD-ZIAGYGMSSA-N 1 1 348.399 2.615 10 5 EFBEMO CCN1CC[NH+]([C@H](C)CNc2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593455955 479348266 /nfs/dbraw/zinc/34/82/66/479348266.db2.gz WDQPKVOQTPYHGM-CQSZACIVSA-N 1 1 343.431 2.581 10 5 EFBEMO CC1(C)Cc2n[nH]cc2C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000596598801 479353351 /nfs/dbraw/zinc/35/33/51/479353351.db2.gz KTLPVDRAMHVSDR-UHFFFAOYSA-N 1 1 330.388 2.781 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)[C@H]2CCC[C@H]21 ZINC000599651439 479369778 /nfs/dbraw/zinc/36/97/78/479369778.db2.gz BKNXLGJUUAAHMC-XHSDSOJGSA-N 1 1 348.399 2.767 10 5 EFBEMO C[C@@H](CNc1cc(N)c([N+](=O)[O-])c(CO)c1)[N@@H+](C)Cc1ccccc1 ZINC000587974960 479377930 /nfs/dbraw/zinc/37/79/30/479377930.db2.gz FJNMVICFWHDFRE-ZDUSSCGKSA-N 1 1 344.415 2.602 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@@H]21 ZINC000599662769 479378487 /nfs/dbraw/zinc/37/84/87/479378487.db2.gz XJLWZOAQEHGAOZ-BRWVUGGUSA-N 1 1 348.399 2.637 10 5 EFBEMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CCCC3(CC3)CC2)cc1 ZINC000599673529 479383743 /nfs/dbraw/zinc/38/37/43/479383743.db2.gz SEBZNFJGAMOSDY-UHFFFAOYSA-N 1 1 338.429 2.635 10 5 EFBEMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CCCC3(CC3)CC2)cc1 ZINC000599673529 479383747 /nfs/dbraw/zinc/38/37/47/479383747.db2.gz SEBZNFJGAMOSDY-UHFFFAOYSA-N 1 1 338.429 2.635 10 5 EFBEMO COc1ccc(NC(=O)C[N@H+]2CCCC3(CC3)CC2)c([N+](=O)[O-])c1 ZINC000599673802 479384422 /nfs/dbraw/zinc/38/44/22/479384422.db2.gz ZESJIOVECJQMGL-UHFFFAOYSA-N 1 1 333.388 2.808 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CC[C@@H]4CC[C@@H](O)[C@@H]43)co2)cc1 ZINC000599682705 479388887 /nfs/dbraw/zinc/38/88/87/479388887.db2.gz INEPHODQFMNTRA-IUIKQTSFSA-N 1 1 329.356 2.595 10 5 EFBEMO COC(=O)C1C[C@H](C)[NH+](Cc2cc([N+](=O)[O-])ccc2OC)[C@@H](C)C1 ZINC000599689876 479392268 /nfs/dbraw/zinc/39/22/68/479392268.db2.gz LDRKJYZSBBFGLF-RYUDHWBXSA-N 1 1 336.388 2.765 10 5 EFBEMO COC(=O)[C@@H]1C[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1 ZINC000599699730 479396936 /nfs/dbraw/zinc/39/69/36/479396936.db2.gz YTNOABCPCVRNGN-DABQJJPHSA-N 1 1 336.388 2.765 10 5 EFBEMO COC(=O)[C@@H]1C[C@@H](C)[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1 ZINC000599699730 479396942 /nfs/dbraw/zinc/39/69/42/479396942.db2.gz YTNOABCPCVRNGN-DABQJJPHSA-N 1 1 336.388 2.765 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000611502427 479397258 /nfs/dbraw/zinc/39/72/58/479397258.db2.gz SEQUOTBPBHYATL-DGCLKSJQSA-N 1 1 339.367 2.612 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000611501374 479397402 /nfs/dbraw/zinc/39/74/02/479397402.db2.gz BEPKEJFCLDHYFZ-AAEUAGOBSA-N 1 1 339.367 2.612 10 5 EFBEMO C[C@H]1CC[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@H]1F ZINC000611501769 479397481 /nfs/dbraw/zinc/39/74/81/479397481.db2.gz IEIUGKXONBKFOQ-WCQYABFASA-N 1 1 337.351 2.573 10 5 EFBEMO C[C@H]1CC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@H]1F ZINC000611501769 479397482 /nfs/dbraw/zinc/39/74/82/479397482.db2.gz IEIUGKXONBKFOQ-WCQYABFASA-N 1 1 337.351 2.573 10 5 EFBEMO COc1cc(C[N@@H+](CCO)CCc2ccccc2)ccc1[N+](=O)[O-] ZINC000611515735 479403403 /nfs/dbraw/zinc/40/34/03/479403403.db2.gz NERCSIQFNCUVSW-UHFFFAOYSA-N 1 1 330.384 2.640 10 5 EFBEMO COC(=O)[C@@H]1C[C@@H](C)[N@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000599713165 479403469 /nfs/dbraw/zinc/40/34/69/479403469.db2.gz ZVGBSVAGFXJUMD-BTTYYORXSA-N 1 1 336.388 2.636 10 5 EFBEMO Cn1ccnc1[C@@H]([NH2+]CCC1(CO)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000593692096 479425824 /nfs/dbraw/zinc/42/58/24/479425824.db2.gz JDCCOUAWSREFMQ-INIZCTEOSA-N 1 1 344.415 2.560 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](c3ccncn3)C2)c1 ZINC000603833346 479433169 /nfs/dbraw/zinc/43/31/69/479433169.db2.gz HGGLWXBOMPBMRQ-CQSZACIVSA-N 1 1 328.372 2.643 10 5 EFBEMO CCC[N@@H+](CC)CCNC(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599829499 479442581 /nfs/dbraw/zinc/44/25/81/479442581.db2.gz DTMCAJHYFBYSRP-UHFFFAOYSA-N 1 1 345.403 2.996 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000618455938 479452462 /nfs/dbraw/zinc/45/24/62/479452462.db2.gz QPAYRLDALLFEKB-CYBMUJFWSA-N 1 1 337.807 2.771 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NCC[NH+]2Cc3ccccc3C2)c1 ZINC000611747242 479465778 /nfs/dbraw/zinc/46/57/78/479465778.db2.gz QZWLPDKMKUSUKW-UHFFFAOYSA-N 1 1 341.367 2.809 10 5 EFBEMO C[C@@H]1CC[N@@H+](CCNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000575745037 479466191 /nfs/dbraw/zinc/46/61/91/479466191.db2.gz NFASBYVDJDEFGL-CQSZACIVSA-N 1 1 349.434 2.753 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CC)[C@H]1CC[N@@H+](C)C1 ZINC000596891195 479476014 /nfs/dbraw/zinc/47/60/14/479476014.db2.gz SGAWDQMCEKOTIR-ZDUSSCGKSA-N 1 1 336.392 2.551 10 5 EFBEMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CC)[C@@H]1CC[N@@H+](C)C1 ZINC000596891194 479476234 /nfs/dbraw/zinc/47/62/34/479476234.db2.gz SGAWDQMCEKOTIR-CYBMUJFWSA-N 1 1 336.392 2.551 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C2Cc3ccccc3C2)c1 ZINC000589496874 479532838 /nfs/dbraw/zinc/53/28/38/479532838.db2.gz VHNDMIOHTPZRMB-UHFFFAOYSA-N 1 1 340.379 2.981 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H](C)CCSC)c1 ZINC000589502413 479533377 /nfs/dbraw/zinc/53/33/77/479533377.db2.gz SKYSFCKYGFAEEZ-LLVKDONJSA-N 1 1 326.418 2.955 10 5 EFBEMO Cn1cc(C[N@@H+]2CCC[C@@H]2CC(=O)c2ccc(F)cc2)c([N+](=O)[O-])n1 ZINC000602796109 479559560 /nfs/dbraw/zinc/55/95/60/479559560.db2.gz KAJDMXMPTKTWBD-OAHLLOKOSA-N 1 1 346.362 2.705 10 5 EFBEMO Cn1cc(C[N@H+]2CCC[C@@H]2CC(=O)c2ccc(F)cc2)c([N+](=O)[O-])n1 ZINC000602796109 479559566 /nfs/dbraw/zinc/55/95/66/479559566.db2.gz KAJDMXMPTKTWBD-OAHLLOKOSA-N 1 1 346.362 2.705 10 5 EFBEMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH+]2C3CCCC2CCC3)cc1 ZINC000612083544 479575968 /nfs/dbraw/zinc/57/59/68/479575968.db2.gz DKASUFIYBNTHLT-UHFFFAOYSA-N 1 1 338.429 2.776 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c1 ZINC000590049508 479595199 /nfs/dbraw/zinc/59/51/99/479595199.db2.gz FCTWNAFQSSBIHH-HIFRSBDPSA-N 1 1 340.326 2.859 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c1 ZINC000590049508 479595204 /nfs/dbraw/zinc/59/52/04/479595204.db2.gz FCTWNAFQSSBIHH-HIFRSBDPSA-N 1 1 340.326 2.859 10 5 EFBEMO CCOC1(C)CC[NH+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1 ZINC000590049314 479595621 /nfs/dbraw/zinc/59/56/21/479595621.db2.gz TUZKFVLMCNNGOT-UHFFFAOYSA-N 1 1 336.388 2.772 10 5 EFBEMO C[N@H+]1C[C@@H]2CCN(Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)[C@@H]2C1 ZINC000590052939 479597575 /nfs/dbraw/zinc/59/75/75/479597575.db2.gz QRWBQCKEUGZGRP-XJKSGUPXSA-N 1 1 344.440 2.854 10 5 EFBEMO O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC(Oc2cnccn2)CC1 ZINC000618824844 479606065 /nfs/dbraw/zinc/60/60/65/479606065.db2.gz HFZXEJVVGVSMRX-HYXAFXHYSA-N 1 1 340.383 2.941 10 5 EFBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@@](O)(C3CC3)C2)c1 ZINC000597203890 479618089 /nfs/dbraw/zinc/61/80/89/479618089.db2.gz AMECPFPSSFESSJ-INIZCTEOSA-N 1 1 342.342 2.933 10 5 EFBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@@](O)(C3CC3)C2)c1 ZINC000597203890 479618093 /nfs/dbraw/zinc/61/80/93/479618093.db2.gz AMECPFPSSFESSJ-INIZCTEOSA-N 1 1 342.342 2.933 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](N(C)C(=O)N(C)C)C1 ZINC000597224644 479630768 /nfs/dbraw/zinc/63/07/68/479630768.db2.gz NIIAEJANWYBGAZ-IDKBZEPQSA-N 1 1 346.431 2.686 10 5 EFBEMO C[C@@H]1CC[N@@H+](CC(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000579244545 479678077 /nfs/dbraw/zinc/67/80/77/479678077.db2.gz ORVYRRPCCGGTDN-MLGOLLRUSA-N 1 1 335.429 2.511 10 5 EFBEMO O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000619252181 479732359 /nfs/dbraw/zinc/73/23/59/479732359.db2.gz GHYRHDULMLOERU-KGLIPLIRSA-N 1 1 341.770 2.507 10 5 EFBEMO O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000619253401 479733554 /nfs/dbraw/zinc/73/35/54/479733554.db2.gz WWLWWLZMQOYBAD-CHWSQXEVSA-N 1 1 341.770 2.507 10 5 EFBEMO O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000619252427 479733649 /nfs/dbraw/zinc/73/36/49/479733649.db2.gz LCWOOPBNMXCOMZ-NWDGAFQWSA-N 1 1 341.770 2.507 10 5 EFBEMO O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000619252429 479733805 /nfs/dbraw/zinc/73/38/05/479733805.db2.gz LCWOOPBNMXCOMZ-VXGBXAGGSA-N 1 1 341.770 2.507 10 5 EFBEMO CC1(C)C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C[C@]2(CCOC2)O1 ZINC000619434241 479789132 /nfs/dbraw/zinc/78/91/32/479789132.db2.gz PNMHPIAKPDWCGP-YEODSOHDSA-N 1 1 332.400 2.878 10 5 EFBEMO CC1(C)C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C[C@]2(CCOC2)O1 ZINC000619434241 479789137 /nfs/dbraw/zinc/78/91/37/479789137.db2.gz PNMHPIAKPDWCGP-YEODSOHDSA-N 1 1 332.400 2.878 10 5 EFBEMO COc1c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)cccc1[N+](=O)[O-] ZINC000619438208 479790180 /nfs/dbraw/zinc/79/01/80/479790180.db2.gz LONQVDJOGCNEIJ-KGLIPLIRSA-N 1 1 347.415 2.691 10 5 EFBEMO C[C@H]([NH2+]C1CCN(C[C@@H]2CCCO2)CC1)c1ccccc1[N+](=O)[O-] ZINC000610420514 480301909 /nfs/dbraw/zinc/30/19/09/480301909.db2.gz DMOGHUWAIDIKGW-HOCLYGCPSA-N 1 1 333.432 2.889 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H](n4ccnc4)C3)nc2c1 ZINC000610581637 480343232 /nfs/dbraw/zinc/34/32/32/480343232.db2.gz FQFUIZHOPZYXFU-ZDUSSCGKSA-N 1 1 327.344 2.770 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H](n4ccnc4)C3)nc2c1 ZINC000610581637 480343235 /nfs/dbraw/zinc/34/32/35/480343235.db2.gz FQFUIZHOPZYXFU-ZDUSSCGKSA-N 1 1 327.344 2.770 10 5 EFBEMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000643364536 481437326 /nfs/dbraw/zinc/43/73/26/481437326.db2.gz IGMQBSICSOHSET-AWEZNQCLSA-N 1 1 349.434 2.848 10 5 EFBEMO C[C@H]1CC[C@](CO)([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000187990672 533770512 /nfs/dbraw/zinc/77/05/12/533770512.db2.gz KXBKPWCFGWDLQR-SJCJKPOMSA-N 1 1 346.387 2.628 10 5 EFBEMO COc1cc(C[N@@H+](C)[C@]2(CO)CC[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000188011953 533794047 /nfs/dbraw/zinc/79/40/47/533794047.db2.gz OSDJNNGVMHIGST-BDJLRTHQSA-N 1 1 326.368 2.725 10 5 EFBEMO COc1cc(C[N@@H+](C)[C@]2(CO)CC[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000188011978 533794112 /nfs/dbraw/zinc/79/41/12/533794112.db2.gz OSDJNNGVMHIGST-MEDUHNTESA-N 1 1 326.368 2.725 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+](C)[C@]2(CO)CC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000188021618 533900994 /nfs/dbraw/zinc/90/09/94/533900994.db2.gz CJIGNDQIGZGFDS-SCLBCKFNSA-N 1 1 349.431 2.715 10 5 EFBEMO CSc1ccc(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000155325621 534187732 /nfs/dbraw/zinc/18/77/32/534187732.db2.gz SNQFRDMFPXUULG-AAEUAGOBSA-N 1 1 337.445 2.775 10 5 EFBEMO CCOCC[N@H+]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000120869630 519920497 /nfs/dbraw/zinc/92/04/97/519920497.db2.gz FDHYIFWPXKNHOX-BVBGJJFLSA-N 1 1 333.432 2.651 10 5 EFBEMO C[NH+](C)[C@H](CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccco1 ZINC000120292339 522080966 /nfs/dbraw/zinc/08/09/66/522080966.db2.gz YHVHXYYYWIOKAU-OAHLLOKOSA-N 1 1 342.355 2.702 10 5 EFBEMO CCn1cnnc1[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000195520204 523598855 /nfs/dbraw/zinc/59/88/55/523598855.db2.gz RISPMFUGTKAFNE-GFCCVEGCSA-N 1 1 333.367 2.725 10 5 EFBEMO CCn1cnnc1[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000195520204 523598859 /nfs/dbraw/zinc/59/88/59/523598859.db2.gz RISPMFUGTKAFNE-GFCCVEGCSA-N 1 1 333.367 2.725 10 5 EFBEMO COCC[N@H+](C)CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180404281 523609771 /nfs/dbraw/zinc/60/97/71/523609771.db2.gz KHKYKZPUJAVQAD-IBGZPJMESA-N 1 1 343.427 2.852 10 5 EFBEMO COCC[N@@H+](C)CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180404281 523609781 /nfs/dbraw/zinc/60/97/81/523609781.db2.gz KHKYKZPUJAVQAD-IBGZPJMESA-N 1 1 343.427 2.852 10 5 EFBEMO Cc1cc(N2CC[N@H+]3CCC[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000195302935 525084023 /nfs/dbraw/zinc/08/40/23/525084023.db2.gz QRLVCMVMFCCILG-MRXNPFEDSA-N 1 1 339.399 2.645 10 5 EFBEMO CSc1ccc(C(=O)N2CC[N@@H+]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000195097170 525958150 /nfs/dbraw/zinc/95/81/50/525958150.db2.gz XWDVSDYNDDPYKU-CYBMUJFWSA-N 1 1 335.429 2.627 10 5 EFBEMO CSc1ccc(C(=O)N2CC[N@H+]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000195097170 525958154 /nfs/dbraw/zinc/95/81/54/525958154.db2.gz XWDVSDYNDDPYKU-CYBMUJFWSA-N 1 1 335.429 2.627 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000075968990 526085030 /nfs/dbraw/zinc/08/50/30/526085030.db2.gz NSZLKCYHKUVCDA-CRAIPNDOSA-N 1 1 333.432 2.843 10 5 EFBEMO O=C(NC[C@H]1CCCC[N@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000067361094 526589844 /nfs/dbraw/zinc/58/98/44/526589844.db2.gz ZCVZJAKNSHWQOK-OAHLLOKOSA-N 1 1 343.383 2.972 10 5 EFBEMO O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000195317342 526636953 /nfs/dbraw/zinc/63/69/53/526636953.db2.gz RLBOEYRNEPLTPU-ZDUSSCGKSA-N 1 1 331.397 2.730 10 5 EFBEMO Cc1nc(C[C@H]2CCC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)no1 ZINC000195518231 526923195 /nfs/dbraw/zinc/92/31/95/526923195.db2.gz YJSIVOUBDLUECI-GFCCVEGCSA-N 1 1 334.351 2.880 10 5 EFBEMO Cc1nc(C[C@H]2CCC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)no1 ZINC000195518231 526923196 /nfs/dbraw/zinc/92/31/96/526923196.db2.gz YJSIVOUBDLUECI-GFCCVEGCSA-N 1 1 334.351 2.880 10 5 EFBEMO O=C1CC[C@@H]2C[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@@H]2N1C1CC1 ZINC000178939018 526992729 /nfs/dbraw/zinc/99/27/29/526992729.db2.gz ZIQWTKNZLFXVJF-WBMJQRKESA-N 1 1 347.390 2.709 10 5 EFBEMO O=C1CC[C@@H]2C[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@@H]2N1C1CC1 ZINC000178939018 526992736 /nfs/dbraw/zinc/99/27/36/526992736.db2.gz ZIQWTKNZLFXVJF-WBMJQRKESA-N 1 1 347.390 2.709 10 5 EFBEMO O=C1CC[C@H]2C[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@@H]2N1C1CC1 ZINC000245710516 526995775 /nfs/dbraw/zinc/99/57/75/526995775.db2.gz ZIQWTKNZLFXVJF-LRDDRELGSA-N 1 1 347.390 2.709 10 5 EFBEMO O=C1CC[C@H]2C[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@@H]2N1C1CC1 ZINC000245710516 526995783 /nfs/dbraw/zinc/99/57/83/526995783.db2.gz ZIQWTKNZLFXVJF-LRDDRELGSA-N 1 1 347.390 2.709 10 5 EFBEMO O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCC[N@H+](C3CC3)CC2)c1 ZINC000179733749 527370762 /nfs/dbraw/zinc/37/07/62/527370762.db2.gz FAQMWSLZFOENMO-UHFFFAOYSA-N 1 1 341.358 2.866 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](Oc2cccnc2)C1 ZINC000152526093 527404815 /nfs/dbraw/zinc/40/48/15/527404815.db2.gz JGCMEPPFQYLGBK-HNNXBMFYSA-N 1 1 329.356 2.522 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000184353442 527526689 /nfs/dbraw/zinc/52/66/89/527526689.db2.gz WGSMOQBVTJYXGL-SADTYBKJSA-N 1 1 329.400 2.693 10 5 EFBEMO Cc1nn(C)c(C)c1[C@@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000137049742 527659700 /nfs/dbraw/zinc/65/97/00/527659700.db2.gz WBLDEQAKNZKCRJ-IRXDYDNUSA-N 1 1 344.415 2.816 10 5 EFBEMO CCC[N@@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cn3)c2C1 ZINC000363871668 535000329 /nfs/dbraw/zinc/00/03/29/535000329.db2.gz GIWAHVPRJSKUTO-UHFFFAOYSA-N 1 1 326.356 2.968 10 5 EFBEMO CCC[N@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cn3)c2C1 ZINC000363871668 535000339 /nfs/dbraw/zinc/00/03/39/535000339.db2.gz GIWAHVPRJSKUTO-UHFFFAOYSA-N 1 1 326.356 2.968 10 5 EFBEMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@H]1CCC(=O)N1 ZINC000412074426 535093940 /nfs/dbraw/zinc/09/39/40/535093940.db2.gz JQWXOMDJPMLZPC-GFCCVEGCSA-N 1 1 325.796 2.737 10 5 EFBEMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@H]1CCC(=O)N1 ZINC000412074426 535093945 /nfs/dbraw/zinc/09/39/45/535093945.db2.gz JQWXOMDJPMLZPC-GFCCVEGCSA-N 1 1 325.796 2.737 10 5 EFBEMO CCc1[nH]nc(C(=O)Nc2cccc3c2C[N@H+](C2CC2)C3)c1[N+](=O)[O-] ZINC000365199909 536009038 /nfs/dbraw/zinc/00/90/38/536009038.db2.gz GPKNPILAUDCPHW-UHFFFAOYSA-N 1 1 341.371 2.611 10 5 EFBEMO COCC[C@H]1CCCC[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000342708499 536821892 /nfs/dbraw/zinc/82/18/92/536821892.db2.gz YGBVMBVORUJFMJ-OAHLLOKOSA-N 1 1 349.431 2.980 10 5 EFBEMO C[N@@H+]1CCC[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000681996149 549674997 /nfs/dbraw/zinc/67/49/97/549674997.db2.gz JNGNQCCCWFKFDV-AWEZNQCLSA-N 1 1 335.407 2.505 10 5 EFBEMO C[N@H+]1CCC[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000681996149 549675001 /nfs/dbraw/zinc/67/50/01/549675001.db2.gz JNGNQCCCWFKFDV-AWEZNQCLSA-N 1 1 335.407 2.505 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(C(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000754414742 575433488 /nfs/dbraw/zinc/43/34/88/575433488.db2.gz KCGQEYHLBLDJHX-GTISMEIMSA-N 1 1 331.416 2.939 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000755297999 575571668 /nfs/dbraw/zinc/57/16/68/575571668.db2.gz WFYQNQWECGJMHE-ISBHARSQSA-N 1 1 329.400 2.599 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H]1COc3ccccc3O1)C2 ZINC000757163585 575830399 /nfs/dbraw/zinc/83/03/99/575830399.db2.gz NWIWGERQTOOPEO-AWEZNQCLSA-N 1 1 326.352 2.793 10 5 EFBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H]1COc3ccccc3O1)C2 ZINC000757163585 575830400 /nfs/dbraw/zinc/83/04/00/575830400.db2.gz NWIWGERQTOOPEO-AWEZNQCLSA-N 1 1 326.352 2.793 10 5 EFBEMO Cc1nn(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)c2ncc([N+](=O)[O-])cc12 ZINC000766094336 577106845 /nfs/dbraw/zinc/10/68/45/577106845.db2.gz WTQZCBAQGHWZKX-JTQLQIEISA-N 1 1 343.309 2.880 10 5 EFBEMO Cc1nn(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)c2ncc([N+](=O)[O-])cc12 ZINC000766094336 577106848 /nfs/dbraw/zinc/10/68/48/577106848.db2.gz WTQZCBAQGHWZKX-JTQLQIEISA-N 1 1 343.309 2.880 10 5 EFBEMO CC[N@H+]1CC[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000770008095 577397482 /nfs/dbraw/zinc/39/74/82/577397482.db2.gz JCYKANIFAGJRIY-JTQLQIEISA-N 1 1 326.784 2.712 10 5 EFBEMO CN(Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)[C@H]1CC[N@H+](C2CC2)C1 ZINC000774627718 581495610 /nfs/dbraw/zinc/49/56/10/581495610.db2.gz STYLZKSPBPYZKV-ZDUSSCGKSA-N 1 1 349.822 2.724 10 5 EFBEMO C[C@@](CO)([NH2+]Cc1cnn(C2CCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000922306053 1265428084 /nfs/dbraw/zinc/42/80/84/1265428084.db2.gz JXFAYRARZIFRRD-KRWDZBQOSA-N 1 1 330.388 2.514 10 5 EFBEMO C[C@@](CO)([NH2+]Cc1nccc2c1CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000922308651 1265441136 /nfs/dbraw/zinc/44/11/36/1265441136.db2.gz ZAGUCMPHHZMLDB-IBGZPJMESA-N 1 1 341.411 2.866 10 5 EFBEMO CCC[N@H+](CCNC(=O)c1ccc[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC001691175818 1248506209 /nfs/dbraw/zinc/50/62/09/1248506209.db2.gz PGLHMGDRWWPTSS-UHFFFAOYSA-N 1 1 330.388 2.565 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1ccc[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC001691175818 1248506230 /nfs/dbraw/zinc/50/62/30/1248506230.db2.gz PGLHMGDRWWPTSS-UHFFFAOYSA-N 1 1 330.388 2.565 10 5 EFBEMO CO[C@H]1CC[C@@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000851035537 1250765054 /nfs/dbraw/zinc/76/50/54/1250765054.db2.gz QDESCTGNJYSJOM-PVAVHDDUSA-N 1 1 348.399 2.527 10 5 EFBEMO CO[C@H]1CC[C@@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000851035537 1250765067 /nfs/dbraw/zinc/76/50/67/1250765067.db2.gz QDESCTGNJYSJOM-PVAVHDDUSA-N 1 1 348.399 2.527 10 5 EFBEMO CC/C(C)=C/C(=O)N1C[C@@H]2C[N@@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001484406479 1252535682 /nfs/dbraw/zinc/53/56/82/1252535682.db2.gz QEIYNXLQKAIRFH-COGRFCOTSA-N 1 1 349.456 2.903 10 5 EFBEMO CC/C(C)=C/C(=O)N1C[C@@H]2C[N@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001484406479 1252535692 /nfs/dbraw/zinc/53/56/92/1252535692.db2.gz QEIYNXLQKAIRFH-COGRFCOTSA-N 1 1 349.456 2.903 10 5 EFBEMO CC(C)CCC(=O)N1C[C@@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001484402596 1252542674 /nfs/dbraw/zinc/54/26/74/1252542674.db2.gz SKLLAGXPMIRNEI-CALCHBBNSA-N 1 1 345.443 2.921 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)c1 ZINC000824655700 1278222721 /nfs/dbraw/zinc/22/27/21/1278222721.db2.gz ZASKKDIEARTERB-SGIREYDYSA-N 1 1 340.807 2.610 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]([C@@H](O)C(F)(F)F)C2)cc1Cl ZINC000825123695 1278418793 /nfs/dbraw/zinc/41/87/93/1278418793.db2.gz BVMLACAROCKPGC-JOYOIKCWSA-N 1 1 338.713 2.993 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]([C@@H](O)C(F)(F)F)C2)cc1Cl ZINC000825123695 1278418796 /nfs/dbraw/zinc/41/87/96/1278418796.db2.gz BVMLACAROCKPGC-JOYOIKCWSA-N 1 1 338.713 2.993 10 5 EFBEMO Cc1ccc2c(c1)[C@@H]1C[N@@H+](C)CC[C@@H]1N2C(=O)c1ccc([N+](=O)[O-])o1 ZINC000791980287 1278473986 /nfs/dbraw/zinc/47/39/86/1278473986.db2.gz UBVQICXGPGYAGP-ZFWWWQNUSA-N 1 1 341.367 2.944 10 5 EFBEMO C[C@@H]1[C@@H](CO)CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC001169812151 1273178516 /nfs/dbraw/zinc/17/85/16/1273178516.db2.gz QZBKVGDLASFFCL-NXEZZACHSA-N 1 1 329.194 2.560 10 5 EFBEMO C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC001169812151 1273178519 /nfs/dbraw/zinc/17/85/19/1273178519.db2.gz QZBKVGDLASFFCL-NXEZZACHSA-N 1 1 329.194 2.560 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC001143981985 1279012650 /nfs/dbraw/zinc/01/26/50/1279012650.db2.gz CZZRPMSVKJRHQO-PHIMTYICSA-N 1 1 325.796 2.803 10 5 EFBEMO C/C(=C\C(=O)N1CC[C@@]2(C1)CCC[N@H+](C)C2)c1ccc([N+](=O)[O-])cc1 ZINC000818178952 1276479444 /nfs/dbraw/zinc/47/94/44/1276479444.db2.gz VSMWYYPOLAQPSI-QZEGLACASA-N 1 1 343.427 2.942 10 5 EFBEMO Cc1nn(C[N@H+]2CC[C@]3(C2)CCCOC3)c2cc([N+](=O)[O-])ccc12 ZINC000789547293 1276801017 /nfs/dbraw/zinc/80/10/17/1276801017.db2.gz UNPVAANIUVDGDW-KRWDZBQOSA-N 1 1 330.388 2.713 10 5 EFBEMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000871763654 1287275605 /nfs/dbraw/zinc/27/56/05/1287275605.db2.gz NDNNXXTVCCZHCY-ZIAGYGMSSA-N 1 1 338.795 2.949 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CCC[C@@]4(CC4(F)F)C3)n2)cc1 ZINC000844747026 1279217015 /nfs/dbraw/zinc/21/70/15/1279217015.db2.gz HFVZWDPVZSLZOU-OAHLLOKOSA-N 1 1 349.341 2.932 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@@]4(CC4(F)F)C3)n2)cc1 ZINC000844747026 1279217022 /nfs/dbraw/zinc/21/70/22/1279217022.db2.gz HFVZWDPVZSLZOU-OAHLLOKOSA-N 1 1 349.341 2.932 10 5 EFBEMO Cc1nn(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c2ncc([N+](=O)[O-])cc12 ZINC000793518467 1279713722 /nfs/dbraw/zinc/71/37/22/1279713722.db2.gz GFZSVGQHGGNXNZ-OCCSQVGLSA-N 1 1 337.330 2.583 10 5 EFBEMO Cc1nn(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c2ncc([N+](=O)[O-])cc12 ZINC000793518467 1279713729 /nfs/dbraw/zinc/71/37/29/1279713729.db2.gz GFZSVGQHGGNXNZ-OCCSQVGLSA-N 1 1 337.330 2.583 10 5 EFBEMO C[C@H]([NH2+][C@H]1CCCc2c1cnn2CCO)c1c(F)cccc1[N+](=O)[O-] ZINC000872026764 1287404715 /nfs/dbraw/zinc/40/47/15/1287404715.db2.gz HIXXEJARXOMXEM-FZMZJTMJSA-N 1 1 348.378 2.651 10 5 EFBEMO C[C@@H]([NH2+]CCC(=O)Nc1ccccn1)c1c(F)cccc1[N+](=O)[O-] ZINC000872027097 1287404530 /nfs/dbraw/zinc/40/45/30/1287404530.db2.gz HLHCQSDTFCDOTL-LLVKDONJSA-N 1 1 332.335 2.808 10 5 EFBEMO CCO[C@H](CC[NH+](C)C)CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872041668 1287409562 /nfs/dbraw/zinc/40/95/62/1287409562.db2.gz JRBJBPQIXUEEPF-QWHCGFSZSA-N 1 1 327.400 2.741 10 5 EFBEMO C[C@@H]([NH2+][C@H]1CCCc2c1cnn2CCO)c1c(F)cccc1[N+](=O)[O-] ZINC000872026766 1287404839 /nfs/dbraw/zinc/40/48/39/1287404839.db2.gz HIXXEJARXOMXEM-RISCZKNCSA-N 1 1 348.378 2.651 10 5 EFBEMO C[C@H]([NH2+][C@H](CO)C[C@@H](O)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872070644 1287419806 /nfs/dbraw/zinc/41/98/06/1287419806.db2.gz VTSVRWBOJWAOBX-COPLHBTASA-N 1 1 328.384 2.543 10 5 EFBEMO C[C@H]([NH2+]CC1(S(C)(=O)=O)CCCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872069967 1287419560 /nfs/dbraw/zinc/41/95/60/1287419560.db2.gz AQYUBSBZCBGAQC-NSHDSACASA-N 1 1 344.408 2.742 10 5 EFBEMO CCOC(C[N@H+](CC)Cc1nc2cc([N+](=O)[O-])ccc2o1)OCC ZINC000846970007 1280641026 /nfs/dbraw/zinc/64/10/26/1280641026.db2.gz IRYLYKGMRPVAEL-UHFFFAOYSA-N 1 1 337.376 2.957 10 5 EFBEMO CCOC(C[N@@H+](CC)Cc1nc2cc([N+](=O)[O-])ccc2o1)OCC ZINC000846970007 1280641040 /nfs/dbraw/zinc/64/10/40/1280641040.db2.gz IRYLYKGMRPVAEL-UHFFFAOYSA-N 1 1 337.376 2.957 10 5 EFBEMO CCN1C[C@H](C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)OC1=O ZINC000846957491 1280658643 /nfs/dbraw/zinc/65/86/43/1280658643.db2.gz LIUZGKAEUGTHTH-HOCLYGCPSA-N 1 1 333.388 2.615 10 5 EFBEMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000846989779 1280675550 /nfs/dbraw/zinc/67/55/50/1280675550.db2.gz USAIIKVCWPXZFW-HECSCLNYSA-N 1 1 331.416 2.941 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC001137931381 1280980304 /nfs/dbraw/zinc/98/03/04/1280980304.db2.gz PBWHLCOIMJWNJL-NEPJUHHUSA-N 1 1 339.823 2.732 10 5 EFBEMO Cc1[nH+]ccn1CCCCNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC001147632710 1281223828 /nfs/dbraw/zinc/22/38/28/1281223828.db2.gz KGELBNHKHNDLPG-UHFFFAOYSA-N 1 1 336.779 2.963 10 5 EFBEMO COC(=O)c1cc(NC(=O)C(C)(C)[NH+]2CCCCC2)cc([N+](=O)[O-])c1 ZINC001147837029 1281311961 /nfs/dbraw/zinc/31/19/61/1281311961.db2.gz ARQNJJLSGPJAEF-UHFFFAOYSA-N 1 1 349.387 2.584 10 5 EFBEMO C[C@@H]([NH2+]Cc1nccn1CC(F)(F)F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815575256 1287631894 /nfs/dbraw/zinc/63/18/94/1287631894.db2.gz MYAKEJZFTIGSOA-SECBINFHSA-N 1 1 343.309 2.787 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCCc2ccccc2[N+](=O)[O-])C1 ZINC000810630521 1283437767 /nfs/dbraw/zinc/43/77/67/1283437767.db2.gz LBRYONGEPJZFHP-QGZVFWFLSA-N 1 1 338.379 2.893 10 5 EFBEMO Cc1c(CNC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000810701426 1283536544 /nfs/dbraw/zinc/53/65/44/1283536544.db2.gz RCEXVORSZIMLTB-QGZVFWFLSA-N 1 1 337.395 2.732 10 5 EFBEMO CC[N@@H+](CCc1ccccn1)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000811456968 1284332571 /nfs/dbraw/zinc/33/25/71/1284332571.db2.gz CYOXRWKOUCAZGD-UHFFFAOYSA-N 1 1 343.383 2.841 10 5 EFBEMO CC1(C2CC2)CC[NH+](Cn2c(=O)oc3cccc([N+](=O)[O-])c32)CC1 ZINC000811784642 1284600252 /nfs/dbraw/zinc/60/02/52/1284600252.db2.gz DZNMPSHNGDISPJ-UHFFFAOYSA-N 1 1 331.372 2.972 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000812848225 1285471871 /nfs/dbraw/zinc/47/18/71/1285471871.db2.gz IKDJSVUUQMQHFJ-KRWDZBQOSA-N 1 1 335.379 2.696 10 5 EFBEMO C[C@H](OCC1CC1)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171011 1285702080 /nfs/dbraw/zinc/70/20/80/1285702080.db2.gz QFBBTYDPJQSJNY-GUYCJALGSA-N 1 1 348.399 2.527 10 5 EFBEMO C[C@H](OCC1CC1)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171011 1285702091 /nfs/dbraw/zinc/70/20/91/1285702091.db2.gz QFBBTYDPJQSJNY-GUYCJALGSA-N 1 1 348.399 2.527 10 5 EFBEMO CC[C@@](C)(OC)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174461 1285705501 /nfs/dbraw/zinc/70/55/01/1285705501.db2.gz UBHNZZSYCDWFHT-DOTOQJQBSA-N 1 1 336.388 2.527 10 5 EFBEMO CC[C@@](C)(OC)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174461 1285705509 /nfs/dbraw/zinc/70/55/09/1285705509.db2.gz UBHNZZSYCDWFHT-DOTOQJQBSA-N 1 1 336.388 2.527 10 5 EFBEMO O=C(C[C@H]1CCCCO1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174604 1285705597 /nfs/dbraw/zinc/70/55/97/1285705597.db2.gz ZOBOGVYZNGDHMA-SJORKVTESA-N 1 1 348.399 2.672 10 5 EFBEMO O=C(C[C@H]1CCCCO1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174604 1285705605 /nfs/dbraw/zinc/70/56/05/1285705605.db2.gz ZOBOGVYZNGDHMA-SJORKVTESA-N 1 1 348.399 2.672 10 5 EFBEMO C[N@H+]1CCC[C@H](NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000813442127 1285910409 /nfs/dbraw/zinc/91/04/09/1285910409.db2.gz FDYGSBWTWOVGLN-VIFPVBQESA-N 1 1 332.187 2.726 10 5 EFBEMO COCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc(C)c(C)c1 ZINC001176200400 1287917348 /nfs/dbraw/zinc/91/73/48/1287917348.db2.gz BFYCUOVMQFWGSW-UHFFFAOYSA-N 1 1 332.404 2.557 10 5 EFBEMO Cc1c(C[NH+]2CCC(CN=S(C)(C)=O)CC2)cccc1[N+](=O)[O-] ZINC001176296085 1287932502 /nfs/dbraw/zinc/93/25/02/1287932502.db2.gz SPBQSCHEWBUYMJ-UHFFFAOYSA-N 1 1 339.461 2.843 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H]2[C@H]3C=C[C@H](C3)[C@@]2(C)C1 ZINC001176618668 1288048853 /nfs/dbraw/zinc/04/88/53/1288048853.db2.gz FOEGNPDSXUIJGO-QMYADUOMSA-N 1 1 341.411 2.986 10 5 EFBEMO O=C(CC[N@H+]1CCCC[C@H]1[C@H]1CCCO1)Nc1ccccc1[N+](=O)[O-] ZINC001176927494 1288177017 /nfs/dbraw/zinc/17/70/17/1288177017.db2.gz SLENAVGMHCNJHN-DLBZAZTESA-N 1 1 347.415 2.957 10 5 EFBEMO C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000816952714 1288336558 /nfs/dbraw/zinc/33/65/58/1288336558.db2.gz QKJOPOTYGPERTI-UFBFGSQYSA-N 1 1 344.198 2.678 10 5 EFBEMO CC[N@H+]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C(C)(C)C1 ZINC001178860581 1288967498 /nfs/dbraw/zinc/96/74/98/1288967498.db2.gz FTMQGCVKUPYZHT-INIZCTEOSA-N 1 1 349.431 2.842 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)Nc1ccc(C)c([N+](=O)[O-])c1N ZINC001179878637 1289303414 /nfs/dbraw/zinc/30/34/14/1289303414.db2.gz CKZIRFHBEVXEQC-NSHDSACASA-N 1 1 331.376 2.834 10 5 EFBEMO CN(C[C@H]1CCC[N@H+]1C)c1ccc([N+](=O)[O-])cc1Br ZINC001186764437 1291014885 /nfs/dbraw/zinc/01/48/85/1291014885.db2.gz RQDRWYVJZYGTBD-LLVKDONJSA-N 1 1 328.210 2.888 10 5 EFBEMO O=[N+]([O-])c1cnc2ccccc2c1N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC001186872768 1291029535 /nfs/dbraw/zinc/02/95/35/1291029535.db2.gz PVGRITZCFMROHG-CVEARBPZSA-N 1 1 326.400 2.994 10 5 EFBEMO CC[C@@H]1CC[C@@H](C)[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC001196176897 1294158394 /nfs/dbraw/zinc/15/83/94/1294158394.db2.gz YYKAJXOMKDKYOX-ZIAGYGMSSA-N 1 1 331.416 2.994 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1Cc2c[nH]nc2[C@@H](C)C1 ZINC001196789823 1294366781 /nfs/dbraw/zinc/36/67/81/1294366781.db2.gz OKKWZLTZFDAUBW-LBPRGKRZSA-N 1 1 343.387 2.574 10 5 EFBEMO Cc1coc(C)c1C(=O)NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001273996487 1294485053 /nfs/dbraw/zinc/48/50/53/1294485053.db2.gz DAWXEEKMUPIYSN-ARJAWSKDSA-N 1 1 349.412 2.942 10 5 EFBEMO Cc1coc(C)c1C(=O)NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001273996488 1294485250 /nfs/dbraw/zinc/48/52/50/1294485250.db2.gz DAWXEEKMUPIYSN-ONEGZZNKSA-N 1 1 349.412 2.942 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](c2cn(C)nn2)C1 ZINC001198612299 1295148025 /nfs/dbraw/zinc/14/80/25/1295148025.db2.gz NDSJLMJFIAANLV-KGLIPLIRSA-N 1 1 329.404 2.972 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@]12CCC[C@H]1OCC2 ZINC001198790416 1295231753 /nfs/dbraw/zinc/23/17/53/1295231753.db2.gz GXSANXYPAYQICE-SJLPKXTDSA-N 1 1 347.415 2.733 10 5 EFBEMO Cc1cc([N+](=O)[O-])c(C(=O)N2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)cc1Cl ZINC000887924423 1295626567 /nfs/dbraw/zinc/62/65/67/1295626567.db2.gz KLJCZBLNVOAPMM-BZNIZROVSA-N 1 1 337.807 2.580 10 5 EFBEMO C[C@@H]1[C@H](NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC[N@H+]1C ZINC000925341608 1296832249 /nfs/dbraw/zinc/83/22/49/1296832249.db2.gz PHOCPZOFSMJEDX-FRFSOERESA-N 1 1 346.431 2.576 10 5 EFBEMO C[C@H](CCc1ccccc1[N+](=O)[O-])N[C@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903975304 1313522806 /nfs/dbraw/zinc/52/28/06/1313522806.db2.gz ZOASMQWRWKISJL-NVXWUHKLSA-N 1 1 347.459 2.664 10 5 EFBEMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585844 1299653663 /nfs/dbraw/zinc/65/36/63/1299653663.db2.gz ANCNKVZUMVKQRG-SCLBCKFNSA-N 1 1 330.384 2.897 10 5 EFBEMO CC(C)NC(=O)[C@H]1CCC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000852697723 1299818991 /nfs/dbraw/zinc/81/89/91/1299818991.db2.gz ZHAGKUYGKVRQCD-ZDUSSCGKSA-N 1 1 339.823 2.985 10 5 EFBEMO CC(C)NC(=O)[C@H]1CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000852697723 1299818998 /nfs/dbraw/zinc/81/89/98/1299818998.db2.gz ZHAGKUYGKVRQCD-ZDUSSCGKSA-N 1 1 339.823 2.985 10 5 EFBEMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c1 ZINC000852759665 1299871344 /nfs/dbraw/zinc/87/13/44/1299871344.db2.gz SAIMASOBJVKQMM-OKZBNKHCSA-N 1 1 332.400 2.521 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)cc1N1CCC([N@H+]2CCCOCC2)CC1 ZINC000853689007 1300230312 /nfs/dbraw/zinc/23/03/12/1300230312.db2.gz WDTGEELUROICNH-UHFFFAOYSA-N 1 1 339.823 2.939 10 5 EFBEMO C/C(=C/C(=O)N[C@@H]1CC[N@H+](C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000855286252 1300890901 /nfs/dbraw/zinc/89/09/01/1300890901.db2.gz NPENUJJIOGUECD-BMOGTNHUSA-N 1 1 331.416 2.987 10 5 EFBEMO CCN(C(=O)c1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CC[N@@H+](CC)C1 ZINC000855489875 1300977943 /nfs/dbraw/zinc/97/79/43/1300977943.db2.gz CDXRIVOVYZNSBY-LBPRGKRZSA-N 1 1 325.796 2.805 10 5 EFBEMO CCN(C(=O)c1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CC[N@@H+](CC)C1 ZINC000855490626 1300978354 /nfs/dbraw/zinc/97/83/54/1300978354.db2.gz NCJJZQAKGLZTOB-GFCCVEGCSA-N 1 1 325.796 2.805 10 5 EFBEMO CCN(C(=O)/C=C(\C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](CC)C1 ZINC000855489590 1300979116 /nfs/dbraw/zinc/97/91/16/1300979116.db2.gz ATWPNFHTJPOYMN-ABDJAZHISA-N 1 1 331.416 2.941 10 5 EFBEMO CCN(C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](CC)C1 ZINC000855490760 1300979533 /nfs/dbraw/zinc/97/95/33/1300979533.db2.gz LARFXCXIWURHPJ-AWEZNQCLSA-N 1 1 341.358 2.629 10 5 EFBEMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860010672 1301673104 /nfs/dbraw/zinc/67/31/04/1301673104.db2.gz GUENBNGMTAAALA-XIKOKIGWSA-N 1 1 339.395 2.961 10 5 EFBEMO CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)/C(C)=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000861347200 1302092015 /nfs/dbraw/zinc/09/20/15/1302092015.db2.gz HHOORPMJJAUPSM-GNOWRCIYSA-N 1 1 348.399 2.651 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])cc4ccccc43)C[C@@H]2C1 ZINC000861774082 1302203761 /nfs/dbraw/zinc/20/37/61/1302203761.db2.gz INOGRWDZMIXBPQ-CABCVRRESA-N 1 1 339.395 2.772 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH+](CCCF)CC1 ZINC000862113759 1302287953 /nfs/dbraw/zinc/28/79/53/1302287953.db2.gz XVGITHWJKYIKLU-YPKPFQOOSA-N 1 1 335.379 2.502 10 5 EFBEMO Cc1ccc(C[NH2+]Cc2cnc(C3OCCO3)s2)cc1[N+](=O)[O-] ZINC000865786805 1303400183 /nfs/dbraw/zinc/40/01/83/1303400183.db2.gz CRCUWYLTWSKFHI-UHFFFAOYSA-N 1 1 335.385 2.695 10 5 EFBEMO Cc1ccc(C[NH2+]Cc2cc(C(F)(F)F)nn2C)cc1[N+](=O)[O-] ZINC000865787524 1303401114 /nfs/dbraw/zinc/40/11/14/1303401114.db2.gz PJPVWSMSCFBPFF-UHFFFAOYSA-N 1 1 328.294 2.945 10 5 EFBEMO CC(C)Oc1nc(N[C@H]2CCC[N@H+](CCF)C2)ccc1[N+](=O)[O-] ZINC000865928025 1303458098 /nfs/dbraw/zinc/45/80/98/1303458098.db2.gz OCYFTVBBBYSBEC-LBPRGKRZSA-N 1 1 326.372 2.623 10 5 EFBEMO CC(C)Oc1nc(N[C@H]2CCC[N@@H+](CCF)C2)ccc1[N+](=O)[O-] ZINC000865928025 1303458102 /nfs/dbraw/zinc/45/81/02/1303458102.db2.gz OCYFTVBBBYSBEC-LBPRGKRZSA-N 1 1 326.372 2.623 10 5 EFBEMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c(C(F)F)c1 ZINC000865956825 1303468747 /nfs/dbraw/zinc/46/87/47/1303468747.db2.gz PMXXEIGNQHBWTF-CYBMUJFWSA-N 1 1 341.358 2.568 10 5 EFBEMO O=[N+]([O-])c1cnc2ccc(NC[C@H]3CC[N@H+]3C3CCCCCC3)nn21 ZINC000866192333 1303557632 /nfs/dbraw/zinc/55/76/32/1303557632.db2.gz IYBHEIVNYXCSGP-CQSZACIVSA-N 1 1 344.419 2.847 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)CC[C@@H]21 ZINC000866205409 1303562456 /nfs/dbraw/zinc/56/24/56/1303562456.db2.gz LMVZAZPGNQUYMS-JQWIXIFHSA-N 1 1 327.331 2.727 10 5 EFBEMO COc1cc(N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000866207283 1303562731 /nfs/dbraw/zinc/56/27/31/1303562731.db2.gz CDOQLQRHXFUMCU-ZYHUDNBSSA-N 1 1 325.796 2.787 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)CC[C@H]21 ZINC000866205408 1303563086 /nfs/dbraw/zinc/56/30/86/1303563086.db2.gz LMVZAZPGNQUYMS-CMPLNLGQSA-N 1 1 327.331 2.727 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3ccc(Br)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000866208363 1303563611 /nfs/dbraw/zinc/56/36/11/1303563611.db2.gz UCGKHVNGYPCHLL-JQWIXIFHSA-N 1 1 340.221 2.888 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(c3c(Br)cccc3[N+](=O)[O-])CC[C@H]21 ZINC000866209640 1303564570 /nfs/dbraw/zinc/56/45/70/1303564570.db2.gz SSBYXARNHALLSY-ZYHUDNBSSA-N 1 1 340.221 2.888 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3cccc(Br)c3[N+](=O)[O-])CC[C@H]21 ZINC000866210225 1303565519 /nfs/dbraw/zinc/56/55/19/1303565519.db2.gz ZSVOFJOGVKIEDP-CMPLNLGQSA-N 1 1 340.221 2.888 10 5 EFBEMO Cc1ccc(CNC(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000868755519 1304457528 /nfs/dbraw/zinc/45/75/28/1304457528.db2.gz ISGCIHGUODFPHS-HOTGVXAUSA-N 1 1 346.431 2.719 10 5 EFBEMO Cc1ccc(CNC(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000868755518 1304457613 /nfs/dbraw/zinc/45/76/13/1304457613.db2.gz ISGCIHGUODFPHS-CVEARBPZSA-N 1 1 346.431 2.719 10 5 EFBEMO C/C(=C\C(=O)N1CC[C@@]2(CC[N@H+](C)C2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000795128553 1305397061 /nfs/dbraw/zinc/39/70/61/1305397061.db2.gz HFMXPIMSRVWGAZ-GPZRYRNASA-N 1 1 329.400 2.552 10 5 EFBEMO C[C@@]([NH3+])(C(=O)N1CCC(C2CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000870953413 1305706403 /nfs/dbraw/zinc/70/64/03/1305706403.db2.gz XVUREWWHQFQUSJ-SFHVURJKSA-N 1 1 331.416 2.807 10 5 EFBEMO C[N@H+]1CCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CCC1(C)C ZINC000871153834 1305842158 /nfs/dbraw/zinc/84/21/58/1305842158.db2.gz NABWQMSLTHFKMN-UHFFFAOYSA-N 1 1 333.432 2.815 10 5 EFBEMO C[N@H+]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCC1(C)C ZINC000871158372 1305853255 /nfs/dbraw/zinc/85/32/55/1305853255.db2.gz ZSEUNVJDFHUNQI-UHFFFAOYSA-N 1 1 347.415 2.500 10 5 EFBEMO Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)[C@@H]1CC[C@H]3CCCC[N@H+]31)CC2 ZINC000901317381 1310129283 /nfs/dbraw/zinc/12/92/83/1310129283.db2.gz JCIVNMVGQUCPET-CABCVRRESA-N 1 1 329.400 2.809 10 5 EFBEMO CNC(=O)C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000801555148 1310518144 /nfs/dbraw/zinc/51/81/44/1310518144.db2.gz DXWINWGYDKKGTI-HNNXBMFYSA-N 1 1 331.347 2.701 10 5 EFBEMO C/C(=C\C(=O)NC[C@H]1CC[N@H+](C(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000751672724 1311130766 /nfs/dbraw/zinc/13/07/66/1311130766.db2.gz IFPWAJBXRZKLEY-YVGNARHYSA-N 1 1 331.416 2.845 10 5 EFBEMO CC[N@H+]1CCC[C@H](CNC(=O)/C=C(\C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000751725220 1311133154 /nfs/dbraw/zinc/13/31/54/1311133154.db2.gz HHNPZELFBXAKMM-ATGUSINASA-N 1 1 331.416 2.846 10 5 EFBEMO CC[N@H+]1CCC[C@H](CNC(=O)/C=C(/C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000751725224 1311133366 /nfs/dbraw/zinc/13/33/66/1311133366.db2.gz HHNPZELFBXAKMM-QKXCFHHRSA-N 1 1 331.416 2.846 10 5 EFBEMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC001160195139 1311662384 /nfs/dbraw/zinc/66/23/84/1311662384.db2.gz ZSFANNQHMAWNCS-GFCCVEGCSA-N 1 1 325.384 2.893 10 5 EFBEMO COC(=O)Cc1ccc(NCCC[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC001162004201 1312026662 /nfs/dbraw/zinc/02/66/62/1312026662.db2.gz GBWRVBVGBBKMPI-CQSZACIVSA-N 1 1 349.431 2.987 10 5 EFBEMO COC(=O)Cc1ccc(NCC[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC001162273651 1312079540 /nfs/dbraw/zinc/07/95/40/1312079540.db2.gz SFSVTJDWDMSMDJ-UHFFFAOYSA-N 1 1 349.431 2.987 10 5 EFBEMO CCCCC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001277388269 1312098024 /nfs/dbraw/zinc/09/80/24/1312098024.db2.gz JLZGNDIFSQHCRZ-IAGOWNOFSA-N 1 1 337.464 2.545 10 5 EFBEMO CCCCC[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001277388269 1312098027 /nfs/dbraw/zinc/09/80/27/1312098027.db2.gz JLZGNDIFSQHCRZ-IAGOWNOFSA-N 1 1 337.464 2.545 10 5 EFBEMO CCCCC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001277388269 1312098030 /nfs/dbraw/zinc/09/80/30/1312098030.db2.gz JLZGNDIFSQHCRZ-IAGOWNOFSA-N 1 1 337.464 2.545 10 5 EFBEMO CC[C@@H](NC(=O)N1CC[C@H]2[C@@H]1CCC[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC001230515621 1312251810 /nfs/dbraw/zinc/25/18/10/1312251810.db2.gz WRZWCLKIFYDPOC-IKGGRYGDSA-N 1 1 346.431 2.924 10 5 EFBEMO CC[N@H+]1[C@H](C)CN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1C ZINC001163884423 1312402064 /nfs/dbraw/zinc/40/20/64/1312402064.db2.gz GFZXTVPUJCMDIY-PHIMTYICSA-N 1 1 325.796 2.803 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1C ZINC001163884423 1312402067 /nfs/dbraw/zinc/40/20/67/1312402067.db2.gz GFZXTVPUJCMDIY-PHIMTYICSA-N 1 1 325.796 2.803 10 5 EFBEMO Cc1nc(NC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC001163900995 1312404933 /nfs/dbraw/zinc/40/49/33/1312404933.db2.gz HNGCGBVAASTMCJ-BBRMVZONSA-N 1 1 341.415 2.873 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC001261260142 1316399328 /nfs/dbraw/zinc/39/93/28/1316399328.db2.gz DNGNHUWJURMFQX-GDBMZVCRSA-N 1 1 337.395 2.523 10 5 EFBEMO O=C(N1CCC[N@H+]2CCC[C@@H]2C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001261847994 1316433491 /nfs/dbraw/zinc/43/34/91/1316433491.db2.gz KHDRPCHHPPKWTD-QGZVFWFLSA-N 1 1 343.427 2.713 10 5 EFBEMO CC[N@@H+](CCCNC(=O)c1ccc[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC001265098650 1316720421 /nfs/dbraw/zinc/72/04/21/1316720421.db2.gz UKJGYDKVISADLU-UHFFFAOYSA-N 1 1 330.388 2.565 10 5 EFBEMO CC(C)(C)CCC[NH+]1CCC(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001319019475 1328764923 /nfs/dbraw/zinc/76/49/23/1328764923.db2.gz WXCUZBLKNVCNJJ-HZPDHXFCSA-N 1 1 339.480 2.696 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC001289202936 1321802861 /nfs/dbraw/zinc/80/28/61/1321802861.db2.gz BWJFAQVGOQLUGG-HNNXBMFYSA-N 1 1 349.431 2.796 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC001289202936 1321802865 /nfs/dbraw/zinc/80/28/65/1321802865.db2.gz BWJFAQVGOQLUGG-HNNXBMFYSA-N 1 1 349.431 2.796 10 5 EFBEMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC001289204288 1321803251 /nfs/dbraw/zinc/80/32/51/1321803251.db2.gz JIYRJLLSADNBAT-HNNXBMFYSA-N 1 1 349.431 2.552 10 5 EFBEMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC001293327169 1322230353 /nfs/dbraw/zinc/23/03/53/1322230353.db2.gz CFMLZJGJNCXIMS-NSHDSACASA-N 1 1 343.786 2.992 10 5 EFBEMO CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C)[nH+]c(C)c2)cc1OC ZINC001319975252 1329047342 /nfs/dbraw/zinc/04/73/42/1329047342.db2.gz YMFDXPKKINEGNK-UHFFFAOYSA-N 1 1 345.355 2.688 10 5 EFBEMO CC(C)C[N@H+]1CCC[C@@H]1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC001295987708 1322836894 /nfs/dbraw/zinc/83/68/94/1322836894.db2.gz BQGPTASDWNAGNG-CQSZACIVSA-N 1 1 331.376 2.530 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCC[N@H+](C(C)C)C1 ZINC001296127060 1322857044 /nfs/dbraw/zinc/85/70/44/1322857044.db2.gz MDJJEFUWEZANPO-ZDUSSCGKSA-N 1 1 335.404 2.596 10 5 EFBEMO C[NH+](C)Cc1cc(NC(=O)c2cnc(N)c([N+](=O)[O-])c2)ccc1Cl ZINC001297079613 1323085105 /nfs/dbraw/zinc/08/51/05/1323085105.db2.gz JPJJJWOBJGIRNH-UHFFFAOYSA-N 1 1 349.778 2.539 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C2CCCC2)[C@H](C)C1 ZINC001303540497 1324609791 /nfs/dbraw/zinc/60/97/91/1324609791.db2.gz REXHRNHUWDGPEU-CQSZACIVSA-N 1 1 331.416 2.992 10 5 EFBEMO Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cc[nH+]c(N2CCCCC2)c1 ZINC001304176620 1324643969 /nfs/dbraw/zinc/64/39/69/1324643969.db2.gz QHZJOXWTQCUNQT-UHFFFAOYSA-N 1 1 341.371 2.815 10 5 EFBEMO C[N@H+]1CCC[C@H](CCNc2c3cc(F)ccc3ncc2[N+](=O)[O-])C1 ZINC001307138260 1324744101 /nfs/dbraw/zinc/74/41/01/1324744101.db2.gz ZKCYOIAONIAYBK-GFCCVEGCSA-N 1 1 332.379 2.848 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NCc1[nH]c(C)[nH+]c1C ZINC001307214056 1324751101 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343.424 2.734 10 5 EFBEMO C[N@@H+](CCCNC(=O)C1(CF)CCC1)Cc1csc([N+](=O)[O-])c1 ZINC001316849499 1325216580 /nfs/dbraw/zinc/21/65/80/1325216580.db2.gz KUIHMRUBBOCMFA-UHFFFAOYSA-N 1 1 343.424 2.734 10 5 EFBEMO O=C(NCCC[N@@H+](CC1CCCCCC1)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001316914884 1325339158 /nfs/dbraw/zinc/33/91/58/1325339158.db2.gz MQEGTLIYLKMZMB-IAGOWNOFSA-N 1 1 337.464 2.593 10 5 EFBEMO O=C(NCCC[N@H+](CC1CCCCCC1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001316914884 1325339182 /nfs/dbraw/zinc/33/91/82/1325339182.db2.gz MQEGTLIYLKMZMB-IAGOWNOFSA-N 1 1 337.464 2.593 10 5 EFBEMO O=C(NCCC[N@@H+](CC1CCCCCC1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001316914884 1325339186 /nfs/dbraw/zinc/33/91/86/1325339186.db2.gz MQEGTLIYLKMZMB-IAGOWNOFSA-N 1 1 337.464 2.593 10 5 EFBEMO O=C(Cc1ccccc1)NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001321120397 1329345189 /nfs/dbraw/zinc/34/51/89/1329345189.db2.gz HZOFLGZEAVVJBP-SNAWJCMRSA-N 1 1 345.424 2.661 10 5 EFBEMO C[N@H+](CCNC(=O)CC1CC(F)(F)C1)Cc1cccc([N+](=O)[O-])c1 ZINC001317452116 1328042111 /nfs/dbraw/zinc/04/21/11/1328042111.db2.gz VSDZXSCHNWQWJY-UHFFFAOYSA-N 1 1 341.358 2.578 10 5 EFBEMO C[N@@H+](CCNC(=O)CC1CC(F)(F)C1)Cc1cccc([N+](=O)[O-])c1 ZINC001317452116 1328042114 /nfs/dbraw/zinc/04/21/14/1328042114.db2.gz VSDZXSCHNWQWJY-UHFFFAOYSA-N 1 1 341.358 2.578 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1[nH]c(C)cc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001317482387 1328065753 /nfs/dbraw/zinc/06/57/53/1328065753.db2.gz RXICSJUXQAXYDO-UHFFFAOYSA-N 1 1 344.415 2.792 10 5 EFBEMO CC[N@H+](CCNC(=O)C1CC2(CC2)C1)Cc1ccccc1[N+](=O)[O-] ZINC001317486684 1328070014 /nfs/dbraw/zinc/07/00/14/1328070014.db2.gz AAGYRWJPUOZYOL-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO CC[N@@H+](CCNC(=O)C1CC2(CC2)C1)Cc1ccccc1[N+](=O)[O-] ZINC001317486684 1328070023 /nfs/dbraw/zinc/07/00/23/1328070023.db2.gz AAGYRWJPUOZYOL-UHFFFAOYSA-N 1 1 331.416 2.723 10 5 EFBEMO Cc1[nH]ccc1C(=O)NCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001317550399 1328134930 /nfs/dbraw/zinc/13/49/30/1328134930.db2.gz CPCWSEBRZQZZCK-UHFFFAOYSA-N 1 1 342.399 2.626 10 5 EFBEMO Cc1cc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc(C)[nH+]1 ZINC001321761564 1329407672 /nfs/dbraw/zinc/40/76/72/1329407672.db2.gz ZQICGCGDGSRYNO-UHFFFAOYSA-N 1 1 328.372 2.735 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001326496603 1330305387 /nfs/dbraw/zinc/30/53/87/1330305387.db2.gz KZNKRYMOXKDONW-UHFFFAOYSA-N 1 1 348.447 2.640 10 5 EFBEMO C/C(=C\C(=O)N1CC[N@H+](C2CC2)C[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC001326571742 1330319662 /nfs/dbraw/zinc/31/96/62/1330319662.db2.gz AQUXSOQUPYHNNW-XDPMZMSMSA-N 1 1 343.427 2.941 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1cccnc1 ZINC001327177864 1330437130 /nfs/dbraw/zinc/43/71/30/1330437130.db2.gz RHVQJGMIXNRFHH-UHFFFAOYSA-N 1 1 342.399 2.584 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)C(C)(C)F ZINC001327175619 1330437176 /nfs/dbraw/zinc/43/71/76/1330437176.db2.gz BMIJNSQLHLSQHT-UHFFFAOYSA-N 1 1 325.384 2.623 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001327555387 1330497484 /nfs/dbraw/zinc/49/74/84/1330497484.db2.gz HFXTXJJDLCPKQJ-GOSISDBHSA-N 1 1 349.406 2.692 10 5 EFBEMO CC[N@H+]1CCC[C@@H](CNc2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)C1 ZINC001327643023 1330503737 /nfs/dbraw/zinc/50/37/37/1330503737.db2.gz OAMNHWTXZJFMBC-ZDUSSCGKSA-N 1 1 335.404 2.834 10 5 EFBEMO Cc1noc(C[NH2+][C@@H]2CCN(C)[C@@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001328410767 1330590319 /nfs/dbraw/zinc/59/03/19/1330590319.db2.gz VHQOUELKTKIVMZ-CZUORRHYSA-N 1 1 334.351 2.565 10 5 EFBEMO CCC(CC)C[N@@H+](CC)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001328575211 1330604015 /nfs/dbraw/zinc/60/40/15/1330604015.db2.gz VCDHWVXSXALPAE-IAGOWNOFSA-N 1 1 339.480 2.648 10 5 EFBEMO CCC(CC)C[N@H+](CC)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001328575211 1330604019 /nfs/dbraw/zinc/60/40/19/1330604019.db2.gz VCDHWVXSXALPAE-IAGOWNOFSA-N 1 1 339.480 2.648 10 5 EFBEMO CCC(CC)C[N@@H+](CC)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001328575211 1330604022 /nfs/dbraw/zinc/60/40/22/1330604022.db2.gz VCDHWVXSXALPAE-IAGOWNOFSA-N 1 1 339.480 2.648 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(c3ncnc4c(Cl)cc([N+](=O)[O-])cc43)CC[C@H]21 ZINC001329748437 1330733396 /nfs/dbraw/zinc/73/33/96/1330733396.db2.gz KGFFUJNMDIAPTP-QMTHXVAHSA-N 1 1 347.806 2.722 10 5 EFBEMO C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC[N@H+]1C ZINC001331867105 1330883034 /nfs/dbraw/zinc/88/30/34/1330883034.db2.gz BNTMGWNQYYEIEH-OCCSQVGLSA-N 1 1 327.384 2.961 10 5 EFBEMO C[N@H+]1C[C@@]23CN(C(=O)Nc4ccc([N+](=O)[O-])cc4)C[C@]2(C1)CCCC3 ZINC001344686998 1332474119 /nfs/dbraw/zinc/47/41/19/1332474119.db2.gz VLFAKCXOSOTXJG-HDICACEKSA-N 1 1 344.415 2.935 10 5 EFBEMO CNc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC[C@H]2C[C@H](C)C[N@H+]2C1 ZINC001349960592 1333018767 /nfs/dbraw/zinc/01/87/67/1333018767.db2.gz SWEXQLNIGDSUIY-XQQFMLRXSA-N 1 1 332.404 2.695 10 5 EFBEMO C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)C1 ZINC001350245706 1333053162 /nfs/dbraw/zinc/05/31/62/1333053162.db2.gz KPKVQIVOZCZDOC-SJCJKPOMSA-N 1 1 340.383 2.916 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001350387639 1333073097 /nfs/dbraw/zinc/07/30/97/1333073097.db2.gz SPIWHLVGBJTWOT-INIZCTEOSA-N 1 1 346.431 2.535 10 5 EFBEMO CC(C)(NC(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21)c1ccc([N+](=O)[O-])cc1 ZINC001350590234 1333100339 /nfs/dbraw/zinc/10/03/39/1333100339.db2.gz UTIVHZUXYKZGNI-HOCLYGCPSA-N 1 1 331.416 2.963 10 5 EFBEMO CC(C)(NC(=O)[C@H]1CC[C@@H]2CCCC[N@@H+]12)c1ccc([N+](=O)[O-])cc1 ZINC001350590229 1333100471 /nfs/dbraw/zinc/10/04/71/1333100471.db2.gz UTIVHZUXYKZGNI-GOEBONIOSA-N 1 1 331.416 2.963 10 5 EFBEMO C[C@@H](NC(=O)[C@H]1CC[C@H]2C[C@@H](C)C[N@H+]2C1)c1ccc([N+](=O)[O-])cc1 ZINC001352969165 1333837117 /nfs/dbraw/zinc/83/71/17/1333837117.db2.gz KIAXRIUUDYVAPO-LGWLGOQQSA-N 1 1 331.416 2.892 10 5 EFBEMO C[C@@H](NC(=O)[C@H]1CC[C@@H]2C[C@@H](C)C[N@H+]2C1)c1ccc([N+](=O)[O-])cc1 ZINC001352969167 1333837225 /nfs/dbraw/zinc/83/72/25/1333837225.db2.gz KIAXRIUUDYVAPO-LNCBFAARSA-N 1 1 331.416 2.892 10 5 EFBEMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H]1C1CC1 ZINC000848476337 1334735622 /nfs/dbraw/zinc/73/56/22/1334735622.db2.gz ABGRVJOSFRDANZ-IRXDYDNUSA-N 1 1 329.400 2.743 10 5 EFBEMO C[C@@H]1CCC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000848476972 1334736114 /nfs/dbraw/zinc/73/61/14/1334736114.db2.gz JKZKGGUQJZKGLU-PBHICJAKSA-N 1 1 331.416 2.990 10 5 EFBEMO C[C@@H]1[C@H](C)SCC[N@@H+]1CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848478887 1334736825 /nfs/dbraw/zinc/73/68/25/1334736825.db2.gz OAVHZICNBWJGOT-DVOMOZLQSA-N 1 1 349.456 2.694 10 5 EFBEMO C[C@@H]1[C@H](C)SCC[N@H+]1CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848478887 1334736827 /nfs/dbraw/zinc/73/68/27/1334736827.db2.gz OAVHZICNBWJGOT-DVOMOZLQSA-N 1 1 349.456 2.694 10 5 EFBEMO CC(C)[C@@H]1CC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848481973 1334738299 /nfs/dbraw/zinc/73/82/99/1334738299.db2.gz IVUAJHLYBZMSCH-WBVHZDCISA-N 1 1 331.416 2.846 10 5 EFBEMO C[C@@H]1C[NH+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C[C@@H](C)S1 ZINC000848480868 1334738867 /nfs/dbraw/zinc/73/88/67/1334738867.db2.gz TUUPPBDNVIMQOO-IOASZLSFSA-N 1 1 349.456 2.694 10 5 EFBEMO CSC[C@@H]1CCC[N@H+]1CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848482663 1334740395 /nfs/dbraw/zinc/74/03/95/1334740395.db2.gz SRMMWVJXTIWZLD-JKSUJKDBSA-N 1 1 349.456 2.696 10 5 EFBEMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)c1 ZINC000848482665 1334740551 /nfs/dbraw/zinc/74/05/51/1334740551.db2.gz SSYGXKHNZDQUDB-PBHICJAKSA-N 1 1 342.399 2.917 10 5 EFBEMO CC[N@H+]1C[C@@H](C)N(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C[C@H]1C ZINC001358022174 1335355087 /nfs/dbraw/zinc/35/50/87/1335355087.db2.gz JFHZSADDUSZZLL-HUUCEWRRSA-N 1 1 345.443 2.958 10 5 EFBEMO CC(C)[N@H+]1CCC[C@@H]1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC001361147212 1335955700 /nfs/dbraw/zinc/95/57/00/1335955700.db2.gz XUSQREQVHOYEQD-QGZVFWFLSA-N 1 1 333.432 2.907 10 5 EFBEMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[NH+](C)C)c(N)c1[N+](=O)[O-] ZINC001456745659 1394788188 /nfs/dbraw/zinc/78/81/88/1394788188.db2.gz SUHCDUPNGWQYIQ-MRXNPFEDSA-N 1 1 328.372 2.727 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)cc1C ZINC001458407262 1395462060 /nfs/dbraw/zinc/46/20/60/1395462060.db2.gz PTZSJGLBKAJHIP-BETUJISGSA-N 1 1 335.404 2.609 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N(C)C[C@@H]2CCC[N@H+]2C)cc1C ZINC001458445706 1395469820 /nfs/dbraw/zinc/46/98/20/1395469820.db2.gz YFYRNBHLIFNEDY-ZDUSSCGKSA-N 1 1 335.404 2.610 10 5 EFBEMO CC[C@H](OC(=O)c1cc(C[NH+](C)C)on1)c1cccc([N+](=O)[O-])c1 ZINC001458460996 1395474623 /nfs/dbraw/zinc/47/46/23/1395474623.db2.gz OQTFFCRSGLZPOC-HNNXBMFYSA-N 1 1 333.344 2.953 10 5 EFBEMO CC[N@H+]1CCCN(Cc2cc([N+](=O)[O-])ccc2Br)CC1 ZINC001459406062 1395848306 /nfs/dbraw/zinc/84/83/06/1395848306.db2.gz OFGITYVCILXQFO-UHFFFAOYSA-N 1 1 342.237 2.885 10 5 EFBEMO CC(=O)Nc1cccc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c1 ZINC001460617112 1396239121 /nfs/dbraw/zinc/23/91/21/1396239121.db2.gz AAQZRLDSBORXEY-SFHVURJKSA-N 1 1 343.383 2.551 10 5 EFBEMO C[N@H+](Cc1ccc2cc[nH]c2c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001460681612 1396242650 /nfs/dbraw/zinc/24/26/50/1396242650.db2.gz ZUKFAKCCZXLLRZ-UHFFFAOYSA-N 1 1 338.367 2.807 10 5 EFBEMO C[N@@H+](Cc1ccc2cc[nH]c2c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001460681612 1396242656 /nfs/dbraw/zinc/24/26/56/1396242656.db2.gz ZUKFAKCCZXLLRZ-UHFFFAOYSA-N 1 1 338.367 2.807 10 5 EFBEMO Cn1cc([C@@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)nn1 ZINC001460948366 1396273287 /nfs/dbraw/zinc/27/32/87/1396273287.db2.gz VBRCCCAEAMSOPY-GFCCVEGCSA-N 1 1 335.795 2.756 10 5 EFBEMO Cn1cc([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)nn1 ZINC001460948366 1396273289 /nfs/dbraw/zinc/27/32/89/1396273289.db2.gz VBRCCCAEAMSOPY-GFCCVEGCSA-N 1 1 335.795 2.756 10 5 EFBEMO Cc1c(NC(=O)c2cc([C@H]3CCC[N@H+]3C)[nH]n2)cccc1[N+](=O)[O-] ZINC001463565876 1396503002 /nfs/dbraw/zinc/50/30/02/1396503002.db2.gz DCOZZWMOOVMXAN-OAHLLOKOSA-N 1 1 329.360 2.645 10 5 EFBEMO Cc1c(NC(=O)c2cc([C@H]3CCC[N@@H+]3C)[nH]n2)cccc1[N+](=O)[O-] ZINC001463565876 1396503003 /nfs/dbraw/zinc/50/30/03/1396503003.db2.gz DCOZZWMOOVMXAN-OAHLLOKOSA-N 1 1 329.360 2.645 10 5 EFBEMO Cc1cc(C(=O)N2CC[N@H+](C)C3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC001468220967 1396935200 /nfs/dbraw/zinc/93/52/00/1396935200.db2.gz CUDGCIYAIGSXGH-UHFFFAOYSA-N 1 1 331.416 2.994 10 5 EFBEMO C[C@H](c1ccccc1)[N@H+](CCO)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001473290855 1397293706 /nfs/dbraw/zinc/29/37/06/1397293706.db2.gz GFCBOXGBAAFVSW-CQSZACIVSA-N 1 1 343.383 2.589 10 5 EFBEMO C[C@H](c1ccccc1)[N@@H+](CCO)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001473290855 1397293711 /nfs/dbraw/zinc/29/37/11/1397293711.db2.gz GFCBOXGBAAFVSW-CQSZACIVSA-N 1 1 343.383 2.589 10 5 EFBEMO CCOC(=O)[C@@H](C)[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001473389003 1397299024 /nfs/dbraw/zinc/29/90/24/1397299024.db2.gz IVGJVJYNDBICEW-CYBMUJFWSA-N 1 1 336.388 2.780 10 5 EFBEMO CCOC(=O)[C@@H](C)[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001473389003 1397299025 /nfs/dbraw/zinc/29/90/25/1397299025.db2.gz IVGJVJYNDBICEW-CYBMUJFWSA-N 1 1 336.388 2.780 10 5 EFBEMO COC(=O)[C@H]1C[C@@H](C(F)(F)F)C[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001473639260 1397317183 /nfs/dbraw/zinc/31/71/83/1397317183.db2.gz AXWIPCMHUSWWAV-NWDGAFQWSA-N 1 1 346.305 2.768 10 5 EFBEMO COC(=O)[C@H]1C[C@@H](C(F)(F)F)C[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001473639260 1397317186 /nfs/dbraw/zinc/31/71/86/1397317186.db2.gz AXWIPCMHUSWWAV-NWDGAFQWSA-N 1 1 346.305 2.768 10 5 EFBEMO CN(C)c1nc2c(s1)C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC2 ZINC001473763923 1397328750 /nfs/dbraw/zinc/32/87/50/1397328750.db2.gz MFIQRMHVTLSYQO-UHFFFAOYSA-N 1 1 332.429 2.718 10 5 EFBEMO CCOc1cc(C[N@H+]2CC[C@@]3(C(=O)OC)CCC[C@@H]23)ccc1[N+](=O)[O-] ZINC001473776942 1397330581 /nfs/dbraw/zinc/33/05/81/1397330581.db2.gz BYLMHZQQXHQEHH-AEFFLSMTSA-N 1 1 348.399 2.911 10 5 EFBEMO C[C@H]([NH2+]Cc1cc(=O)n2ccsc2n1)c1ccc([N+](=O)[O-])cc1 ZINC001473784806 1397331906 /nfs/dbraw/zinc/33/19/06/1397331906.db2.gz HAWYLYGTCFPUTL-JTQLQIEISA-N 1 1 330.369 2.515 10 5 EFBEMO CC[N@@H+](CCCNC(=O)CC(F)(F)F)Cc1ccccc1[N+](=O)[O-] ZINC001479838428 1397936437 /nfs/dbraw/zinc/93/64/37/1397936437.db2.gz HGGSZGRKMFHBCD-UHFFFAOYSA-N 1 1 347.337 2.875 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1cncs1)Cc1cccc([N+](=O)[O-])c1 ZINC001493282610 1398585420 /nfs/dbraw/zinc/58/54/20/1398585420.db2.gz XELRLPDRJICULG-UHFFFAOYSA-N 1 1 348.428 2.693 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1ccsn1)Cc1cccc([N+](=O)[O-])c1 ZINC001493299627 1398595890 /nfs/dbraw/zinc/59/58/90/1398595890.db2.gz RWEOONKHUQXOJW-UHFFFAOYSA-N 1 1 348.428 2.693 10 5 EFBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1cccc(F)c1 ZINC001496654359 1400902364 /nfs/dbraw/zinc/90/23/64/1400902364.db2.gz XGAFWQJMWGOEJZ-UHFFFAOYSA-N 1 1 345.374 2.938 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1cccc(F)c1 ZINC001496654359 1400902368 /nfs/dbraw/zinc/90/23/68/1400902368.db2.gz XGAFWQJMWGOEJZ-UHFFFAOYSA-N 1 1 345.374 2.938 10 5 EFBEMO Cc1ccoc1C(=O)N(C)CC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001496661899 1400907605 /nfs/dbraw/zinc/90/76/05/1400907605.db2.gz FCIQNSNMRQHHAG-UHFFFAOYSA-N 1 1 331.372 2.700 10 5 EFBEMO Cc1ccoc1C(=O)N(C)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001496661899 1400907612 /nfs/dbraw/zinc/90/76/12/1400907612.db2.gz FCIQNSNMRQHHAG-UHFFFAOYSA-N 1 1 331.372 2.700 10 5 EFBEMO CC/C=C(/C)C(=O)N1C[C@@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001501209214 1403493649 /nfs/dbraw/zinc/49/36/49/1403493649.db2.gz WWXPTGWVHYIBEL-PLRRLCDQSA-N 1 1 343.427 2.841 10 5 EFBEMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H]2CCC[N@H+]2C2CCCCC2)n1 ZINC001556397268 1415067162 /nfs/dbraw/zinc/06/71/62/1415067162.db2.gz MKJLQXXEVLDJQQ-HNNXBMFYSA-N 1 1 346.431 2.825 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC001556775013 1415087625 /nfs/dbraw/zinc/08/76/25/1415087625.db2.gz WIQVXXNZGMLHFC-KRWDZBQOSA-N 1 1 335.379 2.600 10 5 EFBEMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1C[N@@H+](C)CC1(C)C ZINC001558504352 1415183832 /nfs/dbraw/zinc/18/38/32/1415183832.db2.gz XOOMYUYNTIRABD-RISCZKNCSA-N 1 1 337.445 2.532 10 5 EFBEMO CC[N@H+]1C[C@@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C(C)(C)C1 ZINC001558527606 1415186157 /nfs/dbraw/zinc/18/61/57/1415186157.db2.gz RPXGSOBVQOWYBM-CQSZACIVSA-N 1 1 337.445 2.533 10 5 EFBEMO COc1ccc2ncc([N+](=O)[O-])c(NCC[N@H+]3CCCC3(C)C)c2c1 ZINC001559210210 1415229928 /nfs/dbraw/zinc/22/99/28/1415229928.db2.gz GVNLULQWXFVKMK-UHFFFAOYSA-N 1 1 344.415 2.860 10 5 EFBEMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@@H]1CC[N@H+](C(C)(C)C)C1 ZINC001559234820 1415232167 /nfs/dbraw/zinc/23/21/67/1415232167.db2.gz QJYQHCVJIIITJT-GFCCVEGCSA-N 1 1 335.404 2.975 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)cc1C ZINC001559304243 1415238988 /nfs/dbraw/zinc/23/89/88/1415238988.db2.gz QGDNSXRTWSZBIH-VHDGCEQUSA-N 1 1 347.415 2.832 10 5 EFBEMO CC[C@H](O)[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001559556772 1415250761 /nfs/dbraw/zinc/25/07/61/1415250761.db2.gz JBNNJIVUMIELMO-GJZGRUSLSA-N 1 1 346.387 2.770 10 5 EFBEMO C[C@H](c1ccccc1)[N@@H+](CCO)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC001559664113 1415252225 /nfs/dbraw/zinc/25/22/25/1415252225.db2.gz WJPMIBTUAQHJNP-RDTXWAMCSA-N 1 1 330.384 2.684 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H]3[C@H](C2)C3(F)F)cccc1[N+](=O)[O-] ZINC001559665141 1415252262 /nfs/dbraw/zinc/25/22/62/1415252262.db2.gz DJACXMAUJBPZCE-NEPJUHHUSA-N 1 1 339.342 2.819 10 5 EFBEMO C[C@H](c1ccccc1)[N@@H+](CCO)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC001559664112 1415252626 /nfs/dbraw/zinc/25/26/26/1415252626.db2.gz WJPMIBTUAQHJNP-KDOFPFPSSA-N 1 1 330.384 2.684 10 5 EFBEMO Cc1c(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cccc1[N+](=O)[O-] ZINC001560066432 1415261943 /nfs/dbraw/zinc/26/19/43/1415261943.db2.gz VABINETWVUELSP-KRWDZBQOSA-N 1 1 345.355 2.809 10 5 EFBEMO C[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CCN1c1cc[nH+]cc1 ZINC001560108890 1415263495 /nfs/dbraw/zinc/26/34/95/1415263495.db2.gz OLVZRXHZVUKEAG-HNNXBMFYSA-N 1 1 342.399 2.579 10 5 EFBEMO C[C@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)CCN1c1cc[nH+]cc1 ZINC001560108890 1415263499 /nfs/dbraw/zinc/26/34/99/1415263499.db2.gz OLVZRXHZVUKEAG-HNNXBMFYSA-N 1 1 342.399 2.579 10 5 EFBEMO C[C@]12C[N@@H+](CC(=O)Nc3ccccc3[N+](=O)[O-])C[C@H]1[C@H]1CC[C@@H]2C1 ZINC001560185407 1415267730 /nfs/dbraw/zinc/26/77/30/1415267730.db2.gz SRKBROMJYSTVEB-MOROJQBDSA-N 1 1 329.400 2.901 10 5 EFBEMO CC(C)(C)n1cncc1[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC001560234659 1415269879 /nfs/dbraw/zinc/26/98/79/1415269879.db2.gz LPEBLBNOVJHCAQ-CQSZACIVSA-N 1 1 346.435 2.622 10 5 EFBEMO CC(C)(C)n1cncc1[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC001560234658 1415269925 /nfs/dbraw/zinc/26/99/25/1415269925.db2.gz LPEBLBNOVJHCAQ-AWEZNQCLSA-N 1 1 346.435 2.622 10 5 EFBEMO C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C(C)(C)C)cc1 ZINC001566453096 1415554095 /nfs/dbraw/zinc/55/40/95/1415554095.db2.gz DIROAYHWIRUZOE-IAGOWNOFSA-N 1 1 347.459 2.587 10 5 EFBEMO C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C(C)(C)C)cc1 ZINC001566453096 1415554099 /nfs/dbraw/zinc/55/40/99/1415554099.db2.gz DIROAYHWIRUZOE-IAGOWNOFSA-N 1 1 347.459 2.587 10 5 EFBEMO C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C(C)(C)C)cc1 ZINC001566453096 1415554102 /nfs/dbraw/zinc/55/41/02/1415554102.db2.gz DIROAYHWIRUZOE-IAGOWNOFSA-N 1 1 347.459 2.587 10 5 EFBEMO C[N@H+](CCNC(=O)c1c[nH]cc1C1CC1)Cc1cccc([N+](=O)[O-])c1 ZINC001567311926 1416067446 /nfs/dbraw/zinc/06/74/46/1416067446.db2.gz KYUJIFBKLAIHDD-UHFFFAOYSA-N 1 1 342.399 2.662 10 5 EFBEMO C[N@@H+](CCNC(=O)c1c[nH]cc1C1CC1)Cc1cccc([N+](=O)[O-])c1 ZINC001567311926 1416067449 /nfs/dbraw/zinc/06/74/49/1416067449.db2.gz KYUJIFBKLAIHDD-UHFFFAOYSA-N 1 1 342.399 2.662 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1ccccc1F)Cc1ccc([N+](=O)[O-])cc1 ZINC001567325395 1416072892 /nfs/dbraw/zinc/07/28/92/1416072892.db2.gz ZMJNRTFJDYOFBI-UHFFFAOYSA-N 1 1 345.374 2.986 10 5 EFBEMO CC[N@H+](CCNC(=O)c1csnc1C)Cc1ccccc1[N+](=O)[O-] ZINC001567331043 1416077870 /nfs/dbraw/zinc/07/78/70/1416077870.db2.gz ZYOZQHYUXJSXIH-UHFFFAOYSA-N 1 1 348.428 2.612 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1csnc1C)Cc1ccccc1[N+](=O)[O-] ZINC001567331043 1416077879 /nfs/dbraw/zinc/07/78/79/1416077879.db2.gz ZYOZQHYUXJSXIH-UHFFFAOYSA-N 1 1 348.428 2.612 10 5 EFBEMO Cc1[nH]c(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C)[nH+]1 ZINC001646074096 1416609186 /nfs/dbraw/zinc/60/91/86/1416609186.db2.gz GWFLFUPOKJEYGJ-UHFFFAOYSA-N 1 1 342.277 2.884 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC001685527315 1416766388 /nfs/dbraw/zinc/76/63/88/1416766388.db2.gz HBYREHAROADYKU-KKUMJFAQSA-N 1 1 348.447 2.822 10 5 EFBEMO CCCCCC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 ZINC001699974712 1417534811 /nfs/dbraw/zinc/53/48/11/1417534811.db2.gz ZWKVUFUJEHGPQZ-ZHCJQAHYSA-N 1 1 337.464 2.591 10 5 EFBEMO CCCCCC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2 ZINC001699974712 1417534814 /nfs/dbraw/zinc/53/48/14/1417534814.db2.gz ZWKVUFUJEHGPQZ-ZHCJQAHYSA-N 1 1 337.464 2.591 10 5 EFBEMO CCCCCC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2 ZINC001699974712 1417534816 /nfs/dbraw/zinc/53/48/16/1417534816.db2.gz ZWKVUFUJEHGPQZ-ZHCJQAHYSA-N 1 1 337.464 2.591 10 5 EFBEMO Cc1cc(C(=O)NCCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])ns1 ZINC001712943076 1418288907 /nfs/dbraw/zinc/28/89/07/1418288907.db2.gz SBDZMBFQBAYWMP-UHFFFAOYSA-N 1 1 348.428 2.612 10 5 EFBEMO Cc1ccc(F)c(C(=O)NCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC001713468881 1418547350 /nfs/dbraw/zinc/54/73/50/1418547350.db2.gz QQQPFAPADFJBAB-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO Cc1ccc(F)c(C(=O)NCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC001713468881 1418547352 /nfs/dbraw/zinc/54/73/52/1418547352.db2.gz QQQPFAPADFJBAB-UHFFFAOYSA-N 1 1 345.374 2.904 10 5 EFBEMO O=C(NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1)C1CC2(CCC2)C1 ZINC001715861381 1418691701 /nfs/dbraw/zinc/69/17/01/1418691701.db2.gz UOWTWNLCKJMZSE-OWOJBTEDSA-N 1 1 349.456 2.999 10 5 EFBEMO CC/C=C(\C)C(=O)N1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1 ZINC001717008451 1419145140 /nfs/dbraw/zinc/14/51/40/1419145140.db2.gz MFBJOSAERWOYSV-JYWGOBKKSA-N 1 1 343.427 2.841 10 5 EFBEMO O=C(NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)c1ccccc1 ZINC001723491138 1424511846 /nfs/dbraw/zinc/51/18/46/1424511846.db2.gz NAIAWSMKJAHAJA-UHFFFAOYSA-N 1 1 331.397 2.709 10 5 EFBEMO O=C(NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)C1(CCF)CC1 ZINC001723544384 1424520367 /nfs/dbraw/zinc/52/03/67/1424520367.db2.gz OPGYWDAXHNDBIC-UHFFFAOYSA-N 1 1 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CCc1[nH]ccc1C(=O)NCCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001731239286 1426347315 /nfs/dbraw/zinc/34/73/15/1426347315.db2.gz NTQVDQIWLCQJNQ-UHFFFAOYSA-N 1 1 344.415 2.737 10 5 EFBEMO CC(C)(C)OC(=O)[C@H]1CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000176166155 715161595 /nfs/dbraw/zinc/16/15/95/715161595.db2.gz PWXWKUQLDUHUJJ-ZDUSSCGKSA-N 1 1 346.387 2.566 10 5 EFBEMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000176166155 715161598 /nfs/dbraw/zinc/16/15/98/715161598.db2.gz PWXWKUQLDUHUJJ-ZDUSSCGKSA-N 1 1 346.387 2.566 10 5 EFBEMO COC(=O)/C=C/c1ccc(NCC[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000108087692 715402344 /nfs/dbraw/zinc/40/23/44/715402344.db2.gz JGHBQBONXLIWEQ-IZPAUZPXSA-N 1 1 347.415 2.925 10 5 EFBEMO CC[C@@H](NC(=O)NCC[N@H+]1CC[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000893450943 715541614 /nfs/dbraw/zinc/54/16/14/715541614.db2.gz PFXZXXWALLREFZ-XJKSGUPXSA-N 1 1 334.420 2.687 10 5 EFBEMO [NH3+]C[C@H]1CCC[C@@H]1NCc1ccc(Br)cc1[N+](=O)[O-] 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CC/C=C\CC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001483816056 1112485159 /nfs/dbraw/zinc/48/51/59/1112485159.db2.gz NAACJYYLTNUECO-GRFNRIFCSA-N 1 1 349.475 2.711 10 5 EFBEMO CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000171577800 529761258 /nfs/dbraw/zinc/76/12/58/529761258.db2.gz RUBBIAQZZAUECF-LBPRGKRZSA-N 1 1 334.401 2.893 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](CNC(=O)C(C)C)C1 ZINC000183309999 235001846 /nfs/dbraw/zinc/00/18/46/235001846.db2.gz SZDCTWADRCUXIT-HNNXBMFYSA-N 1 1 333.432 2.887 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCO[C@]4(CCOC4)C3)o2)c1 ZINC000187546264 236242037 /nfs/dbraw/zinc/24/20/37/236242037.db2.gz YMAJUGSTKWKWGJ-GOSISDBHSA-N 1 1 344.367 2.846 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCO[C@]4(CCOC4)C3)o2)c1 ZINC000187546264 236242039 /nfs/dbraw/zinc/24/20/39/236242039.db2.gz YMAJUGSTKWKWGJ-GOSISDBHSA-N 1 1 344.367 2.846 10 5 EFBEMO O=C([C@@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1)N1CCCC1 ZINC000353564680 296014518 /nfs/dbraw/zinc/01/45/18/296014518.db2.gz DJUBUSYGYQFYKA-ZGRWHYIRSA-N 1 1 343.427 2.942 10 5 EFBEMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000191381913 239076799 /nfs/dbraw/zinc/07/67/99/239076799.db2.gz OXUAPEZLTCCTCT-AWEZNQCLSA-N 1 1 332.404 2.914 10 5 EFBEMO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2ccc3cncn3c2)n1 ZINC000414188232 244039137 /nfs/dbraw/zinc/03/91/37/244039137.db2.gz QHEKQOQEMNZLQK-HOTGVXAUSA-N 1 1 340.387 2.713 10 5 EFBEMO Cn1ccnc1[C@H]([NH2+][C@@H]1CCC[C@@H](CO)C1)c1ccc([N+](=O)[O-])cc1 ZINC000414337153 244092347 /nfs/dbraw/zinc/09/23/47/244092347.db2.gz KNWHNNKJXPKEPC-FRFSOERESA-N 1 1 344.415 2.558 10 5 EFBEMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H]2Cc2cc(F)ccc2F)n1 ZINC000419302521 245370521 /nfs/dbraw/zinc/37/05/21/245370521.db2.gz PVTKCWFYOQSBJP-AWEZNQCLSA-N 1 1 336.342 2.777 10 5 EFBEMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000110992739 220089084 /nfs/dbraw/zinc/08/90/84/220089084.db2.gz OWWKRGXWBLBNDO-ZDUSSCGKSA-N 1 1 330.388 2.680 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441198693 250007094 /nfs/dbraw/zinc/00/70/94/250007094.db2.gz NNGAXRSRHLKXIM-HUUCEWRRSA-N 1 1 347.415 2.590 10 5 EFBEMO CCc1cnc(N2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000441352429 250021603 /nfs/dbraw/zinc/02/16/03/250021603.db2.gz DXGOYTGVRPIVKX-UHFFFAOYSA-N 1 1 346.456 2.978 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441274769 250013911 /nfs/dbraw/zinc/01/39/11/250013911.db2.gz GALQIEGYWUZACB-GJZGRUSLSA-N 1 1 347.415 2.590 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441274769 250013915 /nfs/dbraw/zinc/01/39/15/250013915.db2.gz GALQIEGYWUZACB-GJZGRUSLSA-N 1 1 347.415 2.590 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000441285895 250015629 /nfs/dbraw/zinc/01/56/29/250015629.db2.gz ZKVZUYTZNMMJMO-HUUCEWRRSA-N 1 1 347.415 2.672 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441281244 250015812 /nfs/dbraw/zinc/01/58/12/250015812.db2.gz TWLWQCYEFOSCGR-KFWWJZLASA-N 1 1 347.415 2.670 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)c1ncc(Br)cc1[N+](=O)[O-] ZINC000092670772 218157368 /nfs/dbraw/zinc/15/73/68/218157368.db2.gz ILLVOJXXUQLLEL-NSHDSACASA-N 1 1 343.225 2.673 10 5 EFBEMO CCCC(=O)N[C@@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092708212 218162113 /nfs/dbraw/zinc/16/21/13/218162113.db2.gz NLBYNORJNLAKTM-DXWDOBMASA-N 1 1 331.416 2.989 10 5 EFBEMO CCCC(=O)N[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092708212 218162114 /nfs/dbraw/zinc/16/21/14/218162114.db2.gz NLBYNORJNLAKTM-DXWDOBMASA-N 1 1 331.416 2.989 10 5 EFBEMO COc1cc(CN(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000093644318 218239062 /nfs/dbraw/zinc/23/90/62/218239062.db2.gz CAZDXQAKJXRZKC-GXTWGEPZSA-N 1 1 337.420 2.527 10 5 EFBEMO C[N@H+](Cc1cccnc1)C[C@@H]1CCCN(c2ccc([N+](=O)[O-])nc2)C1 ZINC000095398328 218330604 /nfs/dbraw/zinc/33/06/04/218330604.db2.gz YLHPMHCIHOKPAI-INIZCTEOSA-N 1 1 341.415 2.733 10 5 EFBEMO C[N@H+](Cc1cccnc1)C[C@H]1CCCN(c2ccc([N+](=O)[O-])nc2)C1 ZINC000095398329 218330905 /nfs/dbraw/zinc/33/09/05/218330905.db2.gz YLHPMHCIHOKPAI-MRXNPFEDSA-N 1 1 341.415 2.733 10 5 EFBEMO O=[N+]([O-])c1cccc(C[N@@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c1 ZINC000449420662 251022066 /nfs/dbraw/zinc/02/20/66/251022066.db2.gz JZARQFDWADVHIQ-ROUUACIJSA-N 1 1 330.359 2.895 10 5 EFBEMO O=[N+]([O-])c1cccc(C[N@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c1 ZINC000449420662 251022070 /nfs/dbraw/zinc/02/20/70/251022070.db2.gz JZARQFDWADVHIQ-ROUUACIJSA-N 1 1 330.359 2.895 10 5 EFBEMO C[C@@H]1OCC[C@H]1[N@@H+](CCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000449679067 251114236 /nfs/dbraw/zinc/11/42/36/251114236.db2.gz QULGHDCWCNCCCC-XJKSGUPXSA-N 1 1 346.383 2.827 10 5 EFBEMO Cc1nc(N[C@H]2CCc3[nH+]c(C(C)(C)C)cn3C2)ncc1[N+](=O)[O-] ZINC000450296566 251334418 /nfs/dbraw/zinc/33/44/18/251334418.db2.gz FBSZHGJOONSHIV-NSHDSACASA-N 1 1 330.392 2.614 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c1 ZINC000451339684 251532322 /nfs/dbraw/zinc/53/23/22/251532322.db2.gz ITQIPHMLMFSUQB-RCCFBDPRSA-N 1 1 334.416 2.989 10 5 EFBEMO C[C@H]([NH2+][C@@H]1COCC1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000451812783 251695862 /nfs/dbraw/zinc/69/58/62/251695862.db2.gz UKZNQTCETWDVTO-GXFFZTMASA-N 1 1 332.360 2.720 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000153762112 224154459 /nfs/dbraw/zinc/15/44/59/224154459.db2.gz XASMFQJQUPVBOA-KSSFIOAISA-N 1 1 343.427 2.992 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2CN2CCOCC2)ccc1Cl ZINC000154053883 224196412 /nfs/dbraw/zinc/19/64/12/224196412.db2.gz AAVNEPSDZOHISQ-CQSZACIVSA-N 1 1 339.823 2.545 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2CN2CCOCC2)ccc1Cl ZINC000154053883 224196414 /nfs/dbraw/zinc/19/64/14/224196414.db2.gz AAVNEPSDZOHISQ-CQSZACIVSA-N 1 1 339.823 2.545 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117756456 221086877 /nfs/dbraw/zinc/08/68/77/221086877.db2.gz GMILBGGMRMHLGW-LBPRGKRZSA-N 1 1 339.823 2.781 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000119212737 221267748 /nfs/dbraw/zinc/26/77/48/221267748.db2.gz PWOPUFVANDRFCS-HNNXBMFYSA-N 1 1 344.415 2.561 10 5 EFBEMO COc1ccc(C[N@H+]2CCC[C@H]2Cn2ccnc2C)cc1[N+](=O)[O-] ZINC000178316218 533559454 /nfs/dbraw/zinc/55/94/54/533559454.db2.gz UBVLAEXZLIQQIH-HNNXBMFYSA-N 1 1 330.388 2.773 10 5 EFBEMO COC[C@@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000341645145 141844086 /nfs/dbraw/zinc/84/40/86/141844086.db2.gz ZWYCQFKXQFUDNM-OAHLLOKOSA-N 1 1 343.383 2.819 10 5 EFBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCCN1CCOCC1 ZINC000344843220 142086640 /nfs/dbraw/zinc/08/66/40/142086640.db2.gz FMXVGRWEPPYELM-SSZFMOIBSA-N 1 1 333.432 2.700 10 5 EFBEMO Cc1c(Br)c(N[C@@H]2CC[N@@H+](C(C)C)C2)ncc1[N+](=O)[O-] ZINC000347429985 142215305 /nfs/dbraw/zinc/21/53/05/142215305.db2.gz MPXZORKOEHDAHK-SNVBAGLBSA-N 1 1 343.225 2.955 10 5 EFBEMO Cc1c(Br)c(N[C@@H]2CC[N@H+](C(C)C)C2)ncc1[N+](=O)[O-] ZINC000347429985 142215306 /nfs/dbraw/zinc/21/53/06/142215306.db2.gz MPXZORKOEHDAHK-SNVBAGLBSA-N 1 1 343.225 2.955 10 5 EFBEMO Cc1ccccc1NC(=O)CC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000347778173 142270687 /nfs/dbraw/zinc/27/06/87/142270687.db2.gz CMPKABQMBUYQBO-UHFFFAOYSA-N 1 1 340.383 2.685 10 5 EFBEMO C[C@H]([NH2+]CC(=O)NCc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000342298202 145095559 /nfs/dbraw/zinc/09/55/59/145095559.db2.gz LBEHDUVNTWUZJQ-LBPRGKRZSA-N 1 1 331.347 2.701 10 5 EFBEMO C[C@H]1c2ccccc2C[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000343601588 145249340 /nfs/dbraw/zinc/24/93/40/145249340.db2.gz HCIBNLAPGAOEIH-ZFWWWQNUSA-N 1 1 328.368 2.911 10 5 EFBEMO C[C@H]1c2ccccc2C[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000343601588 145249342 /nfs/dbraw/zinc/24/93/42/145249342.db2.gz HCIBNLAPGAOEIH-ZFWWWQNUSA-N 1 1 328.368 2.911 10 5 EFBEMO C[C@@H]1c2ccccc2C[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000343601587 145249352 /nfs/dbraw/zinc/24/93/52/145249352.db2.gz HCIBNLAPGAOEIH-UKRRQHHQSA-N 1 1 328.368 2.911 10 5 EFBEMO C[C@@H]1c2ccccc2C[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000343601587 145249355 /nfs/dbraw/zinc/24/93/55/145249355.db2.gz HCIBNLAPGAOEIH-UKRRQHHQSA-N 1 1 328.368 2.911 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H]1CC=CCC1 ZINC000344058603 145358201 /nfs/dbraw/zinc/35/82/01/145358201.db2.gz LEERBJZRIJDMTP-ZDUSSCGKSA-N 1 1 333.388 2.830 10 5 EFBEMO COc1ccc(NC(=O)C[N@@H+](C)C[C@@H]2CC=CCC2)c([N+](=O)[O-])c1 ZINC000344092519 145366282 /nfs/dbraw/zinc/36/62/82/145366282.db2.gz VTGNJYMQTXYUCC-CYBMUJFWSA-N 1 1 333.388 2.830 10 5 EFBEMO COc1cc(C[NH+]2CCC(c3nc(C)no3)CC2)ccc1[N+](=O)[O-] ZINC000351985276 146255940 /nfs/dbraw/zinc/25/59/40/146255940.db2.gz UPIFMXBIONGDCY-UHFFFAOYSA-N 1 1 332.360 2.674 10 5 EFBEMO CCC[N@H+]1CCC[C@@H]1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000352127704 146296334 /nfs/dbraw/zinc/29/63/34/146296334.db2.gz RIRUQKVHBLYHSW-QGZVFWFLSA-N 1 1 333.432 2.908 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+](C)Cc2ccc(C)o2)cc1[N+](=O)[O-] ZINC000355585630 147004343 /nfs/dbraw/zinc/00/43/43/147004343.db2.gz RHDNQCMDHLZVDV-UHFFFAOYSA-N 1 1 348.355 2.680 10 5 EFBEMO COC(=O)COc1ccc(C[N@@H+](C)Cc2ccc(C)o2)cc1[N+](=O)[O-] ZINC000355585630 147004344 /nfs/dbraw/zinc/00/43/44/147004344.db2.gz RHDNQCMDHLZVDV-UHFFFAOYSA-N 1 1 348.355 2.680 10 5 EFBEMO COC(=O)COc1ccc(C[N@H+]2CCC[C@@H](C)CC2)cc1[N+](=O)[O-] ZINC000355606532 147011203 /nfs/dbraw/zinc/01/12/03/147011203.db2.gz LJOABALTMWBHJH-CYBMUJFWSA-N 1 1 336.388 2.769 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@@H](C)[C@H]1C ZINC000355780553 147060774 /nfs/dbraw/zinc/06/07/74/147060774.db2.gz ANHUHAJMJYKTFG-JHJVBQTASA-N 1 1 335.404 2.908 10 5 EFBEMO CNc1c(C(=O)N2CCC(n3c[nH+]cc3C)CC2)cccc1[N+](=O)[O-] ZINC000356271390 147195833 /nfs/dbraw/zinc/19/58/33/147195833.db2.gz BODNCWQCJFIYRE-UHFFFAOYSA-N 1 1 343.387 2.619 10 5 EFBEMO CCNc1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000356282256 147199359 /nfs/dbraw/zinc/19/93/59/147199359.db2.gz PPGODZIZBPHTOG-GXTWGEPZSA-N 1 1 334.420 2.581 10 5 EFBEMO Cc1nc(CC[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)n[nH]1 ZINC000356785424 147335648 /nfs/dbraw/zinc/33/56/48/147335648.db2.gz NGQVXITYUAVZBO-SFHVURJKSA-N 1 1 337.383 2.943 10 5 EFBEMO Cc1nnc(CC[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)[nH]1 ZINC000356785424 147335650 /nfs/dbraw/zinc/33/56/50/147335650.db2.gz NGQVXITYUAVZBO-SFHVURJKSA-N 1 1 337.383 2.943 10 5 EFBEMO CCC(=O)c1ccc(NC[C@H]2CCC[N@H+]2CCOC)c([N+](=O)[O-])c1 ZINC000359479552 148097106 /nfs/dbraw/zinc/09/71/06/148097106.db2.gz GWXKQBHXJSXSHO-CQSZACIVSA-N 1 1 335.404 2.710 10 5 EFBEMO C[C@@H]1CC[C@]2(CC[N@@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C2)C1 ZINC000359555929 148120876 /nfs/dbraw/zinc/12/08/76/148120876.db2.gz LFMJNSMLRVYNEI-KUHUBIRLSA-N 1 1 343.427 2.996 10 5 EFBEMO C[C@H]1CC[C@]2(CC[N@@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C2)C1 ZINC000359555930 148121432 /nfs/dbraw/zinc/12/14/32/148121432.db2.gz LFMJNSMLRVYNEI-LIRRHRJNSA-N 1 1 343.427 2.996 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000364376401 149138948 /nfs/dbraw/zinc/13/89/48/149138948.db2.gz DOQGCZQNPRRTME-UHFFFAOYSA-N 1 1 328.372 2.885 10 5 EFBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000364378721 149139335 /nfs/dbraw/zinc/13/93/35/149139335.db2.gz LAJRGSMWBRPDQL-UHFFFAOYSA-N 1 1 328.372 2.885 10 5 EFBEMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cn2)C1 ZINC000366127252 149560422 /nfs/dbraw/zinc/56/04/22/149560422.db2.gz PAZRNAQHVBFFJN-LSDHHAIUSA-N 1 1 346.431 2.716 10 5 EFBEMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2C[C@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000368092090 150033692 /nfs/dbraw/zinc/03/36/92/150033692.db2.gz IWMMUFLBWBZNJZ-LALPHHSUSA-N 1 1 333.388 2.805 10 5 EFBEMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2C[C@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000368092090 150033693 /nfs/dbraw/zinc/03/36/93/150033693.db2.gz IWMMUFLBWBZNJZ-LALPHHSUSA-N 1 1 333.388 2.805 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@]4(C3)CCCOC4)n2)c1 ZINC000368500506 150134392 /nfs/dbraw/zinc/13/43/92/150134392.db2.gz XHJNGJVXQKAGJU-QGZVFWFLSA-N 1 1 344.371 2.647 10 5 EFBEMO Cc1nccc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000373523230 151183837 /nfs/dbraw/zinc/18/38/37/151183837.db2.gz OSJCGIKRIHEMEL-UHFFFAOYSA-N 1 1 328.372 2.737 10 5 EFBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2c[nH]cn2)CC1 ZINC000374207617 151301437 /nfs/dbraw/zinc/30/14/37/151301437.db2.gz JNAPKGYVPYQMEH-GFCCVEGCSA-N 1 1 343.387 2.525 10 5 EFBEMO C[C@H]1C[C@H](N(C)C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000123746051 222326138 /nfs/dbraw/zinc/32/61/38/222326138.db2.gz IEOQQJKOBVAWKI-WDEREUQCSA-N 1 1 325.796 2.803 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000123406030 222272717 /nfs/dbraw/zinc/27/27/17/222272717.db2.gz LLUWTZKVZUUEOK-AWEZNQCLSA-N 1 1 337.420 2.528 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000123490776 222285665 /nfs/dbraw/zinc/28/56/65/222285665.db2.gz CTXDEJQGMJVWLA-CYBMUJFWSA-N 1 1 342.399 2.747 10 5 EFBEMO C[C@@H]1C[C@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000123967662 222359788 /nfs/dbraw/zinc/35/97/88/222359788.db2.gz ODIJUXGRFMDPIS-DGCLKSJQSA-N 1 1 339.823 2.732 10 5 EFBEMO C[C@H]1C[C@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000123967879 222359825 /nfs/dbraw/zinc/35/98/25/222359825.db2.gz ODIJUXGRFMDPIS-WCQYABFASA-N 1 1 339.823 2.732 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000272406698 266256019 /nfs/dbraw/zinc/25/60/19/266256019.db2.gz ZZLSLTPGVQYHPQ-WWGRRREGSA-N 1 1 349.431 2.651 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000272406698 266256023 /nfs/dbraw/zinc/25/60/23/266256023.db2.gz ZZLSLTPGVQYHPQ-WWGRRREGSA-N 1 1 349.431 2.651 10 5 EFBEMO COc1ccc(NC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000272848391 266397298 /nfs/dbraw/zinc/39/72/98/266397298.db2.gz PWXFOASJNMPZJI-WCQYABFASA-N 1 1 336.392 2.550 10 5 EFBEMO COc1ccc(NC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000272848390 266397353 /nfs/dbraw/zinc/39/73/53/266397353.db2.gz PWXFOASJNMPZJI-DGCLKSJQSA-N 1 1 336.392 2.550 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@H](C)[N@@H+](C)C1CC1 ZINC000276546056 267009985 /nfs/dbraw/zinc/00/99/85/267009985.db2.gz GTYUEHWEUZPIHA-JTQLQIEISA-N 1 1 325.796 2.769 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cc(C)c2F)[C@H](C)C1 ZINC000277727514 267246869 /nfs/dbraw/zinc/24/68/69/267246869.db2.gz PWQFDYQVGSMZHV-DOMZBBRYSA-N 1 1 337.395 2.845 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cc(C)c2F)[C@@H](C)C1 ZINC000277727536 267246891 /nfs/dbraw/zinc/24/68/91/267246891.db2.gz PWQFDYQVGSMZHV-WFASDCNBSA-N 1 1 337.395 2.845 10 5 EFBEMO C[C@H]1C[N@@H+](CCCNCc2cc([N+](=O)[O-])ccc2Cl)CCCO1 ZINC000278044006 267328118 /nfs/dbraw/zinc/32/81/18/267328118.db2.gz XSBXOOZAWWOCPW-ZDUSSCGKSA-N 1 1 341.839 2.839 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)c1 ZINC000247355633 273074506 /nfs/dbraw/zinc/07/45/06/273074506.db2.gz OGNYNRNUALONIR-SMDDNHRTSA-N 1 1 337.445 2.775 10 5 EFBEMO COC(=O)c1cc(N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc(C)c1[N+](=O)[O-] ZINC000268841191 274000568 /nfs/dbraw/zinc/00/05/68/274000568.db2.gz OPJMSHJGPLBHFJ-CJNGLKHVSA-N 1 1 347.415 2.610 10 5 EFBEMO O=C(CC[N@@H+]1CCC[C@@H]1c1cc[nH]n1)Nc1cc([N+](=O)[O-])ccc1F ZINC000285575849 274029052 /nfs/dbraw/zinc/02/90/52/274029052.db2.gz ARFATBFHBSXKGV-OAHLLOKOSA-N 1 1 347.350 2.623 10 5 EFBEMO O=C(CC[N@H+]1CCC[C@@H]1c1cc[nH]n1)Nc1cc([N+](=O)[O-])ccc1F ZINC000285575849 274029054 /nfs/dbraw/zinc/02/90/54/274029054.db2.gz ARFATBFHBSXKGV-OAHLLOKOSA-N 1 1 347.350 2.623 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000286110057 274135666 /nfs/dbraw/zinc/13/56/66/274135666.db2.gz LMVFHTKYIRXEFD-MRXNPFEDSA-N 1 1 343.387 2.792 10 5 EFBEMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000355791794 274385224 /nfs/dbraw/zinc/38/52/24/274385224.db2.gz ZVLZQLCXCWDRRO-MCIONIFRSA-N 1 1 331.416 2.850 10 5 EFBEMO CC(C)c1[nH]nc(C(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)c1[N+](=O)[O-] ZINC000433761353 276040507 /nfs/dbraw/zinc/04/05/07/276040507.db2.gz AEGMFATYULJVBH-ZDUSSCGKSA-N 1 1 349.435 2.532 10 5 EFBEMO CC[N@H+]1CC[C@@H](CNC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000446097740 276212338 /nfs/dbraw/zinc/21/23/38/276212338.db2.gz BDSHHVPYGJVDOJ-NSHDSACASA-N 1 1 325.796 2.628 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000348707210 276213893 /nfs/dbraw/zinc/21/38/93/276213893.db2.gz RJEQRHKYOCFJND-HUUCEWRRSA-N 1 1 348.447 2.504 10 5 EFBEMO C[N@@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@H]1c1ccc(Cl)cc1 ZINC000340581132 277136879 /nfs/dbraw/zinc/13/68/79/277136879.db2.gz WTOUPMTWZQCMRZ-UKRRQHHQSA-N 1 1 348.790 2.752 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@H]1c1ccc(Cl)cc1 ZINC000340581132 277136880 /nfs/dbraw/zinc/13/68/80/277136880.db2.gz WTOUPMTWZQCMRZ-UKRRQHHQSA-N 1 1 348.790 2.752 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000180199235 277137422 /nfs/dbraw/zinc/13/74/22/277137422.db2.gz VAHUFRZDWCEOSD-WBVHZDCISA-N 1 1 325.368 2.770 10 5 EFBEMO C[N@@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)cc1 ZINC000361683365 277169001 /nfs/dbraw/zinc/16/90/01/277169001.db2.gz AZTFHRPNDQSZGT-DLBZAZTESA-N 1 1 343.358 2.909 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)cc1 ZINC000361683365 277169003 /nfs/dbraw/zinc/16/90/03/277169003.db2.gz AZTFHRPNDQSZGT-DLBZAZTESA-N 1 1 343.358 2.909 10 5 EFBEMO CC(C)c1ccc(CN2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000418121178 278036672 /nfs/dbraw/zinc/03/66/72/278036672.db2.gz WXWDESOBLATHEU-CABCVRRESA-N 1 1 335.448 2.605 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)c1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000175167317 279328496 /nfs/dbraw/zinc/32/84/96/279328496.db2.gz RURXFRIFLRSNKG-HNNXBMFYSA-N 1 1 348.447 2.654 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1N1CCN(C[C@H]2CCCC[N@@H+]2C)CC1 ZINC000107296582 281259879 /nfs/dbraw/zinc/25/98/79/281259879.db2.gz DWUJQSZXBXNESZ-MRXNPFEDSA-N 1 1 332.448 2.510 10 5 EFBEMO C[N@H+]1C[C@@H]2CCCN(c3ccc(Br)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000425275547 290281257 /nfs/dbraw/zinc/28/12/57/290281257.db2.gz ARHRQPGNIMVGQT-IINYFYTJSA-N 1 1 340.221 2.888 10 5 EFBEMO O=[N+]([O-])c1cc(C[NH+]2CCC(OC[C@H]3CCOC3)CC2)cs1 ZINC000131896969 293211973 /nfs/dbraw/zinc/21/19/73/293211973.db2.gz IYSUEZQKYGREHI-LBPRGKRZSA-N 1 1 326.418 2.674 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC000291075285 294267324 /nfs/dbraw/zinc/26/73/24/294267324.db2.gz FXILPQRGVHTILW-MRXNPFEDSA-N 1 1 339.367 2.754 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@](C)(F)C1 ZINC000295058691 295263064 /nfs/dbraw/zinc/26/30/64/295263064.db2.gz BEWYBOBTBCJCSU-MRXNPFEDSA-N 1 1 339.367 2.756 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C(=O)NCC2CC2)C1 ZINC000298740991 311019338 /nfs/dbraw/zinc/01/93/38/311019338.db2.gz JQHRIVYOBKQYSJ-XJKSGUPXSA-N 1 1 331.416 2.894 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000299245064 311064998 /nfs/dbraw/zinc/06/49/98/311064998.db2.gz CHCHUPQBQKVZFY-GFCCVEGCSA-N 1 1 330.388 2.680 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@@H+]1CCc2sccc2C1 ZINC000299654209 311107634 /nfs/dbraw/zinc/10/76/34/311107634.db2.gz PEKGOTPDUFYRNZ-UHFFFAOYSA-N 1 1 345.424 2.753 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@H+]1CCc2sccc2C1 ZINC000299654209 311107635 /nfs/dbraw/zinc/10/76/35/311107635.db2.gz PEKGOTPDUFYRNZ-UHFFFAOYSA-N 1 1 345.424 2.753 10 5 EFBEMO C[C@@H]1C[N@H+](C2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)CCO1 ZINC000301076301 311117438 /nfs/dbraw/zinc/11/74/38/311117438.db2.gz IVBCRXNKPKKGFG-GFCCVEGCSA-N 1 1 339.823 2.938 10 5 EFBEMO COC(=O)/C=C/c1ccc(NC[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1 ZINC000301214389 311124943 /nfs/dbraw/zinc/12/49/43/311124943.db2.gz XGMAJHFZKSLSLE-IZPAUZPXSA-N 1 1 333.388 2.535 10 5 EFBEMO COc1cc(F)c([N+](=O)[O-])c(N2C[C@@H]3C[N@H+]4CCCC[C@@H]4[C@@H]3C2)c1 ZINC000301477702 311139510 /nfs/dbraw/zinc/13/95/10/311139510.db2.gz PRFFHKAOEKAXGL-NJZAAPMLSA-N 1 1 335.379 2.663 10 5 EFBEMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ncc([N+](=O)[O-])c(N)n2)cc1 ZINC000301562331 311144672 /nfs/dbraw/zinc/14/46/72/311144672.db2.gz VAAUGGLDGBHHKF-JTQLQIEISA-N 1 1 339.359 2.634 10 5 EFBEMO CC[C@H]1CCCC[N@H+]1CCNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000301630851 311148692 /nfs/dbraw/zinc/14/86/92/311148692.db2.gz BKJWQXULLLFYJL-LBPRGKRZSA-N 1 1 348.403 2.602 10 5 EFBEMO Cc1cc(NC[C@H](C)[N@@H+]2CCOC[C@@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000302003723 311171462 /nfs/dbraw/zinc/17/14/62/311171462.db2.gz JZRZCMUTBQAINZ-KBPBESRZSA-N 1 1 344.415 2.973 10 5 EFBEMO Cc1cc(NC[C@H](C)[N@H+]2CCOC[C@@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000302003723 311171463 /nfs/dbraw/zinc/17/14/63/311171463.db2.gz JZRZCMUTBQAINZ-KBPBESRZSA-N 1 1 344.415 2.973 10 5 EFBEMO Cc1cc(NC[C@@H]2C[N@@H+](C3CC3)CCO2)c2cccc([N+](=O)[O-])c2n1 ZINC000302016763 311172161 /nfs/dbraw/zinc/17/21/61/311172161.db2.gz LXRDMOAEVYNCTO-CQSZACIVSA-N 1 1 342.399 2.727 10 5 EFBEMO Cc1cc(NC[C@@H]2C[N@H+](C3CC3)CCO2)c2cccc([N+](=O)[O-])c2n1 ZINC000302016763 311172162 /nfs/dbraw/zinc/17/21/62/311172162.db2.gz LXRDMOAEVYNCTO-CQSZACIVSA-N 1 1 342.399 2.727 10 5 EFBEMO C[N@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])cn2)[C@@H]1c1cccs1 ZINC000302169597 311182142 /nfs/dbraw/zinc/18/21/42/311182142.db2.gz TYZSWDVBPSKOGP-BXUZGUMPSA-N 1 1 333.417 2.941 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000330708158 311330152 /nfs/dbraw/zinc/33/01/52/311330152.db2.gz NJFCEAWROYBCOX-UHOFOFEASA-N 1 1 349.431 2.651 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000330708158 311330155 /nfs/dbraw/zinc/33/01/55/311330155.db2.gz NJFCEAWROYBCOX-UHOFOFEASA-N 1 1 349.431 2.651 10 5 EFBEMO CC(C)(C)[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1O ZINC000330832090 311337459 /nfs/dbraw/zinc/33/74/59/311337459.db2.gz HJAHQZLUAFKCFR-JKSUJKDBSA-N 1 1 349.431 2.652 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000330836427 311337529 /nfs/dbraw/zinc/33/75/29/311337529.db2.gz IFEWZNMBJYFZJL-GOEBONIOSA-N 1 1 349.431 2.571 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000330836427 311337532 /nfs/dbraw/zinc/33/75/32/311337532.db2.gz IFEWZNMBJYFZJL-GOEBONIOSA-N 1 1 349.431 2.571 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@](O)(C(F)(F)F)C1 ZINC000470178689 313129392 /nfs/dbraw/zinc/12/93/92/313129392.db2.gz MIALOUVREKXTID-DPQIITEBSA-N 1 1 330.306 2.997 10 5 EFBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@](O)(C(F)(F)F)C1 ZINC000470178689 313129396 /nfs/dbraw/zinc/12/93/96/313129396.db2.gz MIALOUVREKXTID-DPQIITEBSA-N 1 1 330.306 2.997 10 5 EFBEMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000485351206 313327005 /nfs/dbraw/zinc/32/70/05/313327005.db2.gz UOCWSFULCNJCDB-UHFFFAOYSA-N 1 1 345.443 2.932 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(c2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)C[C@H]1C ZINC000497515959 315393026 /nfs/dbraw/zinc/39/30/26/315393026.db2.gz PZAKNGRVWNYNDK-OLZOCXBDSA-N 1 1 335.404 2.609 10 5 EFBEMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cn2)C1 ZINC000532136972 317360341 /nfs/dbraw/zinc/36/03/41/317360341.db2.gz BWMGROANQYOIPP-HIFRSBDPSA-N 1 1 340.383 2.555 10 5 EFBEMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cn2)c1 ZINC000532138758 317361195 /nfs/dbraw/zinc/36/11/95/317361195.db2.gz AQWZROIUPFVPRQ-UHFFFAOYSA-N 1 1 342.399 2.760 10 5 EFBEMO C[N@@H+]1CCO[C@H](CSCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000566214955 319047833 /nfs/dbraw/zinc/04/78/33/319047833.db2.gz ZXMVBBMYEHNJSG-HNNXBMFYSA-N 1 1 349.412 2.814 10 5 EFBEMO C[N@H+]1CCO[C@H](CSCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000566214955 319047836 /nfs/dbraw/zinc/04/78/36/319047836.db2.gz ZXMVBBMYEHNJSG-HNNXBMFYSA-N 1 1 349.412 2.814 10 5 EFBEMO O=C(CCNC1CC([NH+]2CCCCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000567700169 319200047 /nfs/dbraw/zinc/20/00/47/319200047.db2.gz GJNGPMVQTUDOIA-UHFFFAOYSA-N 1 1 346.431 2.530 10 5 EFBEMO C[N@H+]1CCCC12CCN(c1nc3c(cc1[N+](=O)[O-])CCCC3)CC2 ZINC000568385494 319278722 /nfs/dbraw/zinc/27/87/22/319278722.db2.gz IEPOQGPZPHOIDU-UHFFFAOYSA-N 1 1 330.432 2.933 10 5 EFBEMO C[C@H](C(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000184199789 323358895 /nfs/dbraw/zinc/35/88/95/323358895.db2.gz IUUYYJKWGQFDOS-AVGNSLFASA-N 1 1 337.395 2.779 10 5 EFBEMO CC(C)[N@@H+]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000161118393 473208578 /nfs/dbraw/zinc/20/85/78/473208578.db2.gz BEEHLDFAXVWCJU-NHYWBVRUSA-N 1 1 339.823 2.636 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000124366447 473237490 /nfs/dbraw/zinc/23/74/90/473237490.db2.gz VXWJQKDAKLCXAD-ZIAGYGMSSA-N 1 1 349.431 2.521 10 5 EFBEMO CCOc1ccc(C(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000161837051 473269556 /nfs/dbraw/zinc/26/95/56/473269556.db2.gz QDEATMAETSZSDK-CQSZACIVSA-N 1 1 349.431 2.701 10 5 EFBEMO Cc1ccnc(N2CC[C@H](C[N@H+](C)Cc3cccnc3)C2)c1[N+](=O)[O-] ZINC000190446488 473278040 /nfs/dbraw/zinc/27/80/40/473278040.db2.gz RZTUJSGSUZOMDT-MRXNPFEDSA-N 1 1 341.415 2.652 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000176976380 473279398 /nfs/dbraw/zinc/27/93/98/473279398.db2.gz YJCSAPSDFYSSGH-ZDUSSCGKSA-N 1 1 337.445 2.873 10 5 EFBEMO Cc1sc(C(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000148553137 473319365 /nfs/dbraw/zinc/31/93/65/473319365.db2.gz STOPUYSJJWXTGO-QWRGUYRKSA-N 1 1 325.434 2.815 10 5 EFBEMO Cc1ccc([C@H](C)[NH2+]CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)o1 ZINC000171234795 473334154 /nfs/dbraw/zinc/33/41/54/473334154.db2.gz LVBJSMAVKNBALO-JTQLQIEISA-N 1 1 347.327 2.514 10 5 EFBEMO COCC[C@H]1CN(c2ccc([N+](=O)[O-])c(OC(C)C)c2)CC[N@H+]1C ZINC000150289218 473337263 /nfs/dbraw/zinc/33/72/63/473337263.db2.gz GBSDNXISILQDKD-HNNXBMFYSA-N 1 1 337.420 2.539 10 5 EFBEMO O=C1C[C@@H]([C@@H]2CCCC[N@@H+]2Cc2cc([N+](=O)[O-])ccc2Cl)CN1 ZINC000125063832 473350304 /nfs/dbraw/zinc/35/03/04/473350304.db2.gz QUIDNZWDJJRDNF-ABAIWWIYSA-N 1 1 337.807 2.739 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N(C)CC[N@H+](C)C1CCN(C)CC1 ZINC000177375502 473367028 /nfs/dbraw/zinc/36/70/28/473367028.db2.gz NIBGCTWHRNLVDI-OAHLLOKOSA-N 1 1 334.464 2.614 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N(C)CC[N@@H+](C)C1CCN(C)CC1 ZINC000177375502 473367034 /nfs/dbraw/zinc/36/70/34/473367034.db2.gz NIBGCTWHRNLVDI-OAHLLOKOSA-N 1 1 334.464 2.614 10 5 EFBEMO Cc1c(C(=O)N2CCC(Cc3[nH+]ccn3C)CC2)cccc1[N+](=O)[O-] ZINC000162672498 473369368 /nfs/dbraw/zinc/36/93/68/473369368.db2.gz AHHOJBNSJMUUHS-UHFFFAOYSA-N 1 1 342.399 2.732 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000185279569 473384439 /nfs/dbraw/zinc/38/44/39/473384439.db2.gz CPMRYXDGXUZTRU-SJLPKXTDSA-N 1 1 345.443 2.860 10 5 EFBEMO CC[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000389402493 476781897 /nfs/dbraw/zinc/78/18/97/476781897.db2.gz PZCYVBODJOZYRR-SECBINFHSA-N 1 1 329.198 2.567 10 5 EFBEMO CC[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000389402493 476781901 /nfs/dbraw/zinc/78/19/01/476781901.db2.gz PZCYVBODJOZYRR-SECBINFHSA-N 1 1 329.198 2.567 10 5 EFBEMO CC[C@H]1[C@H](CO)CC[N@@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000395242453 476842468 /nfs/dbraw/zinc/84/24/68/476842468.db2.gz ZGQFWFYYXJLILZ-AAEUAGOBSA-N 1 1 343.221 2.950 10 5 EFBEMO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000395242453 476842472 /nfs/dbraw/zinc/84/24/72/476842472.db2.gz ZGQFWFYYXJLILZ-AAEUAGOBSA-N 1 1 343.221 2.950 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1cc(=O)n2ccccc2n1 ZINC000024863532 472070902 /nfs/dbraw/zinc/07/09/02/472070902.db2.gz OJFLRFGUBCXKKA-CYBMUJFWSA-N 1 1 338.367 2.796 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cc(=O)n2ccccc2n1 ZINC000024863532 472070904 /nfs/dbraw/zinc/07/09/04/472070904.db2.gz OJFLRFGUBCXKKA-CYBMUJFWSA-N 1 1 338.367 2.796 10 5 EFBEMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2ccc(C)o2)c([N+](=O)[O-])c1 ZINC000041887942 472093945 /nfs/dbraw/zinc/09/39/45/472093945.db2.gz SQMJQPICMYKNNU-UHFFFAOYSA-N 1 1 347.371 2.965 10 5 EFBEMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCN(C[C@@H]2CCCC[N@H+]2C)CC1 ZINC000075718685 472188346 /nfs/dbraw/zinc/18/83/46/472188346.db2.gz BFKBLJBTCJFVLQ-IRXDYDNUSA-N 1 1 346.475 2.758 10 5 EFBEMO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000076120798 472279046 /nfs/dbraw/zinc/27/90/46/472279046.db2.gz AZSBLVYDBJHZPL-RCBQFDQVSA-N 1 1 348.403 2.527 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCOc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000076480409 472353304 /nfs/dbraw/zinc/35/33/04/472353304.db2.gz MLWSSFKLCKHDCB-HUUCEWRRSA-N 1 1 349.431 2.552 10 5 EFBEMO C[N@H+](Cc1ccc(Cl)cc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000031005801 472358621 /nfs/dbraw/zinc/35/86/21/472358621.db2.gz NFSXGDKJJOCJSP-UHFFFAOYSA-N 1 1 333.775 2.979 10 5 EFBEMO C[N@@H+](Cc1ccc(Cl)cc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000031005801 472358624 /nfs/dbraw/zinc/35/86/24/472358624.db2.gz NFSXGDKJJOCJSP-UHFFFAOYSA-N 1 1 333.775 2.979 10 5 EFBEMO Cc1ccc([N+](=O)[O-])c(N2CCN(C[C@@H]3CCCC[N@@H+]3C)CC2)c1 ZINC000088721312 472380874 /nfs/dbraw/zinc/38/08/74/472380874.db2.gz YIDISKNDPULAPD-INIZCTEOSA-N 1 1 332.448 2.510 10 5 EFBEMO C[C@H]1CCCC[N@H+]1CCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000076776166 472401367 /nfs/dbraw/zinc/40/13/67/472401367.db2.gz KTRKNRARXRBVKC-ZDUSSCGKSA-N 1 1 346.431 2.773 10 5 EFBEMO C[C@H]1CCC[N@@H+](CCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000119887459 472597491 /nfs/dbraw/zinc/59/74/91/472597491.db2.gz KFKSUOLLWJFWGR-LBPRGKRZSA-N 1 1 330.388 2.538 10 5 EFBEMO Cc1ccc(C[C@@H](C)[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000090550091 472633892 /nfs/dbraw/zinc/63/38/92/472633892.db2.gz HKQGUPFRSAPANI-OAHLLOKOSA-N 1 1 329.400 2.628 10 5 EFBEMO COc1cc[nH+]c(N2CCN([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000104718292 472687106 /nfs/dbraw/zinc/68/71/06/472687106.db2.gz HRZPHKQRZQXDJH-AWEZNQCLSA-N 1 1 342.399 2.882 10 5 EFBEMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000104976030 472708443 /nfs/dbraw/zinc/70/84/43/472708443.db2.gz NGIAEFKDDLCGPV-GFCCVEGCSA-N 1 1 338.795 2.950 10 5 EFBEMO C[NH+]1CCC(CNc2ccccc2[N+](=O)[O-])(N2CCCCC2)CC1 ZINC000078457514 472718053 /nfs/dbraw/zinc/71/80/53/472718053.db2.gz RRUZCAUGANEFMG-UHFFFAOYSA-N 1 1 332.448 2.957 10 5 EFBEMO CC[C@@H](NC(=O)C[N@@H+](C)[C@@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000156825291 472757792 /nfs/dbraw/zinc/75/77/92/472757792.db2.gz CMYDICDYWCKNEI-HUUCEWRRSA-N 1 1 337.445 2.599 10 5 EFBEMO CC[C@H](NC(=O)C[N@@H+](C)[C@@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000156825145 472757822 /nfs/dbraw/zinc/75/78/22/472757822.db2.gz CMYDICDYWCKNEI-CABCVRRESA-N 1 1 337.445 2.599 10 5 EFBEMO CC[N@H+]1CCC[C@@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000120977570 472778273 /nfs/dbraw/zinc/77/82/73/472778273.db2.gz SWRSRRSHBUJKEI-OAHLLOKOSA-N 1 1 346.431 2.753 10 5 EFBEMO CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000105851826 472789385 /nfs/dbraw/zinc/78/93/85/472789385.db2.gz XGPOSFWEFQWVQD-CYBMUJFWSA-N 1 1 328.372 2.831 10 5 EFBEMO COc1ccc(C[N@@H+]2CCC[C@H](n3cc(C)cn3)C2)cc1[N+](=O)[O-] ZINC000105901399 472803678 /nfs/dbraw/zinc/80/36/78/472803678.db2.gz AMFIMWJQBWDTHR-HNNXBMFYSA-N 1 1 330.388 2.945 10 5 EFBEMO COc1ccc(C[N@H+]2CCC[C@H](n3cc(C)cn3)C2)cc1[N+](=O)[O-] ZINC000105901399 472803684 /nfs/dbraw/zinc/80/36/84/472803684.db2.gz AMFIMWJQBWDTHR-HNNXBMFYSA-N 1 1 330.388 2.945 10 5 EFBEMO COC(=O)/C=C/c1ccc(N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000133533743 472815364 /nfs/dbraw/zinc/81/53/64/472815364.db2.gz OJVWFEQSXABDOP-BILJCIPTSA-N 1 1 345.399 2.818 10 5 EFBEMO Cc1cnc(CC[N@@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)s1 ZINC000157753080 472853289 /nfs/dbraw/zinc/85/32/89/472853289.db2.gz MZOCRMFEEPXFCH-GFCCVEGCSA-N 1 1 348.428 2.861 10 5 EFBEMO Cc1cnc(CC[N@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)s1 ZINC000157753080 472853296 /nfs/dbraw/zinc/85/32/96/472853296.db2.gz MZOCRMFEEPXFCH-GFCCVEGCSA-N 1 1 348.428 2.861 10 5 EFBEMO Cc1ccc(CN2CCC([N@@H+]3CCO[C@@H](C)C3)CC2)cc1[N+](=O)[O-] ZINC000092079178 472854870 /nfs/dbraw/zinc/85/48/70/472854870.db2.gz GJKBFJZFILRQTP-HNNXBMFYSA-N 1 1 333.432 2.588 10 5 EFBEMO Cc1ccc(C[NH+]2CCC(N3CCO[C@@H](C)C3)CC2)cc1[N+](=O)[O-] ZINC000092079178 472854872 /nfs/dbraw/zinc/85/48/72/472854872.db2.gz GJKBFJZFILRQTP-HNNXBMFYSA-N 1 1 333.432 2.588 10 5 EFBEMO Cc1cnc(CC[N@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)s1 ZINC000157803713 472860725 /nfs/dbraw/zinc/86/07/25/472860725.db2.gz NSZIVBZJBQKPAU-UHFFFAOYSA-N 1 1 349.412 2.901 10 5 EFBEMO Cn1cc[nH+]c1CC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000122013357 472964232 /nfs/dbraw/zinc/96/42/32/472964232.db2.gz ATFCKOPHROVYAB-UHFFFAOYSA-N 1 1 346.362 2.562 10 5 EFBEMO Cc1sc(C(=O)N2CCC(Cc3[nH+]ccn3C)CC2)cc1[N+](=O)[O-] ZINC000122031938 472967466 /nfs/dbraw/zinc/96/74/66/472967466.db2.gz OZUAZYVIHKEBOB-UHFFFAOYSA-N 1 1 348.428 2.793 10 5 EFBEMO Cc1sc(C(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000074327330 472989691 /nfs/dbraw/zinc/98/96/91/472989691.db2.gz DPSGGQKTXIKNHO-ZDUSSCGKSA-N 1 1 337.445 2.769 10 5 EFBEMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)c1 ZINC000065967749 473034042 /nfs/dbraw/zinc/03/40/42/473034042.db2.gz CZGZXOMKEWZJET-JLDOPYBVSA-N 1 1 346.427 2.845 10 5 EFBEMO C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000159588585 473041780 /nfs/dbraw/zinc/04/17/80/473041780.db2.gz SZUMGPORBXPOFH-CHWSQXEVSA-N 1 1 343.383 2.941 10 5 EFBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+](Cc1ccco1)C1CCCC1 ZINC000159760601 473058022 /nfs/dbraw/zinc/05/80/22/473058022.db2.gz KTJAKLHDJLSPOR-UHFFFAOYSA-N 1 1 331.372 2.794 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1N1CCN(C[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000080635279 473060040 /nfs/dbraw/zinc/06/00/40/473060040.db2.gz PTEUKCVXLJKDTM-KRWDZBQOSA-N 1 1 332.448 2.510 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000122894199 473072107 /nfs/dbraw/zinc/07/21/07/473072107.db2.gz HSBXFNWFDPVRGM-GXTWGEPZSA-N 1 1 348.403 2.694 10 5 EFBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN(C[C@H]2CCCC[N@H+]2C)CC1 ZINC000109755771 473117972 /nfs/dbraw/zinc/11/79/72/473117972.db2.gz RHWKAYTUDLTUOA-VQIMIIECSA-N 1 1 346.475 2.758 10 5 EFBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN(C[C@H]2CCCC[N@H+]2C)CC1 ZINC000109755768 473118403 /nfs/dbraw/zinc/11/84/03/473118403.db2.gz RHWKAYTUDLTUOA-QFBILLFUSA-N 1 1 346.475 2.758 10 5 EFBEMO C[C@@H]1C[C@H](N(C)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123464092 473143303 /nfs/dbraw/zinc/14/33/03/473143303.db2.gz APKLWHRINAJVCI-ZWNOBZJWSA-N 1 1 325.796 2.803 10 5 EFBEMO CCOCC[N@@H+]1CCN(c2ccc(C(C)=O)cc2[N+](=O)[O-])C[C@H]1CC ZINC000110560666 473162593 /nfs/dbraw/zinc/16/25/93/473162593.db2.gz IMHBPFFMJNOAAD-MRXNPFEDSA-N 1 1 349.431 2.735 10 5 EFBEMO CCOCC[N@H+]1CCN(c2ccc(C(C)=O)cc2[N+](=O)[O-])C[C@H]1CC ZINC000110560666 473162596 /nfs/dbraw/zinc/16/25/96/473162596.db2.gz IMHBPFFMJNOAAD-MRXNPFEDSA-N 1 1 349.431 2.735 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@]4(O)CCCC[C@@H]4C3)nc2c1 ZINC000160719639 473165746 /nfs/dbraw/zinc/16/57/46/473165746.db2.gz AGBPJQPSEHASLP-PXAZEXFGSA-N 1 1 331.372 2.863 10 5 EFBEMO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H]1CCCN(c2cccnn2)C1 ZINC000171551917 473409716 /nfs/dbraw/zinc/40/97/16/473409716.db2.gz NQAVILFEFJSWPZ-HNNXBMFYSA-N 1 1 345.378 2.625 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000177702976 473419434 /nfs/dbraw/zinc/41/94/34/473419434.db2.gz YAGXEXPPTOCTBV-HNNXBMFYSA-N 1 1 345.403 2.561 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177706623 473420739 /nfs/dbraw/zinc/42/07/39/473420739.db2.gz USRKBEHFKYTOQG-LSDHHAIUSA-N 1 1 348.447 2.646 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177706513 473421263 /nfs/dbraw/zinc/42/12/63/473421263.db2.gz HDKDAJQEZMVCJQ-MRXNPFEDSA-N 1 1 348.447 2.648 10 5 EFBEMO CCN1CCC[C@@H]1C[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177706513 473421272 /nfs/dbraw/zinc/42/12/72/473421272.db2.gz HDKDAJQEZMVCJQ-MRXNPFEDSA-N 1 1 348.447 2.648 10 5 EFBEMO CCN1CCC[C@@H]1C[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177706513 473421273 /nfs/dbraw/zinc/42/12/73/473421273.db2.gz HDKDAJQEZMVCJQ-MRXNPFEDSA-N 1 1 348.447 2.648 10 5 EFBEMO CN1CCC[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CC1=O ZINC000191124614 473484466 /nfs/dbraw/zinc/48/44/66/473484466.db2.gz CPYIELWTWZPRHP-UHFFFAOYSA-N 1 1 336.391 2.610 10 5 EFBEMO CN1CCC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CC1=O ZINC000191124614 473484471 /nfs/dbraw/zinc/48/44/71/473484471.db2.gz CPYIELWTWZPRHP-UHFFFAOYSA-N 1 1 336.391 2.610 10 5 EFBEMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000126535149 473524846 /nfs/dbraw/zinc/52/48/46/473524846.db2.gz LNLDFUQJUDDKAT-JTQLQIEISA-N 1 1 345.321 2.685 10 5 EFBEMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H](Oc3cccnc3)C2)cc1 ZINC000152239411 473539466 /nfs/dbraw/zinc/53/94/66/473539466.db2.gz VESIURFVZCCBOB-SFHVURJKSA-N 1 1 343.383 2.912 10 5 EFBEMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000178725045 473549248 /nfs/dbraw/zinc/54/92/48/473549248.db2.gz ZUXLMQCYSSOPIP-MRXNPFEDSA-N 1 1 348.447 2.857 10 5 EFBEMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](c2nncn2C2CC2)C1 ZINC000152430312 473561894 /nfs/dbraw/zinc/56/18/94/473561894.db2.gz SLURUKQCDUUTRI-AWEZNQCLSA-N 1 1 327.388 2.901 10 5 EFBEMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H](c3nncn3C3CC3)C2)cc1 ZINC000152496681 473569884 /nfs/dbraw/zinc/56/98/84/473569884.db2.gz ZTXFZOAJWZHBAY-OAHLLOKOSA-N 1 1 341.415 2.943 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCN(c2cccnn2)CC1 ZINC000116277756 473646115 /nfs/dbraw/zinc/64/61/15/473646115.db2.gz COGQEPDDJYCCBC-UHFFFAOYSA-N 1 1 347.806 2.751 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCN(c2cccnn2)CC1 ZINC000116277756 473646120 /nfs/dbraw/zinc/64/61/20/473646120.db2.gz COGQEPDDJYCCBC-UHFFFAOYSA-N 1 1 347.806 2.751 10 5 EFBEMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@@H]2c2ccco2)c1 ZINC000116298354 473646684 /nfs/dbraw/zinc/64/66/84/473646684.db2.gz OACJUTGXBPTWQA-GOEBONIOSA-N 1 1 332.356 2.765 10 5 EFBEMO Cc1c(OC[C@H](O)C[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000154022745 473660791 /nfs/dbraw/zinc/66/07/91/473660791.db2.gz ZOJGFGKTQFOFTO-QGZVFWFLSA-N 1 1 342.395 2.701 10 5 EFBEMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179252474 473663283 /nfs/dbraw/zinc/66/32/83/473663283.db2.gz PFBXEYDMLNYCEJ-QWRGUYRKSA-N 1 1 333.413 2.974 10 5 EFBEMO CSc1cccc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-] ZINC000186571266 473692165 /nfs/dbraw/zinc/69/21/65/473692165.db2.gz OLJDTQSLYIEVGM-VXGBXAGGSA-N 1 1 337.445 2.871 10 5 EFBEMO C[N@H+]1CC[C@@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000192766096 473721984 /nfs/dbraw/zinc/72/19/84/473721984.db2.gz GFHSFFFAEQDJFH-WBVHZDCISA-N 1 1 340.383 2.551 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186671573 473722224 /nfs/dbraw/zinc/72/22/24/473722224.db2.gz KVUYRDLIMROORK-LBPRGKRZSA-N 1 1 337.445 2.873 10 5 EFBEMO COC(=O)C[C@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000179896981 473750986 /nfs/dbraw/zinc/75/09/86/473750986.db2.gz DARBFWNTQLCKMU-LLVKDONJSA-N 1 1 344.314 2.724 10 5 EFBEMO COC(=O)C[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000179896981 473750991 /nfs/dbraw/zinc/75/09/91/473750991.db2.gz DARBFWNTQLCKMU-LLVKDONJSA-N 1 1 344.314 2.724 10 5 EFBEMO CCCNC(=O)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180003256 473773838 /nfs/dbraw/zinc/77/38/38/473773838.db2.gz PTDQFDWQLMRWED-GOSISDBHSA-N 1 1 327.384 2.800 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000246260724 473809267 /nfs/dbraw/zinc/80/92/67/473809267.db2.gz LCKQWLIFSAZZIF-HOTGVXAUSA-N 1 1 347.415 2.520 10 5 EFBEMO COc1ccc(OCC[N@H+]2CCCC[C@H]2c2cn[nH]c2)c([N+](=O)[O-])c1 ZINC000173398592 473825574 /nfs/dbraw/zinc/82/55/74/473825574.db2.gz VASDKMRWCTUQFA-HNNXBMFYSA-N 1 1 346.387 2.933 10 5 EFBEMO Cc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)n1 ZINC000187262274 473847940 /nfs/dbraw/zinc/84/79/40/473847940.db2.gz HTLNIWMOERPJMV-HNNXBMFYSA-N 1 1 327.388 2.688 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000246448267 473868114 /nfs/dbraw/zinc/86/81/14/473868114.db2.gz LKRFVFIWLPOCRH-KBPBESRZSA-N 1 1 344.415 2.543 10 5 EFBEMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000246557285 473901216 /nfs/dbraw/zinc/90/12/16/473901216.db2.gz WJNYBVKVXMYILK-ZYHUDNBSSA-N 1 1 325.796 2.707 10 5 EFBEMO C[C@H](NC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000246582410 473907592 /nfs/dbraw/zinc/90/75/92/473907592.db2.gz CHVBFRKZOOYONL-QRTARXTBSA-N 1 1 346.431 2.782 10 5 EFBEMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2COc3ccccc3[C@H]2O)c1 ZINC000288459980 473949399 /nfs/dbraw/zinc/94/93/99/473949399.db2.gz DTSBGIVNJUDVRW-GDBMZVCRSA-N 1 1 334.759 2.832 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2C[C@@H](c3ccsc3)[C@H](CO)C2)c1 ZINC000188124823 473992746 /nfs/dbraw/zinc/99/27/46/473992746.db2.gz YGLYIYWQUWMXEM-YOEHRIQHSA-N 1 1 348.424 2.743 10 5 EFBEMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1F ZINC000181338857 474028016 /nfs/dbraw/zinc/02/80/16/474028016.db2.gz CHRCFVYRULYKKT-LLVKDONJSA-N 1 1 331.347 2.992 10 5 EFBEMO Cc1c(C[N@@H+]2CCCC[C@H](N3CCN(C)CC3)C2)cccc1[N+](=O)[O-] ZINC000174877645 474111494 /nfs/dbraw/zinc/11/14/94/474111494.db2.gz SHBQCOXNVCCDTE-SFHVURJKSA-N 1 1 346.475 2.505 10 5 EFBEMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000247300814 474112881 /nfs/dbraw/zinc/11/28/81/474112881.db2.gz LKKAYALMRMXFHP-GXFFZTMASA-N 1 1 325.796 2.707 10 5 EFBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000175010852 474131583 /nfs/dbraw/zinc/13/15/83/474131583.db2.gz QOZBWMXXTSWWAN-HNNXBMFYSA-N 1 1 349.431 2.615 10 5 EFBEMO CCOc1ccc(C(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2CC)cc1[N+](=O)[O-] ZINC000175042152 474136583 /nfs/dbraw/zinc/13/65/83/474136583.db2.gz MHEASXCMXGIACK-HUUCEWRRSA-N 1 1 347.415 2.692 10 5 EFBEMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000247441208 474147993 /nfs/dbraw/zinc/14/79/93/474147993.db2.gz RZWFGHKSOVXXJF-IINYFYTJSA-N 1 1 325.796 2.707 10 5 EFBEMO CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)c1 ZINC000247467229 474153815 /nfs/dbraw/zinc/15/38/15/474153815.db2.gz RIYRGDKRQRKRFH-NEPJUHHUSA-N 1 1 335.429 2.625 10 5 EFBEMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000265017036 474164213 /nfs/dbraw/zinc/16/42/13/474164213.db2.gz XULFHWKFMQCHCR-BXUZGUMPSA-N 1 1 329.356 2.650 10 5 EFBEMO C[N@H+]1CC[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000248047684 474251457 /nfs/dbraw/zinc/25/14/57/474251457.db2.gz NFXFFHXFAODNOV-VQIMIIECSA-N 1 1 339.395 2.699 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000275842699 474336888 /nfs/dbraw/zinc/33/68/88/474336888.db2.gz HEJDSYBVCZHPFM-OLZOCXBDSA-N 1 1 337.807 2.913 10 5 EFBEMO CC[C@@H](NC(=O)N[C@@H]1CCC[N@@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000175953889 474347752 /nfs/dbraw/zinc/34/77/52/474347752.db2.gz YNPYAAKUFJMRNH-GDBMZVCRSA-N 1 1 334.420 2.829 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2CCC[N@@H+]2C[C@H]1C ZINC000248613303 474378204 /nfs/dbraw/zinc/37/82/04/474378204.db2.gz QYNJDVQUJGQRJV-FZTGFJCWSA-N 1 1 329.400 2.693 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000248623625 474382601 /nfs/dbraw/zinc/38/26/01/474382601.db2.gz MVIVXIBHTRUGFP-WFASDCNBSA-N 1 1 339.411 2.905 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000248623623 474383181 /nfs/dbraw/zinc/38/31/81/474383181.db2.gz MVIVXIBHTRUGFP-SWLSCSKDSA-N 1 1 339.411 2.905 10 5 EFBEMO COC(=O)[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000271056826 474388896 /nfs/dbraw/zinc/38/88/96/474388896.db2.gz ARTWVUISULVJIQ-ZDUSSCGKSA-N 1 1 330.340 2.850 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000271056825 474388935 /nfs/dbraw/zinc/38/89/35/474388935.db2.gz ARTWVUISULVJIQ-CYBMUJFWSA-N 1 1 330.340 2.850 10 5 EFBEMO CC1(C)CO[C@@H](c2ccccc2)C[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000176227713 474415705 /nfs/dbraw/zinc/41/57/05/474415705.db2.gz GSDWNGPXOQNMGK-OAHLLOKOSA-N 1 1 330.388 2.643 10 5 EFBEMO CC1(C)CO[C@@H](c2ccccc2)C[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000176227713 474415707 /nfs/dbraw/zinc/41/57/07/474415707.db2.gz GSDWNGPXOQNMGK-OAHLLOKOSA-N 1 1 330.388 2.643 10 5 EFBEMO CC[C@@H](NC(=O)NC[C@H]1CCC[N@H+]1CC)c1cccc([N+](=O)[O-])c1 ZINC000176317191 474438106 /nfs/dbraw/zinc/43/81/06/474438106.db2.gz KERKIAVSPRILCG-HZPDHXFCSA-N 1 1 334.420 2.829 10 5 EFBEMO CCOCC[N@@H+]1CCN(c2cccc(OCC)c2[N+](=O)[O-])C[C@@H]1C ZINC000184110571 474473340 /nfs/dbraw/zinc/47/33/40/474473340.db2.gz OCNLEAXLJYPVCU-AWEZNQCLSA-N 1 1 337.420 2.541 10 5 EFBEMO CCOCC[N@H+]1CCN(c2cccc(OCC)c2[N+](=O)[O-])C[C@@H]1C ZINC000184110571 474473343 /nfs/dbraw/zinc/47/33/43/474473343.db2.gz OCNLEAXLJYPVCU-AWEZNQCLSA-N 1 1 337.420 2.541 10 5 EFBEMO CSc1cccc(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-] ZINC000249112139 474529243 /nfs/dbraw/zinc/52/92/43/474529243.db2.gz BULLGCQQHRQPKM-DGCLKSJQSA-N 1 1 337.445 2.775 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+](C)[C@@]2(CO)CC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000249535569 474588085 /nfs/dbraw/zinc/58/80/85/474588085.db2.gz CJIGNDQIGZGFDS-ACJLOTCBSA-N 1 1 349.431 2.715 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC[N@@H+](CC)C1 ZINC000184703162 474589524 /nfs/dbraw/zinc/58/95/24/474589524.db2.gz ZSEXJELWLUHSCV-CVEARBPZSA-N 1 1 333.432 2.622 10 5 EFBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000249627383 474600703 /nfs/dbraw/zinc/60/07/03/474600703.db2.gz QISSFRRUYKOQCL-GJZGRUSLSA-N 1 1 347.415 2.611 10 5 EFBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCC[N@@H+](CC)C1 ZINC000184763964 474602525 /nfs/dbraw/zinc/60/25/25/474602525.db2.gz RAMCVHHZOMEUCF-HZPDHXFCSA-N 1 1 333.432 2.764 10 5 EFBEMO C[C@H]1CN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[N@H+](C2CCC2)C1 ZINC000291630881 474636009 /nfs/dbraw/zinc/63/60/09/474636009.db2.gz BMHDRXFCQHNHCS-GFCCVEGCSA-N 1 1 329.404 2.782 10 5 EFBEMO CO[C@@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@@H]1C ZINC000251929397 474651696 /nfs/dbraw/zinc/65/16/96/474651696.db2.gz SZRDHILWFDKRQY-SMDDNHRTSA-N 1 1 332.360 2.502 10 5 EFBEMO CO[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@@H]1C ZINC000251929397 474651700 /nfs/dbraw/zinc/65/17/00/474651700.db2.gz SZRDHILWFDKRQY-SMDDNHRTSA-N 1 1 332.360 2.502 10 5 EFBEMO C[N@@H+]1CC[C@H](NC(=O)c2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000252477185 474662027 /nfs/dbraw/zinc/66/20/27/474662027.db2.gz JUMDISCTDFHLDB-DOTOQJQBSA-N 1 1 343.358 2.909 10 5 EFBEMO C[N@H+]1CC[C@H](NC(=O)c2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000252477185 474662034 /nfs/dbraw/zinc/66/20/34/474662034.db2.gz JUMDISCTDFHLDB-DOTOQJQBSA-N 1 1 343.358 2.909 10 5 EFBEMO COc1cc(N[C@@H]2CC[N@@H+](C[C@H]3CCCO3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000252477369 474662945 /nfs/dbraw/zinc/66/29/45/474662945.db2.gz MQMACDRHCXUVHG-NUEKZKHPSA-N 1 1 349.431 2.905 10 5 EFBEMO O=[N+]([O-])c1cc(F)cc(OC[C@H](O)C[N@H+]2CCc3ccccc3C2)c1 ZINC000305299950 474728639 /nfs/dbraw/zinc/72/86/39/474728639.db2.gz JBJQJTCKRVJRGS-QGZVFWFLSA-N 1 1 346.358 2.532 10 5 EFBEMO O=[N+]([O-])c1cc(F)cc(OC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c1 ZINC000305299949 474728663 /nfs/dbraw/zinc/72/86/63/474728663.db2.gz JBJQJTCKRVJRGS-KRWDZBQOSA-N 1 1 346.358 2.532 10 5 EFBEMO C[N@H+]1CCN(CCNc2c3ccccc3ncc2[N+](=O)[O-])CC1(C)C ZINC000291920342 474751973 /nfs/dbraw/zinc/75/19/73/474751973.db2.gz LPBMGJFOMOPJPV-UHFFFAOYSA-N 1 1 343.431 2.581 10 5 EFBEMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(-n2cncn2)cc1 ZINC000338956936 474777469 /nfs/dbraw/zinc/77/74/69/474777469.db2.gz XFQAOQHQIBOLOU-UHFFFAOYSA-N 1 1 337.383 2.850 10 5 EFBEMO C[C@H]1CC[C@@H](C(N)=O)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000338961859 474780317 /nfs/dbraw/zinc/78/03/17/474780317.db2.gz RJJPFARQZLEVEA-VHSXEESVSA-N 1 1 345.321 2.699 10 5 EFBEMO C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000338961859 474780323 /nfs/dbraw/zinc/78/03/23/474780323.db2.gz RJJPFARQZLEVEA-VHSXEESVSA-N 1 1 345.321 2.699 10 5 EFBEMO CC(C)[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCOC1 ZINC000292002994 474796703 /nfs/dbraw/zinc/79/67/03/474796703.db2.gz XKHSWZHPHQVSJK-AWEZNQCLSA-N 1 1 332.360 2.644 10 5 EFBEMO CC(C)[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCOC1 ZINC000292002994 474796711 /nfs/dbraw/zinc/79/67/11/474796711.db2.gz XKHSWZHPHQVSJK-AWEZNQCLSA-N 1 1 332.360 2.644 10 5 EFBEMO COc1cc(C[N@@H+]2CCc3ccccc3[C@@H]2CO)ccc1[N+](=O)[O-] ZINC000305856372 474799741 /nfs/dbraw/zinc/79/97/41/474799741.db2.gz WOPJRQZUUVUEPY-KRWDZBQOSA-N 1 1 328.368 2.695 10 5 EFBEMO COc1cc(C[N@H+]2CCc3ccccc3[C@@H]2CO)ccc1[N+](=O)[O-] ZINC000305856372 474799750 /nfs/dbraw/zinc/79/97/50/474799750.db2.gz WOPJRQZUUVUEPY-KRWDZBQOSA-N 1 1 328.368 2.695 10 5 EFBEMO CC[C@H]1CN(C/C=C\c2ccccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000255234076 474825142 /nfs/dbraw/zinc/82/51/42/474825142.db2.gz XAUFESRYYZCGFX-QLBOMPFWSA-N 1 1 333.432 2.651 10 5 EFBEMO C[N@H+]1CCO[C@H]2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C[C@@H]21 ZINC000285063529 474878369 /nfs/dbraw/zinc/87/83/69/474878369.db2.gz OWIUTEKMDQPQKW-KBPBESRZSA-N 1 1 345.321 2.523 10 5 EFBEMO C[N@H+]1CCO[C@H]2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C[C@H]21 ZINC000285063531 474878392 /nfs/dbraw/zinc/87/83/92/474878392.db2.gz OWIUTEKMDQPQKW-KGLIPLIRSA-N 1 1 345.321 2.523 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1 ZINC000278895055 474899975 /nfs/dbraw/zinc/89/99/75/474899975.db2.gz ZTQZRCAXWSJKFR-NSHDSACASA-N 1 1 337.807 2.937 10 5 EFBEMO C[C@@H]([NH2+]Cc1cc([O-])ccc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000339074073 474901146 /nfs/dbraw/zinc/90/11/46/474901146.db2.gz ILOBVGHQNDDWBM-QVQLBTGDSA-N 1 1 334.397 2.889 10 5 EFBEMO C[N@H+]1CCO[C@H]2CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C[C@H]21 ZINC000285170723 474915255 /nfs/dbraw/zinc/91/52/55/474915255.db2.gz UWXZGLUNFBBXDP-KGLIPLIRSA-N 1 1 345.321 2.523 10 5 EFBEMO COc1cc(C[N@@H+](C)[C@H]2C[C@@H](OC)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000285286209 474958504 /nfs/dbraw/zinc/95/85/04/474958504.db2.gz GBFJAIAWBQGFKB-PHIMTYICSA-N 1 1 346.330 2.814 10 5 EFBEMO COc1cc(C[N@H+](C)[C@H]2C[C@@H](OC)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000285286209 474958509 /nfs/dbraw/zinc/95/85/09/474958509.db2.gz GBFJAIAWBQGFKB-PHIMTYICSA-N 1 1 346.330 2.814 10 5 EFBEMO COC(=O)[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000293459436 474990261 /nfs/dbraw/zinc/99/02/61/474990261.db2.gz LBSHCNICFVNMIB-VIFPVBQESA-N 1 1 332.278 2.609 10 5 EFBEMO COC(=O)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000293459436 474990268 /nfs/dbraw/zinc/99/02/68/474990268.db2.gz LBSHCNICFVNMIB-VIFPVBQESA-N 1 1 332.278 2.609 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCN(c3ccccn3)CC2)cc1F ZINC000328586452 475032314 /nfs/dbraw/zinc/03/23/14/475032314.db2.gz ZDEZZYLYTAIGHA-UHFFFAOYSA-N 1 1 330.363 2.841 10 5 EFBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCCN(c3ccccn3)CC2)cc1F ZINC000328586452 475032318 /nfs/dbraw/zinc/03/23/18/475032318.db2.gz ZDEZZYLYTAIGHA-UHFFFAOYSA-N 1 1 330.363 2.841 10 5 EFBEMO CC[N@H+]1CC[C@H]2OCCN(c3ccc(Cl)cc3[N+](=O)[O-])[C@H]2C1 ZINC000292819135 475208198 /nfs/dbraw/zinc/20/81/98/475208198.db2.gz OVXYWVTUXYHSCX-LSDHHAIUSA-N 1 1 325.796 2.548 10 5 EFBEMO CN(C)CC[NH+]1CCC(Nc2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000296191705 475220763 /nfs/dbraw/zinc/22/07/63/475220763.db2.gz BPFPQEBWJBUDNR-UHFFFAOYSA-N 1 1 343.431 2.581 10 5 EFBEMO CNc1c(C(=O)NCC[N@@H+](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000361181231 475249962 /nfs/dbraw/zinc/24/99/62/475249962.db2.gz YQXYLSCNYKXVLJ-UHFFFAOYSA-N 1 1 334.420 2.631 10 5 EFBEMO COc1cc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)ccc1O ZINC000352399620 475256663 /nfs/dbraw/zinc/25/66/63/475256663.db2.gz MNYRCRLLSLRCAL-UHFFFAOYSA-N 1 1 332.356 2.950 10 5 EFBEMO COc1cc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)ccc1O ZINC000352399620 475256672 /nfs/dbraw/zinc/25/66/72/475256672.db2.gz MNYRCRLLSLRCAL-UHFFFAOYSA-N 1 1 332.356 2.950 10 5 EFBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN(Cc2nccn2C)CC1 ZINC000352406505 475263367 /nfs/dbraw/zinc/26/33/67/475263367.db2.gz QENRUPGQBCMKAZ-HNNXBMFYSA-N 1 1 343.431 2.516 10 5 EFBEMO Cc1ccc([C@@H](C)NC(=O)N[C@H]2CCc3nc[nH]c3C2)cc1[N+](=O)[O-] ZINC000357954881 475289861 /nfs/dbraw/zinc/28/98/61/475289861.db2.gz HYBUPJGHCLQDRA-YPMHNXCESA-N 1 1 343.387 2.544 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000352546389 475401281 /nfs/dbraw/zinc/40/12/81/475401281.db2.gz ULBISUOEZANTPT-ZDUSSCGKSA-N 1 1 336.388 2.767 10 5 EFBEMO COc1cc(C[N@@H+](C)[C@H](CC(N)=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000361468580 475472181 /nfs/dbraw/zinc/47/21/81/475472181.db2.gz HKGJORSHGJSVFN-MRXNPFEDSA-N 1 1 343.383 2.652 10 5 EFBEMO C[C@@H](c1cccc(Nc2ccncc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000352642487 475484282 /nfs/dbraw/zinc/48/42/82/475484282.db2.gz ZJHYDLXUIRSVMQ-ZDUSSCGKSA-N 1 1 328.372 2.549 10 5 EFBEMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000348249294 475523351 /nfs/dbraw/zinc/52/33/51/475523351.db2.gz WJNDHSSIFDROMD-OSMZGAPFSA-N 1 1 348.321 2.607 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCCC[C@H]3CCO)n2)c1 ZINC000342067281 475543634 /nfs/dbraw/zinc/54/36/34/475543634.db2.gz RTSBDMGIJXCWJS-AWEZNQCLSA-N 1 1 346.387 2.772 10 5 EFBEMO COc1cc(C[N@H+]2CC[C@@](CO)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000361592037 475578189 /nfs/dbraw/zinc/57/81/89/475578189.db2.gz UYKCFROQNCSBIE-LJQANCHMSA-N 1 1 342.395 2.739 10 5 EFBEMO C[C@H]1CCCCC[N@@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000358378941 475631930 /nfs/dbraw/zinc/63/19/30/475631930.db2.gz CWSZHSAESISYEW-NSHDSACASA-N 1 1 335.360 2.527 10 5 EFBEMO C[C@H]1CCCCC[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000358378941 475631936 /nfs/dbraw/zinc/63/19/36/475631936.db2.gz CWSZHSAESISYEW-NSHDSACASA-N 1 1 335.360 2.527 10 5 EFBEMO CCN(CCC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1)CC(F)(F)F ZINC000355063718 475639920 /nfs/dbraw/zinc/63/99/20/475639920.db2.gz WYXKUAQJYDSZLX-UHFFFAOYSA-N 1 1 346.353 2.622 10 5 EFBEMO COc1c(C)c[nH+]c(CN2CCc3ncc([N+](=O)[O-])cc3C2)c1C ZINC000353031930 475682989 /nfs/dbraw/zinc/68/29/89/475682989.db2.gz GIQDBSXZLNSZHF-UHFFFAOYSA-N 1 1 328.372 2.569 10 5 EFBEMO COc1cc(C[N@H+]2CCC[C@H]3COCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000355128554 475686454 /nfs/dbraw/zinc/68/64/54/475686454.db2.gz CNZDIPSFDVJJGZ-GXTWGEPZSA-N 1 1 336.388 2.613 10 5 EFBEMO Cc1sc(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000343066410 475736021 /nfs/dbraw/zinc/73/60/21/475736021.db2.gz GELWEBHXRVFLIN-GHMZBOCLSA-N 1 1 325.434 2.957 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c2c(c1)COCO2 ZINC000355207481 475743815 /nfs/dbraw/zinc/74/38/15/475743815.db2.gz OCUFMGPFEZZYKO-UONOGXRCSA-N 1 1 348.399 2.710 10 5 EFBEMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c2c(c1)COCO2 ZINC000355207476 475744153 /nfs/dbraw/zinc/74/41/53/475744153.db2.gz OCUFMGPFEZZYKO-KGLIPLIRSA-N 1 1 348.399 2.710 10 5 EFBEMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1C ZINC000338425091 475892531 /nfs/dbraw/zinc/89/25/31/475892531.db2.gz PSYGSQSCURXOOL-AWEZNQCLSA-N 1 1 334.420 2.683 10 5 EFBEMO CC[N@H+]1CCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H](C)C1 ZINC000343265792 475904285 /nfs/dbraw/zinc/90/42/85/475904285.db2.gz CEAZCTHUWDVFIL-CQSZACIVSA-N 1 1 341.415 2.891 10 5 EFBEMO COc1ccccc1[C@@H](C)[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000340323730 475946163 /nfs/dbraw/zinc/94/61/63/475946163.db2.gz RJAYGXSBHOAMOV-GFCCVEGCSA-N 1 1 329.356 2.893 10 5 EFBEMO C[C@@]12CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C[C@@H]1C2(F)F ZINC000298221694 476024460 /nfs/dbraw/zinc/02/44/60/476024460.db2.gz GDGPAVDGLYIWKR-DZGCQCFKSA-N 1 1 339.342 2.901 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CC([N@@H+](C)Cc3ccccc3)C2)n1 ZINC000343624164 476092600 /nfs/dbraw/zinc/09/26/00/476092600.db2.gz JHQMEKNLMGKNPN-UHFFFAOYSA-N 1 1 326.400 2.927 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000334074055 476106245 /nfs/dbraw/zinc/10/62/45/476106245.db2.gz GWZJSCATXFRQLL-CZUORRHYSA-N 1 1 348.447 2.775 10 5 EFBEMO Cn1ccnc1[C@H]([NH2+]CC1(CCO)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000353650154 476156854 /nfs/dbraw/zinc/15/68/54/476156854.db2.gz ZFBVURDBHBTTDS-MRXNPFEDSA-N 1 1 344.415 2.560 10 5 EFBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000357077812 476211168 /nfs/dbraw/zinc/21/11/68/476211168.db2.gz XLHSPWZZNMCNTH-KDOFPFPSSA-N 1 1 347.415 2.814 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H]4COCC[C@@H]43)n2)c1 ZINC000362453261 476262135 /nfs/dbraw/zinc/26/21/35/476262135.db2.gz WWVNWVYNXRVRIW-HIFRSBDPSA-N 1 1 344.371 2.646 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H]4COCC[C@H]43)n2)c1 ZINC000362453260 476262624 /nfs/dbraw/zinc/26/26/24/476262624.db2.gz WWVNWVYNXRVRIW-DZGCQCFKSA-N 1 1 344.371 2.646 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000362455718 476264992 /nfs/dbraw/zinc/26/49/92/476264992.db2.gz SWRFIHNZZOXZSK-YOEHRIQHSA-N 1 1 347.415 2.733 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000360666893 476334446 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VLILMDNDQGBBOQ-CQSZACIVSA-N 1 1 337.420 2.977 10 5 EFBEMO Cc1noc(C)c1CO[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000375160289 476694647 /nfs/dbraw/zinc/69/46/47/476694647.db2.gz OIUBIVWLIWGKRJ-INIZCTEOSA-N 1 1 331.372 2.991 10 5 EFBEMO Cc1noc(C)c1CO[C@@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000375171599 476701232 /nfs/dbraw/zinc/70/12/32/476701232.db2.gz QBOSIHXUYOXQSK-OAHLLOKOSA-N 1 1 331.372 2.991 10 5 EFBEMO Cc1noc(C)c1CO[C@@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000375171599 476701240 /nfs/dbraw/zinc/70/12/40/476701240.db2.gz QBOSIHXUYOXQSK-OAHLLOKOSA-N 1 1 331.372 2.991 10 5 EFBEMO COC[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000452074696 476806629 /nfs/dbraw/zinc/80/66/29/476806629.db2.gz CGZMHZXXAZMAFC-CYBMUJFWSA-N 1 1 346.387 2.893 10 5 EFBEMO COC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000452075724 476808388 /nfs/dbraw/zinc/80/83/88/476808388.db2.gz AYPSTOIBZCJRFS-CABCVRRESA-N 1 1 349.431 2.979 10 5 EFBEMO O=[N+]([O-])c1ccc(NC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)cn1 ZINC000391066683 476810088 /nfs/dbraw/zinc/81/00/88/476810088.db2.gz NPQZRZSEUWICSS-KRWDZBQOSA-N 1 1 342.399 2.693 10 5 EFBEMO COC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000452096655 476820744 /nfs/dbraw/zinc/82/07/44/476820744.db2.gz YKJCEHPMASAFJB-KGLIPLIRSA-N 1 1 335.404 2.670 10 5 EFBEMO COC[C@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000452110159 476830816 /nfs/dbraw/zinc/83/08/16/476830816.db2.gz YETLSVWRWOKYRQ-ZDUSSCGKSA-N 1 1 346.387 2.893 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](c2nc(C3CC3)no2)C1 ZINC000375465260 476851915 /nfs/dbraw/zinc/85/19/15/476851915.db2.gz MVOVNFOKUQTKEU-ZDUSSCGKSA-N 1 1 344.371 2.853 10 5 EFBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c1 ZINC000375465230 476852194 /nfs/dbraw/zinc/85/21/94/476852194.db2.gz HSAWRHCARSSYKY-CYBMUJFWSA-N 1 1 344.371 2.724 10 5 EFBEMO Cn1cnc([N+](=O)[O-])c1NC[C@@]1(C)CCC[N@H+]1Cc1ccccc1 ZINC000398004894 476865438 /nfs/dbraw/zinc/86/54/38/476865438.db2.gz XIGCLRKIQCKRJG-QGZVFWFLSA-N 1 1 329.404 2.795 10 5 EFBEMO C[NH+](C)CCOCCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000447590834 477018693 /nfs/dbraw/zinc/01/86/93/477018693.db2.gz FSNKFIJILKMUQP-IBGZPJMESA-N 1 1 343.427 2.852 10 5 EFBEMO C[N@@H+](CCN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)Cc1ccc(F)cc1 ZINC000447667618 477032340 /nfs/dbraw/zinc/03/23/40/477032340.db2.gz FGXBCHHOFNBPGL-UHFFFAOYSA-N 1 1 343.362 2.576 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@H]1CCS(C)(=O)=O ZINC000366553376 477064931 /nfs/dbraw/zinc/06/49/31/477064931.db2.gz KPAAWVSGGGULKJ-HNNXBMFYSA-N 1 1 340.445 2.692 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@H]1CCS(C)(=O)=O ZINC000366553376 477064935 /nfs/dbraw/zinc/06/49/35/477064935.db2.gz KPAAWVSGGGULKJ-HNNXBMFYSA-N 1 1 340.445 2.692 10 5 EFBEMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000411379715 477211143 /nfs/dbraw/zinc/21/11/43/477211143.db2.gz BQMDAKOBZPJGQM-YOEHRIQHSA-N 1 1 348.447 2.586 10 5 EFBEMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000411379715 477211145 /nfs/dbraw/zinc/21/11/45/477211145.db2.gz BQMDAKOBZPJGQM-YOEHRIQHSA-N 1 1 348.447 2.586 10 5 EFBEMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000411379712 477211576 /nfs/dbraw/zinc/21/15/76/477211576.db2.gz BQMDAKOBZPJGQM-PBHICJAKSA-N 1 1 348.447 2.586 10 5 EFBEMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000411379712 477211580 /nfs/dbraw/zinc/21/15/80/477211580.db2.gz BQMDAKOBZPJGQM-PBHICJAKSA-N 1 1 348.447 2.586 10 5 EFBEMO CC(C)Oc1cc(C(=O)NCC[N@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000411415901 477226347 /nfs/dbraw/zinc/22/63/47/477226347.db2.gz NXMFNCJVCXWMRQ-AWEZNQCLSA-N 1 1 349.431 2.986 10 5 EFBEMO Nc1nccc([C@@H]2CCC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000366981460 477284515 /nfs/dbraw/zinc/28/45/15/477284515.db2.gz KKSCQHVYXQGVIP-LLVKDONJSA-N 1 1 347.806 2.830 10 5 EFBEMO Nc1nccc([C@@H]2CCC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000366981460 477284517 /nfs/dbraw/zinc/28/45/17/477284517.db2.gz KKSCQHVYXQGVIP-LLVKDONJSA-N 1 1 347.806 2.830 10 5 EFBEMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CCN(c2cnccn2)CC1 ZINC000367217921 477399877 /nfs/dbraw/zinc/39/98/77/477399877.db2.gz CVSKDYDQEHFMKE-UHFFFAOYSA-N 1 1 345.378 2.625 10 5 EFBEMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cc4cccnc4o3)C2)nc1 ZINC000449029843 477400753 /nfs/dbraw/zinc/40/07/53/477400753.db2.gz PYFRHDMBCQCCLD-ZDUSSCGKSA-N 1 1 339.355 2.817 10 5 EFBEMO O=[N+]([O-])c1cnc(NCc2ccc(C[NH+]3CCOCC3)cc2)c(F)c1 ZINC000413030462 477477304 /nfs/dbraw/zinc/47/73/04/477477304.db2.gz HEBVQOCGEZDYJG-UHFFFAOYSA-N 1 1 346.362 2.573 10 5 EFBEMO COCC[N@H+]1CCC[C@H]1CNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413114513 477526251 /nfs/dbraw/zinc/52/62/51/477526251.db2.gz DVLFADPFOGGFAS-JTQLQIEISA-N 1 1 348.325 2.531 10 5 EFBEMO C[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H](c2ccccc2)C1 ZINC000450228904 477584356 /nfs/dbraw/zinc/58/43/56/477584356.db2.gz VUHGBMNYAGICLM-KRWDZBQOSA-N 1 1 337.383 2.964 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CCC[C@H]2C[N@H+](C)C[C@H]21 ZINC000425067928 477628991 /nfs/dbraw/zinc/62/89/91/477628991.db2.gz SMMPLSMCWWRJGX-SMDDNHRTSA-N 1 1 337.807 2.723 10 5 EFBEMO C[C@H](c1ccccc1)[C@@H](O)C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000450690435 477683409 /nfs/dbraw/zinc/68/34/09/477683409.db2.gz GVINFEXKANHVAZ-ACJLOTCBSA-N 1 1 327.384 2.513 10 5 EFBEMO C[C@H](c1ccccc1)[C@@H](O)C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000450690435 477683416 /nfs/dbraw/zinc/68/34/16/477683416.db2.gz GVINFEXKANHVAZ-ACJLOTCBSA-N 1 1 327.384 2.513 10 5 EFBEMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000372283847 477734937 /nfs/dbraw/zinc/73/49/37/477734937.db2.gz VFFMAFACKRHZOM-OHOWAWRESA-N 1 1 348.399 2.651 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](C(C)C)C1 ZINC000438493274 477852094 /nfs/dbraw/zinc/85/20/94/477852094.db2.gz LIZUIBRGEDDSGJ-ZDUSSCGKSA-N 1 1 335.404 2.910 10 5 EFBEMO CC[C@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000493870229 477867530 /nfs/dbraw/zinc/86/75/30/477867530.db2.gz DGYIZBPGFHLHPB-ZDUSSCGKSA-N 1 1 341.839 2.791 10 5 EFBEMO CCOc1ccc(C(=O)N2CC[N@@H+](CC)C[C@@H]2CC)cc1[N+](=O)[O-] ZINC000456348036 477876721 /nfs/dbraw/zinc/87/67/21/477876721.db2.gz KCQXVTYQXPEZMI-AWEZNQCLSA-N 1 1 335.404 2.550 10 5 EFBEMO COc1cc(C[N@@H+]2C[C@@H](O)CC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000421032840 477923187 /nfs/dbraw/zinc/92/31/87/477923187.db2.gz ZKDYTMXAJHENOB-ONGXEEELSA-N 1 1 346.330 2.550 10 5 EFBEMO COc1cc(C[N@H+]2C[C@@H](O)CC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000421032840 477923195 /nfs/dbraw/zinc/92/31/95/477923195.db2.gz ZKDYTMXAJHENOB-ONGXEEELSA-N 1 1 346.330 2.550 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@H](O)C[C@H]1[C@@H]1CCCOC1 ZINC000451299930 477939709 /nfs/dbraw/zinc/93/97/09/477939709.db2.gz KVKIXXHQMCLRGM-YUELXQCFSA-N 1 1 340.807 2.610 10 5 EFBEMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@H](O)C[C@H]1[C@H]1CCCOC1 ZINC000451299928 477939923 /nfs/dbraw/zinc/93/99/23/477939923.db2.gz KVKIXXHQMCLRGM-CFVMTHIKSA-N 1 1 340.807 2.610 10 5 EFBEMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1 ZINC000451340607 477964025 /nfs/dbraw/zinc/96/40/25/477964025.db2.gz JXSVHHITHROLSI-KSZLIROESA-N 1 1 334.416 2.989 10 5 EFBEMO O=C(C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O)Nc1ccccc1[N+](=O)[O-] ZINC000451350862 477969118 /nfs/dbraw/zinc/96/91/18/477969118.db2.gz ZYHNTRPWCKILSG-FRFSOERESA-N 1 1 347.415 2.549 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc2c1 ZINC000451351219 477969500 /nfs/dbraw/zinc/96/95/00/477969500.db2.gz IKWFFAUAKHMPKO-XKQJLSEDSA-N 1 1 344.415 2.987 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@](O)(CO)C3)s2)cc1 ZINC000459664330 478028672 /nfs/dbraw/zinc/02/86/72/478028672.db2.gz AYJBHVNKIQYOKR-KRWDZBQOSA-N 1 1 348.424 2.643 10 5 EFBEMO O=C(CNc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000600228393 478298735 /nfs/dbraw/zinc/29/87/35/478298735.db2.gz KWTUQEGBSWGTPZ-HNNXBMFYSA-N 1 1 346.431 2.530 10 5 EFBEMO O=C(NC[C@H]1CC[N@H+]1C1CCCCC1)c1ccc(F)cc1[N+](=O)[O-] ZINC000600228476 478299187 /nfs/dbraw/zinc/29/91/87/478299187.db2.gz BDGQMRPLJCRYRD-CQSZACIVSA-N 1 1 335.379 2.871 10 5 EFBEMO CNc1c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)cccc1[N+](=O)[O-] ZINC000600230004 478301670 /nfs/dbraw/zinc/30/16/70/478301670.db2.gz NPCXXLUDBPBHJD-AWEZNQCLSA-N 1 1 346.431 2.773 10 5 EFBEMO CCOc1ccc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000600470730 478382968 /nfs/dbraw/zinc/38/29/68/478382968.db2.gz IFBXVHVEKBLVJK-HNNXBMFYSA-N 1 1 347.415 2.740 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000600468737 478383791 /nfs/dbraw/zinc/38/37/91/478383791.db2.gz HCKOSVJDAPNSJA-OAHLLOKOSA-N 1 1 331.416 2.958 10 5 EFBEMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000597576377 478417675 /nfs/dbraw/zinc/41/76/75/478417675.db2.gz BUTSQSQFBGEGCP-ZIAGYGMSSA-N 1 1 347.346 2.599 10 5 EFBEMO CCc1ccc([C@@H]([NH2+]C[C@](C)(CO)OC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000594511776 478419323 /nfs/dbraw/zinc/41/93/23/478419323.db2.gz OOCRQAFSQHXIGA-ZWKOTPCHSA-N 1 1 348.399 2.827 10 5 EFBEMO COc1cc(C[NH2+]Cc2cccc(C)c2OC)c([N+](=O)[O-])cc1O ZINC000594523014 478425511 /nfs/dbraw/zinc/42/55/11/478425511.db2.gz VBLKWFAUHRFYNX-UHFFFAOYSA-N 1 1 332.356 2.916 10 5 EFBEMO Cc1[nH+]cn(CCCCc2noc(-c3ccc([N+](=O)[O-])cn3)n2)c1C ZINC000594534067 478427682 /nfs/dbraw/zinc/42/76/82/478427682.db2.gz GUDJLZWKQHVNFT-UHFFFAOYSA-N 1 1 342.359 2.876 10 5 EFBEMO Cc1[nH+]cn(CCCCc2noc(-c3ccc([N+](=O)[O-])n3C)n2)c1C ZINC000594533667 478427896 /nfs/dbraw/zinc/42/78/96/478427896.db2.gz DSGIBAHVHXLOGV-UHFFFAOYSA-N 1 1 344.375 2.820 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000597853966 478541027 /nfs/dbraw/zinc/54/10/27/478541027.db2.gz FPBSRCGOAJYVAQ-GFCCVEGCSA-N 1 1 344.415 2.926 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000597856868 478541971 /nfs/dbraw/zinc/54/19/71/478541971.db2.gz BXCSCUDGPAHUMW-LBPRGKRZSA-N 1 1 337.445 2.676 10 5 EFBEMO CSc1ccc(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000597858742 478545187 /nfs/dbraw/zinc/54/51/87/478545187.db2.gz OQYGAIQDUOHZHD-LBPRGKRZSA-N 1 1 337.445 2.919 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+]1C(C)(C)C ZINC000597859735 478547276 /nfs/dbraw/zinc/54/72/76/478547276.db2.gz GLEYZWSWFGAJEY-GFCCVEGCSA-N 1 1 335.404 2.596 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000597925541 478579283 /nfs/dbraw/zinc/57/92/83/478579283.db2.gz WVCLXAHLCBPMOR-LLVKDONJSA-N 1 1 330.388 2.679 10 5 EFBEMO CC[N@H+]1CC[C@H](N(C)C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000571382094 478581999 /nfs/dbraw/zinc/58/19/99/478581999.db2.gz HNZVQZKSFDYQOS-VBQJREDUSA-N 1 1 333.432 2.887 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(CC)[C@H]1CC[N@@H+](C)C1 ZINC000597946313 478590349 /nfs/dbraw/zinc/59/03/49/478590349.db2.gz OCJLWWSFPROMLT-RDJZCZTQSA-N 1 1 333.432 2.716 10 5 EFBEMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000600997679 478605191 /nfs/dbraw/zinc/60/51/91/478605191.db2.gz AVPKPUYDZVKGOR-IRXDYDNUSA-N 1 1 343.427 2.760 10 5 EFBEMO CCC[N@@H+](C)C[C@H]1CCN(c2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC000542048342 478625184 /nfs/dbraw/zinc/62/51/84/478625184.db2.gz XPVVFWQTMWFBNE-CYBMUJFWSA-N 1 1 335.404 2.550 10 5 EFBEMO CCN(C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)[C@@H]1CC[N@@H+](CC)C1 ZINC000598038478 478627180 /nfs/dbraw/zinc/62/71/80/478627180.db2.gz DLZPVIIQQBEGTA-GFCCVEGCSA-N 1 1 330.388 2.632 10 5 EFBEMO CCN(C(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598039844 478627303 /nfs/dbraw/zinc/62/73/03/478627303.db2.gz APWJSHRHIYJSAM-CQSZACIVSA-N 1 1 331.372 2.897 10 5 EFBEMO C[C@H]1CC[N@@H+](CC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000582556046 478628944 /nfs/dbraw/zinc/62/89/44/478628944.db2.gz KJADJFQHBJTWQY-HOCLYGCPSA-N 1 1 331.416 2.643 10 5 EFBEMO C[C@@H]1CCCC[N@H+]1CCNc1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601104755 478658587 /nfs/dbraw/zinc/65/85/87/478658587.db2.gz FZZUHYHZWRIZKX-SECBINFHSA-N 1 1 335.330 2.633 10 5 EFBEMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1c2c(nn1C)CCCC2 ZINC000601106449 478660167 /nfs/dbraw/zinc/66/01/67/478660167.db2.gz XNUTXVPTAXUYRA-UHFFFAOYSA-N 1 1 330.388 2.506 10 5 EFBEMO CC[N@H+]1CCCC[C@H]1CNc1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601115730 478664866 /nfs/dbraw/zinc/66/48/66/478664866.db2.gz JMDJDKXEVCWZRX-VIFPVBQESA-N 1 1 335.330 2.633 10 5 EFBEMO CC[N@H+]1CC[C@@H](N(C)c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C[C@@H]1C ZINC000601122406 478670312 /nfs/dbraw/zinc/67/03/12/478670312.db2.gz VVRPUFPAKDMPRD-VHSXEESVSA-N 1 1 349.357 2.656 10 5 EFBEMO COc1cc(F)cc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c1 ZINC000601150524 478691942 /nfs/dbraw/zinc/69/19/42/478691942.db2.gz YTOWQQKAZMQGKV-KRWDZBQOSA-N 1 1 334.347 2.740 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1 ZINC000601171955 478704262 /nfs/dbraw/zinc/70/42/62/478704262.db2.gz SWVBKKQHUPCFSM-LKFCYVNXSA-N 1 1 341.289 2.893 10 5 EFBEMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(c2ncc(F)cc2[N+](=O)[O-])C1 ZINC000601194211 478717666 /nfs/dbraw/zinc/71/76/66/478717666.db2.gz GHCRAUDUIXECQT-INIZCTEOSA-N 1 1 344.390 2.882 10 5 EFBEMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@H]4CC[C@@H](C3)[S@@]4=O)c2c1 ZINC000601202753 478721658 /nfs/dbraw/zinc/72/16/58/478721658.db2.gz HKOSUBQOFVTHEY-HEWAKGLMSA-N 1 1 331.397 2.633 10 5 EFBEMO C[C@H]1C[C@@H](NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)CC[N@H+]1C ZINC000601233245 478738638 /nfs/dbraw/zinc/73/86/38/478738638.db2.gz ZTGLTOWXSOGZMY-ZFWWWQNUSA-N 1 1 331.416 2.615 10 5 EFBEMO COC(=O)c1cc(N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)cc(C)c1[N+](=O)[O-] ZINC000564567609 478762184 /nfs/dbraw/zinc/76/21/84/478762184.db2.gz LRZDZZQWKNATGU-AAEUAGOBSA-N 1 1 333.388 2.727 10 5 EFBEMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601311114 478779178 /nfs/dbraw/zinc/77/91/78/478779178.db2.gz YKGRKMHEYVJBJM-DYVFJYSZSA-N 1 1 343.427 2.615 10 5 EFBEMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601400334 478820533 /nfs/dbraw/zinc/82/05/33/478820533.db2.gz YLPGDCCGLWCKOY-UONOGXRCSA-N 1 1 331.416 2.568 10 5 EFBEMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601400334 478820537 /nfs/dbraw/zinc/82/05/37/478820537.db2.gz YLPGDCCGLWCKOY-UONOGXRCSA-N 1 1 331.416 2.568 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCC[C@H]1C1CCC1 ZINC000592200469 478822595 /nfs/dbraw/zinc/82/25/95/478822595.db2.gz YZESVNCEVMKTJF-CVEARBPZSA-N 1 1 334.416 2.989 10 5 EFBEMO Cc1noc(C[N@H+]2CCC[C@@H](O)[C@H]2CCc2ccccc2)c1[N+](=O)[O-] ZINC000595556756 478852443 /nfs/dbraw/zinc/85/24/43/478852443.db2.gz FTWBWUDLNNOANX-HZPDHXFCSA-N 1 1 345.399 2.849 10 5 EFBEMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601588194 478893876 /nfs/dbraw/zinc/89/38/76/478893876.db2.gz UWRNVMZASVPIAN-AWEZNQCLSA-N 1 1 333.432 2.861 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@](C)(C2CC2)C1 ZINC000595625443 478896559 /nfs/dbraw/zinc/89/65/59/478896559.db2.gz MTVRECJAZWHXGP-GOSISDBHSA-N 1 1 347.415 2.733 10 5 EFBEMO Cc1sc(C(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000598562090 478896984 /nfs/dbraw/zinc/89/69/84/478896984.db2.gz SYNIEJANKGNNMZ-ZDUSSCGKSA-N 1 1 337.445 2.817 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2[C@@H]2CCCOC2)c1 ZINC000592516979 478925572 /nfs/dbraw/zinc/92/55/72/478925572.db2.gz MNZOQSKAFDDWSZ-GDBMZVCRSA-N 1 1 348.399 2.772 10 5 EFBEMO Cc1c(NC(=O)CC[N@@H+]2CC3(CCC3)OC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000595683614 478934516 /nfs/dbraw/zinc/93/45/16/478934516.db2.gz WTONESULEADHPH-ZDUSSCGKSA-N 1 1 347.415 2.875 10 5 EFBEMO C[N@H+]1CCCC[C@H](CNC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000601685368 478952206 /nfs/dbraw/zinc/95/22/06/478952206.db2.gz ZFOZROCONJGOCF-OAHLLOKOSA-N 1 1 345.443 2.865 10 5 EFBEMO C[C@]12COC[C@@H]1C[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000595759457 478980301 /nfs/dbraw/zinc/98/03/01/478980301.db2.gz QIHPJPOWUHOZOA-FZMZJTMJSA-N 1 1 341.205 2.826 10 5 EFBEMO C[C@]12COC[C@@H]1C[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000595759457 478980308 /nfs/dbraw/zinc/98/03/08/478980308.db2.gz QIHPJPOWUHOZOA-FZMZJTMJSA-N 1 1 341.205 2.826 10 5 EFBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@H]2COC[C@@]2(C)C1 ZINC000595761481 478982071 /nfs/dbraw/zinc/98/20/71/478982071.db2.gz XABNGNACGREXBQ-BTJLNZGRSA-N 1 1 344.371 2.674 10 5 EFBEMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3ccon3)CC2)c2c(c1)COCO2 ZINC000595837049 479026386 /nfs/dbraw/zinc/02/63/86/479026386.db2.gz OFNQKQUFZOROCW-UHFFFAOYSA-N 1 1 345.355 2.829 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000592763508 479031490 /nfs/dbraw/zinc/03/14/90/479031490.db2.gz SSQHVJLYVXBIFF-ZDUSSCGKSA-N 1 1 346.387 2.500 10 5 EFBEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000592767093 479032963 /nfs/dbraw/zinc/03/29/63/479032963.db2.gz NUBPBAGSFUEJOT-ZDUSSCGKSA-N 1 1 330.388 2.664 10 5 EFBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000592785224 479043712 /nfs/dbraw/zinc/04/37/12/479043712.db2.gz JLXHWJSTMGOOOJ-LLVKDONJSA-N 1 1 332.360 2.952 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)[C@H](C)[C@H]1C ZINC000584180089 479045165 /nfs/dbraw/zinc/04/51/65/479045165.db2.gz QUYQBMTYYOITST-GHMZBOCLSA-N 1 1 325.796 2.721 10 5 EFBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C)[C@H](C)[C@H]1C ZINC000584180089 479045171 /nfs/dbraw/zinc/04/51/71/479045171.db2.gz QUYQBMTYYOITST-GHMZBOCLSA-N 1 1 325.796 2.721 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl ZINC000596049276 479106930 /nfs/dbraw/zinc/10/69/30/479106930.db2.gz IIZGTQUCCHIQIH-SNVBAGLBSA-N 1 1 341.795 2.931 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](CCO)c2ccccc2)c1 ZINC000593019753 479128315 /nfs/dbraw/zinc/12/83/15/479128315.db2.gz JYSPOOZTVHIXEV-MRXNPFEDSA-N 1 1 344.367 2.595 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2cnccc2C)c1 ZINC000593023019 479130331 /nfs/dbraw/zinc/13/03/31/479130331.db2.gz NNVHETOBHQUZHB-GFCCVEGCSA-N 1 1 329.356 2.936 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@@H]2C[C@@H](C)O)c1 ZINC000593028408 479132000 /nfs/dbraw/zinc/13/20/00/479132000.db2.gz FMDRKQYBPTZBHM-IUODEOHRSA-N 1 1 336.388 2.507 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@@H]2C[C@H](C)O)c1 ZINC000593028409 479132074 /nfs/dbraw/zinc/13/20/74/479132074.db2.gz FMDRKQYBPTZBHM-SWLSCSKDSA-N 1 1 336.388 2.507 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCCC[C@H]2CCO)c1 ZINC000593030915 479133396 /nfs/dbraw/zinc/13/33/96/479133396.db2.gz QEVNKMIOEPYILR-HNNXBMFYSA-N 1 1 336.388 2.508 10 5 EFBEMO COCC[N@H+]1CCC[C@H]1CNc1ccc2cnccc2c1[N+](=O)[O-] ZINC000599040572 479135345 /nfs/dbraw/zinc/13/53/45/479135345.db2.gz KEKZSSQNKSJIRD-AWEZNQCLSA-N 1 1 330.388 2.666 10 5 EFBEMO COc1cc(NCc2c[nH+]c(N(C)C)n2C)c(Cl)cc1[N+](=O)[O-] ZINC000596126002 479153341 /nfs/dbraw/zinc/15/33/41/479153341.db2.gz GUIJVFRWFYTNJO-UHFFFAOYSA-N 1 1 339.783 2.668 10 5 EFBEMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H]1CCCOC1 ZINC000593068772 479156292 /nfs/dbraw/zinc/15/62/92/479156292.db2.gz OXDFDMXOLBGZOG-OAHLLOKOSA-N 1 1 335.404 2.733 10 5 EFBEMO COc1cc(NC[C@H](C)C[NH+]2CCOCC2)c(Cl)cc1[N+](=O)[O-] ZINC000596135071 479157495 /nfs/dbraw/zinc/15/74/95/479157495.db2.gz QINMFVIQWJLYGE-NSHDSACASA-N 1 1 343.811 2.637 10 5 EFBEMO COc1ccc(OCC[N@@H+]2C[C@@H](C)OCC23CCC3)c([N+](=O)[O-])c1 ZINC000593093494 479172004 /nfs/dbraw/zinc/17/20/04/479172004.db2.gz UHSLJOOEJPGEKQ-CYBMUJFWSA-N 1 1 336.388 2.626 10 5 EFBEMO COc1ccc(OCC[N@H+]2C[C@@H](C)OCC23CCC3)c([N+](=O)[O-])c1 ZINC000593093494 479172013 /nfs/dbraw/zinc/17/20/13/479172013.db2.gz UHSLJOOEJPGEKQ-CYBMUJFWSA-N 1 1 336.388 2.626 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@H]2CNc2ncc([N+](=O)[O-])cc2F)cc1 ZINC000599139937 479177515 /nfs/dbraw/zinc/17/75/15/479177515.db2.gz PITABBMLZSMJMJ-ZDUSSCGKSA-N 1 1 346.362 2.824 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@H]2CNc2ncc([N+](=O)[O-])cc2F)cc1 ZINC000599139937 479177517 /nfs/dbraw/zinc/17/75/17/479177517.db2.gz PITABBMLZSMJMJ-ZDUSSCGKSA-N 1 1 346.362 2.824 10 5 EFBEMO COc1ccc(C[N@@H+]2CC[C@H]2CNc2cccnc2[N+](=O)[O-])cc1 ZINC000599139332 479177831 /nfs/dbraw/zinc/17/78/31/479177831.db2.gz KICCOYDUEZYDSA-AWEZNQCLSA-N 1 1 328.372 2.685 10 5 EFBEMO COc1ccc(C[N@H+]2CC[C@H]2CNc2cccnc2[N+](=O)[O-])cc1 ZINC000599139332 479177839 /nfs/dbraw/zinc/17/78/39/479177839.db2.gz KICCOYDUEZYDSA-AWEZNQCLSA-N 1 1 328.372 2.685 10 5 EFBEMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593115215 479182240 /nfs/dbraw/zinc/18/22/40/479182240.db2.gz AMUDVZIJJFZSLB-IINYFYTJSA-N 1 1 325.315 2.653 10 5 EFBEMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593115215 479182247 /nfs/dbraw/zinc/18/22/47/479182247.db2.gz AMUDVZIJJFZSLB-IINYFYTJSA-N 1 1 325.315 2.653 10 5 EFBEMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@@H]1c1ccccc1 ZINC000596179229 479182609 /nfs/dbraw/zinc/18/26/09/479182609.db2.gz OPOISLJWYVPQCP-RDJZCZTQSA-N 1 1 340.383 2.551 10 5 EFBEMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@@H]1c1ccccc1 ZINC000596179231 479182929 /nfs/dbraw/zinc/18/29/29/479182929.db2.gz OPOISLJWYVPQCP-WBVHZDCISA-N 1 1 340.383 2.551 10 5 EFBEMO O=C(CC[N@H+]1CC[C@@]2(CC2(F)F)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000593116293 479184457 /nfs/dbraw/zinc/18/44/57/479184457.db2.gz HFYQZBXFACGHTG-CQSZACIVSA-N 1 1 325.315 2.655 10 5 EFBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000593118909 479187251 /nfs/dbraw/zinc/18/72/51/479187251.db2.gz SXHXRUPHYQCHQZ-OAHLLOKOSA-N 1 1 339.342 2.963 10 5 EFBEMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000599207378 479210169 /nfs/dbraw/zinc/21/01/69/479210169.db2.gz ULOTWUXZTFNZDV-MRXNPFEDSA-N 1 1 346.431 2.753 10 5 EFBEMO COc1ccc(NC(=O)NCCC[N@@H+](C)CC(C)C)cc1[N+](=O)[O-] ZINC000593178147 479222363 /nfs/dbraw/zinc/22/23/63/479222363.db2.gz RFWJUDDDPXOMCJ-UHFFFAOYSA-N 1 1 338.408 2.703 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000593203246 479238212 /nfs/dbraw/zinc/23/82/12/479238212.db2.gz IYELOPHPWVFXTB-UHFFFAOYSA-N 1 1 344.415 2.851 10 5 EFBEMO CCNc1ccc(C(=O)NCCC[N@@H+](C)CC(C)C)cc1[N+](=O)[O-] ZINC000593204761 479239465 /nfs/dbraw/zinc/23/94/65/479239465.db2.gz LRCCUOCHFHUZCL-UHFFFAOYSA-N 1 1 336.436 2.734 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000596307333 479246725 /nfs/dbraw/zinc/24/67/25/479246725.db2.gz KRCTUADLOPCTKS-CQSZACIVSA-N 1 1 346.431 2.772 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000596307346 479247036 /nfs/dbraw/zinc/24/70/36/479247036.db2.gz KVKDYFCXJUKKEK-SNVBAGLBSA-N 1 1 331.376 2.528 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@H+](C(C)(C)C)C2)c1 ZINC000596307360 479248508 /nfs/dbraw/zinc/24/85/08/479248508.db2.gz LGALREDHUZKYDA-GFCCVEGCSA-N 1 1 335.404 2.914 10 5 EFBEMO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000596362923 479265638 /nfs/dbraw/zinc/26/56/38/479265638.db2.gz FLEZMBSTJWTQSZ-AWEZNQCLSA-N 1 1 345.447 2.827 10 5 EFBEMO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000596362923 479265645 /nfs/dbraw/zinc/26/56/45/479265645.db2.gz FLEZMBSTJWTQSZ-AWEZNQCLSA-N 1 1 345.447 2.827 10 5 EFBEMO O=[N+]([O-])c1ccc(NCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000596422580 479288599 /nfs/dbraw/zinc/28/85/99/479288599.db2.gz FRDROQBTTYLXAW-GOSISDBHSA-N 1 1 327.384 2.774 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000593314030 479288893 /nfs/dbraw/zinc/28/88/93/479288893.db2.gz FFKRKGVRHXBWBK-CQSZACIVSA-N 1 1 336.436 2.933 10 5 EFBEMO O=[N+]([O-])c1ccc(NCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c(F)c1 ZINC000596424607 479289217 /nfs/dbraw/zinc/28/92/17/479289217.db2.gz UAQRPXRAMKIVGC-MRXNPFEDSA-N 1 1 345.374 2.913 10 5 EFBEMO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCCN2Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000593324043 479296544 /nfs/dbraw/zinc/29/65/44/479296544.db2.gz XLRMKDUJDAJVHI-COXVUDFISA-N 1 1 337.395 2.595 10 5 EFBEMO COc1cncc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000599433894 479296765 /nfs/dbraw/zinc/29/67/65/479296765.db2.gz MDQLLNHCDCPHES-CQSZACIVSA-N 1 1 328.372 2.773 10 5 EFBEMO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCCN2Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000593324045 479296882 /nfs/dbraw/zinc/29/68/82/479296882.db2.gz XLRMKDUJDAJVHI-KBRIMQKVSA-N 1 1 337.395 2.595 10 5 EFBEMO O=[N+]([O-])c1ccc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c(F)c1 ZINC000596515122 479323971 /nfs/dbraw/zinc/32/39/71/479323971.db2.gz SGXNEFHERYINPP-HZPDHXFCSA-N 1 1 335.379 2.789 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000596515146 479324050 /nfs/dbraw/zinc/32/40/50/479324050.db2.gz WSJVCUCFAJJLDG-IAGOWNOFSA-N 1 1 331.416 2.959 10 5 EFBEMO Cc1c(C[N@@H+]2CCOC[C@@H]2[C@@H]2CCCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000585800615 479331511 /nfs/dbraw/zinc/33/15/11/479331511.db2.gz BSVQNUUVBGPCNA-JQHSSLGASA-N 1 1 334.416 2.655 10 5 EFBEMO Cc1c(C[N@H+]2CCOC[C@@H]2[C@@H]2CCCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000585800615 479331515 /nfs/dbraw/zinc/33/15/15/479331515.db2.gz BSVQNUUVBGPCNA-JQHSSLGASA-N 1 1 334.416 2.655 10 5 EFBEMO CC(C)C[N@@H+](C)CCCNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000593422171 479334341 /nfs/dbraw/zinc/33/43/41/479334341.db2.gz DSQMQZYONXSRBJ-UHFFFAOYSA-N 1 1 336.436 2.714 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2ccc(CN3C[C@H]4C[NH2+]C[C@@H]4C3)s2)cc1 ZINC000611287776 479338379 /nfs/dbraw/zinc/33/83/79/479338379.db2.gz HVPALQFOABZODK-ZIAGYGMSSA-N 1 1 329.425 2.975 10 5 EFBEMO CCN(C(=O)NCc1cccc([N+](=O)[O-])c1C)[C@H]1CC[N@@H+](CC)C1 ZINC000596580351 479346792 /nfs/dbraw/zinc/34/67/92/479346792.db2.gz WEFJKNPLOKLFQO-HNNXBMFYSA-N 1 1 334.420 2.529 10 5 EFBEMO CCN1CC[NH+]([C@@H](C)CNc2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593455954 479348182 /nfs/dbraw/zinc/34/81/82/479348182.db2.gz WDQPKVOQTPYHGM-AWEZNQCLSA-N 1 1 343.431 2.581 10 5 EFBEMO O=[N+]([O-])c1ccc2c(c1)nccc2N1CC[NH+](Cc2ccccn2)CC1 ZINC000593454721 479348408 /nfs/dbraw/zinc/34/84/08/479348408.db2.gz KRUUFVYBMHEODD-UHFFFAOYSA-N 1 1 349.394 2.860 10 5 EFBEMO C[C@H]([C@H](C)Nc1ccnc2cc([N+](=O)[O-])ccc21)[NH+]1CCOCC1 ZINC000593461960 479351944 /nfs/dbraw/zinc/35/19/44/479351944.db2.gz WMSCRHHYDLFLBO-QWHCGFSZSA-N 1 1 330.388 2.664 10 5 EFBEMO C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000599625901 479358418 /nfs/dbraw/zinc/35/84/18/479358418.db2.gz QTQDDZPJXZANQX-RSQPEXBXSA-N 1 1 332.360 2.546 10 5 EFBEMO C[C@H]1O[C@@H](C)[C@H](C)[C@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000599625900 479358634 /nfs/dbraw/zinc/35/86/34/479358634.db2.gz QTQDDZPJXZANQX-KIGUWFBYSA-N 1 1 332.360 2.546 10 5 EFBEMO C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000599627222 479359815 /nfs/dbraw/zinc/35/98/15/479359815.db2.gz VAFVFHXLXPOFEX-RSQPEXBXSA-N 1 1 332.360 2.546 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)[C@H]2CCC[C@H]21 ZINC000599649881 479367874 /nfs/dbraw/zinc/36/78/74/479367874.db2.gz DTFMGYZQOPOKTF-XHSDSOJGSA-N 1 1 348.399 2.767 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)[C@H]2CCC[C@H]21 ZINC000599649881 479367880 /nfs/dbraw/zinc/36/78/80/479367880.db2.gz DTFMGYZQOPOKTF-XHSDSOJGSA-N 1 1 348.399 2.767 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@H]2CCC[C@@H]21 ZINC000599648860 479368738 /nfs/dbraw/zinc/36/87/38/479368738.db2.gz BIBCMVRUHLQTNG-JMSVASOKSA-N 1 1 336.363 2.898 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@H]2CCC[C@@H]21 ZINC000599648860 479368741 /nfs/dbraw/zinc/36/87/41/479368741.db2.gz BIBCMVRUHLQTNG-JMSVASOKSA-N 1 1 336.363 2.898 10 5 EFBEMO COC(=O)[C@@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000599648866 479368943 /nfs/dbraw/zinc/36/89/43/479368943.db2.gz BIBCMVRUHLQTNG-ZOWXZIJZSA-N 1 1 336.363 2.898 10 5 EFBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000599648866 479368947 /nfs/dbraw/zinc/36/89/47/479368947.db2.gz BIBCMVRUHLQTNG-ZOWXZIJZSA-N 1 1 336.363 2.898 10 5 EFBEMO C[C@H](C[N@@H+](C)Cc1ccccc1)Nc1cc(N)c([N+](=O)[O-])c(CO)c1 ZINC000588012602 479384261 /nfs/dbraw/zinc/38/42/61/479384261.db2.gz JANOXCBMNFCJOO-CYBMUJFWSA-N 1 1 344.415 2.602 10 5 EFBEMO COc1ccc(NC(=O)CC[N@H+]2CC[C@H](C)[C@H](F)C2)c([N+](=O)[O-])c1 ZINC000611501904 479397530 /nfs/dbraw/zinc/39/75/30/479397530.db2.gz KJKWSRVIVARUIF-WCQYABFASA-N 1 1 339.367 2.612 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000603833350 479433559 /nfs/dbraw/zinc/43/35/59/479433559.db2.gz HKYHUGNDQLMXAG-CQSZACIVSA-N 1 1 328.372 2.643 10 5 EFBEMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H](c2ccncn2)C1 ZINC000603833349 479433792 /nfs/dbraw/zinc/43/37/92/479433792.db2.gz HKYHUGNDQLMXAG-AWEZNQCLSA-N 1 1 328.372 2.643 10 5 EFBEMO CC[C@@H](C)[N@@H+](C)CCNC(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599830652 479443021 /nfs/dbraw/zinc/44/30/21/479443021.db2.gz WFBSMGJOTDPSCL-GFCCVEGCSA-N 1 1 345.403 2.995 10 5 EFBEMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599833738 479444977 /nfs/dbraw/zinc/44/49/77/479444977.db2.gz XVRLOPIZQQZOEY-RYUDHWBXSA-N 1 1 343.387 2.699 10 5 EFBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1CC[N@H+]1C(C)(C)C ZINC000596843866 479452872 /nfs/dbraw/zinc/45/28/72/479452872.db2.gz LJISHIZQKPMXCU-GFCCVEGCSA-N 1 1 336.392 2.598 10 5 EFBEMO C[C@H]1CC[N@@H+](CCNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000575745029 479466800 /nfs/dbraw/zinc/46/68/00/479466800.db2.gz NFASBYVDJDEFGL-AWEZNQCLSA-N 1 1 349.434 2.753 10 5 EFBEMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCCCO)CC2)c(Cl)c1 ZINC000611788256 479481043 /nfs/dbraw/zinc/48/10/43/479481043.db2.gz UAKDBJHCRIZBEC-UHFFFAOYSA-N 1 1 328.796 2.612 10 5 EFBEMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000604481846 479525724 /nfs/dbraw/zinc/52/57/24/479525724.db2.gz LNSGDPXBWTWQBS-CQSZACIVSA-N 1 1 329.356 2.651 10 5 EFBEMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000604481846 479525732 /nfs/dbraw/zinc/52/57/32/479525732.db2.gz LNSGDPXBWTWQBS-CQSZACIVSA-N 1 1 329.356 2.651 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](OCC(C)C)C2)c1 ZINC000589505316 479534923 /nfs/dbraw/zinc/53/49/23/479534923.db2.gz FLOYPBZZJVBGRS-OAHLLOKOSA-N 1 1 336.388 2.628 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](OCC(C)C)C2)c1 ZINC000589505316 479534929 /nfs/dbraw/zinc/53/49/29/479534929.db2.gz FLOYPBZZJVBGRS-OAHLLOKOSA-N 1 1 336.388 2.628 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000589506110 479535167 /nfs/dbraw/zinc/53/51/67/479535167.db2.gz VTEOPNJSRJSOEJ-CABCVRRESA-N 1 1 348.399 2.630 10 5 EFBEMO 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CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)s2)[C@H](C)C1 ZINC000076484893 521712685 /nfs/dbraw/zinc/71/26/85/521712685.db2.gz XVBCXFBVPKDCOD-ZYHUDNBSSA-N 1 1 325.434 2.767 10 5 EFBEMO COC(=O)C[C@@](C)([NH2+]Cc1ccc([N+](=O)[O-])cc1C)c1ccncc1 ZINC000191906196 523312142 /nfs/dbraw/zinc/31/21/42/523312142.db2.gz WTCOGCYIHAECDC-GOSISDBHSA-N 1 1 343.383 2.866 10 5 EFBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000245935712 523483858 /nfs/dbraw/zinc/48/38/58/523483858.db2.gz KVQHICAIYHALSV-CVEARBPZSA-N 1 1 331.416 2.531 10 5 EFBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1C[C@@H]2CCC[N@@H+]2C[C@H]1C ZINC000246102718 524334978 /nfs/dbraw/zinc/33/49/78/524334978.db2.gz JIVZOBBLRKUKOZ-HIFRSBDPSA-N 1 1 331.416 2.829 10 5 EFBEMO Cc1nccn1C[C@@H]1CCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000178291207 534779397 /nfs/dbraw/zinc/77/93/97/534779397.db2.gz KVPRLUFDAXLQMO-INIZCTEOSA-N 1 1 330.388 2.643 10 5 EFBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C(C)C)C1CCOCC1 ZINC000077323049 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Cc1nc(C[C@H]2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)no1 ZINC000195518233 526923383 /nfs/dbraw/zinc/92/33/83/526923383.db2.gz PIOTWPALZABBLS-OAHLLOKOSA-N 1 1 330.388 2.783 10 5 EFBEMO O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[N@H+](C2CC2)CC1 ZINC000143868969 527262435 /nfs/dbraw/zinc/26/24/35/527262435.db2.gz WGWWHOVDWWTLFU-UHFFFAOYSA-N 1 1 338.795 2.950 10 5 EFBEMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(c4cc[nH]n4)CC3)nc2c1 ZINC000177034168 527381456 /nfs/dbraw/zinc/38/14/56/527381456.db2.gz JYPDURMINCUSTH-UHFFFAOYSA-N 1 1 327.344 2.839 10 5 EFBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@H]1c1ccco1 ZINC000181889251 527404774 /nfs/dbraw/zinc/40/47/74/527404774.db2.gz PPXIOGPRNIJVAO-UONOGXRCSA-N 1 1 332.356 2.765 10 5 EFBEMO CC[N@@H+](CCc1nccs1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000159388512 528607975 /nfs/dbraw/zinc/60/79/75/528607975.db2.gz YKEBTAHQDJSVSC-UHFFFAOYSA-N 1 1 349.412 2.982 10 5 EFBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000174533046 529066151 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335.404 2.547 10 5 EFBEMO CC(C)Oc1cc(C(=O)N2[C@H](C)C[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000412216489 534946667 /nfs/dbraw/zinc/94/66/67/534946667.db2.gz ODSKDFXRVMLEAX-BETUJISGSA-N 1 1 335.404 2.547 10 5 EFBEMO CC(C)[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C[C@@H](C)O ZINC000425405105 535089066 /nfs/dbraw/zinc/08/90/66/535089066.db2.gz MZZYQLJFRUOSGH-SNVBAGLBSA-N 1 1 331.210 2.949 10 5 EFBEMO CC[C@@H]1C[C@H](C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)CCO1 ZINC000357000594 535898182 /nfs/dbraw/zinc/89/81/82/535898182.db2.gz WTCQAXHDOUIIGA-IIAWOOMASA-N 1 1 334.420 2.681 10 5 EFBEMO COc1ccc(NC(=O)CC[N@H+]2CCCC23CCC3)c([N+](=O)[O-])c1 ZINC000411647095 536759056 /nfs/dbraw/zinc/75/90/56/536759056.db2.gz QSEWHBKGIQXILU-UHFFFAOYSA-N 1 1 333.388 2.951 10 5 EFBEMO COc1ccc(NC(=O)C[N@H+]2C[C@H](C)C[C@H](C)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000355791708 536770032 /nfs/dbraw/zinc/77/00/32/536770032.db2.gz XOUNYSRWFMPUQR-AGIUHOORSA-N 1 1 335.404 2.908 10 5 EFBEMO 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ZINC000774294698 581489044 /nfs/dbraw/zinc/48/90/44/581489044.db2.gz AKYWCNUCEKRTDP-OAHLLOKOSA-N 1 1 336.388 2.700 10 5 EFBEMO CC[N@H+](CCNC(=O)Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC001691026114 1247990875 /nfs/dbraw/zinc/99/08/75/1247990875.db2.gz RVAUUGAJOBBCPQ-UHFFFAOYSA-N 1 1 341.411 2.776 10 5 EFBEMO CC[N@@H+](CCNC(=O)Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC001691026114 1247990881 /nfs/dbraw/zinc/99/08/81/1247990881.db2.gz RVAUUGAJOBBCPQ-UHFFFAOYSA-N 1 1 341.411 2.776 10 5 EFBEMO CC[N@@H+](CCNC(=O)C1(C)CC=CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001691038998 1248036656 /nfs/dbraw/zinc/03/66/56/1248036656.db2.gz UHOVVHOIEKALSD-UHFFFAOYSA-N 1 1 331.416 2.889 10 5 EFBEMO CC[N@@H+](CCNC(=O)C1(CF)CCC1)Cc1cccc([N+](=O)[O-])c1 ZINC001691040855 1248038772 /nfs/dbraw/zinc/03/87/72/1248038772.db2.gz UNMXEXYRLYBNOP-UHFFFAOYSA-N 1 1 337.395 2.673 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1nccs1)Cc1ccc([N+](=O)[O-])cc1 ZINC001691193766 1248522730 /nfs/dbraw/zinc/52/27/30/1248522730.db2.gz FESNLTBGWYAKLX-UHFFFAOYSA-N 1 1 348.428 2.693 10 5 EFBEMO O=[N+]([O-])c1cccc(Br)c1C[NH2+][C@H]1C[C@@H](O)C12CCC2 ZINC000850388130 1250460438 /nfs/dbraw/zinc/46/04/38/1250460438.db2.gz IGBTXWAYFYLZTA-QWHCGFSZSA-N 1 1 341.205 2.750 10 5 EFBEMO CCOP(=O)(OCC)[C@H](O)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000851715491 1251218028 /nfs/dbraw/zinc/21/80/28/1251218028.db2.gz WJYXBQIWZXBTGE-AWEZNQCLSA-N 1 1 346.320 2.611 10 5 EFBEMO CC/C(C)=C\C(=O)N1C[C@@H]2C[N@@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001484406480 1252534909 /nfs/dbraw/zinc/53/49/09/1252534909.db2.gz QEIYNXLQKAIRFH-GPYPFEAASA-N 1 1 349.456 2.903 10 5 EFBEMO CC/C(C)=C\C(=O)N1C[C@@H]2C[N@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001484406480 1252534913 /nfs/dbraw/zinc/53/49/13/1252534913.db2.gz QEIYNXLQKAIRFH-GPYPFEAASA-N 1 1 349.456 2.903 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1ccco1 ZINC001484762629 1252892060 /nfs/dbraw/zinc/89/20/60/1252892060.db2.gz JMKMRFDHFNABRC-UHFFFAOYSA-N 1 1 345.399 2.711 10 5 EFBEMO C[C@@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc(NC(=O)C2CC2)cc1 ZINC001168581265 1258036218 /nfs/dbraw/zinc/03/62/18/1258036218.db2.gz SZXSULRHUKWWSD-LLVKDONJSA-N 1 1 343.387 2.528 10 5 EFBEMO C[C@@H]1[C@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[N@H+]1C ZINC000922557330 1266253836 /nfs/dbraw/zinc/25/38/36/1266253836.db2.gz OEHUDWNIUGSRKS-IAQYHMDHSA-N 1 1 332.429 2.901 10 5 EFBEMO C[C@@H]1[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCN1C ZINC000922557330 1266253841 /nfs/dbraw/zinc/25/38/41/1266253841.db2.gz OEHUDWNIUGSRKS-IAQYHMDHSA-N 1 1 332.429 2.901 10 5 EFBEMO C[C@](CO)([NH2+]Cc1cccc2c1OCC2)c1cccc([N+](=O)[O-])c1 ZINC000922305334 1265406608 /nfs/dbraw/zinc/40/66/08/1265406608.db2.gz FQIFKWVYCOESDL-GOSISDBHSA-N 1 1 328.368 2.527 10 5 EFBEMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000734552740 1267015462 /nfs/dbraw/zinc/01/54/62/1267015462.db2.gz NJFRSHLFPXEMOI-LLVKDONJSA-N 1 1 325.796 2.662 10 5 EFBEMO COC(=O)/C=C\c1ccc(NC[C@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000742571990 1270115806 /nfs/dbraw/zinc/11/58/06/1270115806.db2.gz JWCOMNCXLJYGDF-ZQMJAJRESA-N 1 1 347.415 2.923 10 5 EFBEMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CCCOC1 ZINC000844403608 1278953684 /nfs/dbraw/zinc/95/36/84/1278953684.db2.gz HOXSVIXTXJFKNC-ZDUSSCGKSA-N 1 1 339.367 2.563 10 5 EFBEMO Cc1nc(F)ccc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000787179645 1275707499 /nfs/dbraw/zinc/70/74/99/1275707499.db2.gz ZRNSGFRDXIWNTO-CYBMUJFWSA-N 1 1 331.351 2.519 10 5 EFBEMO Cc1nc(F)ccc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000787179645 1275707504 /nfs/dbraw/zinc/70/75/04/1275707504.db2.gz ZRNSGFRDXIWNTO-CYBMUJFWSA-N 1 1 331.351 2.519 10 5 EFBEMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CC[C@@]4(C3)CCCOC4)c2)cc1 ZINC000789538965 1276793969 /nfs/dbraw/zinc/79/39/69/1276793969.db2.gz CUXUWGNLWMMTCM-GOSISDBHSA-N 1 1 342.399 2.918 10 5 EFBEMO C/C(=C/C(=O)N1CCC[C@H]2C[N@H+](C)C[C@H]21)c1ccc([N+](=O)[O-])cc1 ZINC000819718881 1276892895 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KTPHJDPJOQGZGC-GXTWGEPZSA-N 1 1 341.770 2.507 10 5 EFBEMO Cc1cc([N+](=O)[O-])cc(C(=O)NCCC[N@H+](C)CC(C)C)c1F ZINC000844655327 1279140011 /nfs/dbraw/zinc/14/00/11/1279140011.db2.gz VJBUFLLAHUVXIO-UHFFFAOYSA-N 1 1 325.384 2.750 10 5 EFBEMO Cc1nn(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)c2ncc([N+](=O)[O-])cc12 ZINC000844750237 1279218902 /nfs/dbraw/zinc/21/89/02/1279218902.db2.gz IYJJGFKITFHJNR-CQSZACIVSA-N 1 1 337.330 2.727 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)c2ncc([N+](=O)[O-])cc12 ZINC000844750237 1279218911 /nfs/dbraw/zinc/21/89/11/1279218911.db2.gz IYJJGFKITFHJNR-CQSZACIVSA-N 1 1 337.330 2.727 10 5 EFBEMO COCC[N@@H+]1[C@H](C)CN(c2ccnc3cc([N+](=O)[O-])ccc32)C[C@@H]1C ZINC000845579517 1279726992 /nfs/dbraw/zinc/72/69/92/1279726992.db2.gz UJPRPIXTIIQFQT-OKILXGFUSA-N 1 1 344.415 2.688 10 5 EFBEMO C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001175301180 1287370639 /nfs/dbraw/zinc/37/06/39/1287370639.db2.gz OAHLIGBHKFXACP-ZVXAKGHKSA-N 1 1 332.360 2.546 10 5 EFBEMO CC(C)C[N@H+]1CCO[C@@H](CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872017815 1287400473 /nfs/dbraw/zinc/40/04/73/1287400473.db2.gz FHYSWOTYYNFRBZ-KBPBESRZSA-N 1 1 339.411 2.741 10 5 EFBEMO C[C@](CO)([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001175323074 1287401122 /nfs/dbraw/zinc/40/11/22/1287401122.db2.gz HIAYGQQSRLBLBA-MRXNPFEDSA-N 1 1 331.328 2.500 10 5 EFBEMO C[C@@H]([NH2+]CC1(CS(C)(=O)=O)CCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872079798 1287422599 /nfs/dbraw/zinc/42/25/99/1287422599.db2.gz KLUGNUKYYUJIAV-LLVKDONJSA-N 1 1 344.408 2.599 10 5 EFBEMO C[C@H]([NH2+]CC[S@@](=O)CC(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872085878 1287424472 /nfs/dbraw/zinc/42/44/72/1287424472.db2.gz RNSRSYPCMFDDOO-QSIZCVBASA-N 1 1 342.314 2.696 10 5 EFBEMO Cc1ccnc([C@H]2CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000846969234 1280669990 /nfs/dbraw/zinc/66/99/90/1280669990.db2.gz MRXUXAVYCQWITG-YJBOKZPZSA-N 1 1 327.384 2.821 10 5 EFBEMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)/C=C(\C)c1ccc([N+](=O)[O-])cc1 ZINC000846988512 1280675529 /nfs/dbraw/zinc/67/55/29/1280675529.db2.gz MHVQWFVVXVZMKD-GRNBYLDVSA-N 1 1 331.416 2.941 10 5 EFBEMO CC[N@H+]1C[C@H](C)N(C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC001137931383 1280979351 /nfs/dbraw/zinc/97/93/51/1280979351.db2.gz PBWHLCOIMJWNJL-RYUDHWBXSA-N 1 1 339.823 2.732 10 5 EFBEMO O=C(C[N@@H+]1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000872281528 1287520495 /nfs/dbraw/zinc/52/04/95/1287520495.db2.gz TXEUQNNJIHZUFU-HNNXBMFYSA-N 1 1 347.415 2.957 10 5 EFBEMO O=C(C[N@H+]1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000872281528 1287520500 /nfs/dbraw/zinc/52/05/00/1287520500.db2.gz TXEUQNNJIHZUFU-HNNXBMFYSA-N 1 1 347.415 2.957 10 5 EFBEMO CNC(=O)[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(C)C ZINC000809972380 1282733771 /nfs/dbraw/zinc/73/37/71/1282733771.db2.gz VBIVZFRAYKANCT-NSHDSACASA-N 1 1 334.203 2.762 10 5 EFBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000810537976 1283360982 /nfs/dbraw/zinc/36/09/82/1283360982.db2.gz PEZOVHBQJAEFJJ-OAHLLOKOSA-N 1 1 327.331 2.885 10 5 EFBEMO CC1(C2CC2)CC[NH+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000811785135 1284648522 /nfs/dbraw/zinc/64/85/22/1284648522.db2.gz WSHUYGGVEHEXBV-UHFFFAOYSA-N 1 1 331.372 2.972 10 5 EFBEMO COC(=O)/C=C/c1ccc(N[C@H](C)C[N@@H+](C)C(C)C)c([N+](=O)[O-])c1 ZINC000811859118 1284700486 /nfs/dbraw/zinc/70/04/86/1284700486.db2.gz NUCPTBXYNPOOSH-BUUCAEBMSA-N 1 1 335.404 2.922 10 5 EFBEMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@@H]([C@@H]4CCOC4)C3)c2c1 ZINC000747828704 1285553118 /nfs/dbraw/zinc/55/31/18/1285553118.db2.gz HPGFWKCZLQXIGS-HUUCEWRRSA-N 1 1 330.388 2.651 10 5 EFBEMO Cc1nn(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000747831284 1285578766 /nfs/dbraw/zinc/57/87/66/1285578766.db2.gz LVICILGUUVPLQV-CABCVRRESA-N 1 1 344.415 2.959 10 5 EFBEMO CCCSCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813170893 1285702752 /nfs/dbraw/zinc/70/27/52/1285702752.db2.gz AIXUAIFKUFCENH-HNNXBMFYSA-N 1 1 338.429 2.856 10 5 EFBEMO CCCSCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813170893 1285702759 /nfs/dbraw/zinc/70/27/59/1285702759.db2.gz AIXUAIFKUFCENH-HNNXBMFYSA-N 1 1 338.429 2.856 10 5 EFBEMO CC[C@H]1CC[C@@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)O1 ZINC000813173890 1285703953 /nfs/dbraw/zinc/70/39/53/1285703953.db2.gz LXPULRQPRRKYED-ULQDDVLXSA-N 1 1 348.399 2.670 10 5 EFBEMO CC[C@H]1CC[C@@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)O1 ZINC000813173890 1285703960 /nfs/dbraw/zinc/70/39/60/1285703960.db2.gz LXPULRQPRRKYED-ULQDDVLXSA-N 1 1 348.399 2.670 10 5 EFBEMO CC[C@](C)(OC)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174462 1285705361 /nfs/dbraw/zinc/70/53/61/1285705361.db2.gz UBHNZZSYCDWFHT-RDJZCZTQSA-N 1 1 336.388 2.527 10 5 EFBEMO CC[C@](C)(OC)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174462 1285705367 /nfs/dbraw/zinc/70/53/67/1285705367.db2.gz UBHNZZSYCDWFHT-RDJZCZTQSA-N 1 1 336.388 2.527 10 5 EFBEMO COC(=O)[C@H]1[C@@H]2C[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@@H]21 ZINC000814172866 1286357312 /nfs/dbraw/zinc/35/73/12/1286357312.db2.gz CACIHXJYYVIUKV-QLPKVWCKSA-N 1 1 342.351 2.706 10 5 EFBEMO C[N@H+]1CCCC[C@@H]1CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001134555991 1286911671 /nfs/dbraw/zinc/91/16/71/1286911671.db2.gz KBKFJYXAYHIPDL-CYBMUJFWSA-N 1 1 342.399 2.544 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@H]1[C@H]1CCCO1 ZINC001176927561 1288176782 /nfs/dbraw/zinc/17/67/82/1288176782.db2.gz SVLHFSMTXPKWFE-DLBZAZTESA-N 1 1 347.415 2.875 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@H]1[C@H]1CCCO1 ZINC001176927561 1288176786 /nfs/dbraw/zinc/17/67/86/1288176786.db2.gz SVLHFSMTXPKWFE-DLBZAZTESA-N 1 1 347.415 2.875 10 5 EFBEMO Cc1[nH]c(CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c(C)[nH+]1 ZINC001178441843 1288771122 /nfs/dbraw/zinc/77/11/22/1288771122.db2.gz XPOWAJGRRIUAKH-JTQLQIEISA-N 1 1 334.401 2.732 10 5 EFBEMO CC(=O)C1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000872800060 1289389434 /nfs/dbraw/zinc/38/94/34/1289389434.db2.gz QPZJTAQHASQDGW-UHFFFAOYSA-N 1 1 328.372 2.717 10 5 EFBEMO CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000824634880 1289734023 /nfs/dbraw/zinc/73/40/23/1289734023.db2.gz CJUGNNJGESJZSQ-GXFFZTMASA-N 1 1 343.221 2.950 10 5 EFBEMO C[C@@H](OC(=O)CCCC[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000803513221 1312739893 /nfs/dbraw/zinc/73/98/93/1312739893.db2.gz VVFLRFXZZGIZHV-CQSZACIVSA-N 1 1 336.388 2.702 10 5 EFBEMO O=[N+]([O-])c1c(N[C@H]2CC[N@@H+](CC3CCCC3)C2)nc2ccccn21 ZINC001185555721 1290707081 /nfs/dbraw/zinc/70/70/81/1290707081.db2.gz XGCHTPVHXNPICN-AWEZNQCLSA-N 1 1 329.404 2.919 10 5 EFBEMO COC(=O)C=Cc1ccc(NCc2[nH]c(C)[nH+]c2C)c([N+](=O)[O-])c1 ZINC001187670005 1291209724 /nfs/dbraw/zinc/20/97/24/1291209724.db2.gz XKSIZZVUPKMNBH-FNORWQNLSA-N 1 1 330.344 2.733 10 5 EFBEMO [NH3+]C[C@@H]1Cc2cc(F)ccc2N(Cc2cc(O)ccc2[N+](=O)[O-])C1 ZINC000903567611 1312876735 /nfs/dbraw/zinc/87/67/35/1312876735.db2.gz CMHQDTSMOVKDNG-NSHDSACASA-N 1 1 331.347 2.577 10 5 EFBEMO C[C@@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC000878953516 1291892944 /nfs/dbraw/zinc/89/29/44/1291892944.db2.gz JODNRHYZMJUSGK-NEPJUHHUSA-N 1 1 332.360 2.644 10 5 EFBEMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC000878953516 1291892954 /nfs/dbraw/zinc/89/29/54/1291892954.db2.gz JODNRHYZMJUSGK-NEPJUHHUSA-N 1 1 332.360 2.644 10 5 EFBEMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001192313274 1292863641 /nfs/dbraw/zinc/86/36/41/1292863641.db2.gz CCMYGQAWKVOFBV-GHMZBOCLSA-N 1 1 342.237 2.882 10 5 EFBEMO CC(=O)c1c(NCCc2cn3c([nH+]2)CCCC3)cccc1[N+](=O)[O-] ZINC000881793226 1293009795 /nfs/dbraw/zinc/00/97/95/1293009795.db2.gz FEUQIIUCSSPJRA-UHFFFAOYSA-N 1 1 328.372 2.985 10 5 EFBEMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000882271454 1293148440 /nfs/dbraw/zinc/14/84/40/1293148440.db2.gz XCQYANJCEMQNAT-CYBMUJFWSA-N 1 1 328.372 2.915 10 5 EFBEMO O=C(C[N@H+]1CCC[C@H](C2CCC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001196255638 1294172609 /nfs/dbraw/zinc/17/26/09/1294172609.db2.gz XAQRKGMMOGSQQH-INIZCTEOSA-N 1 1 343.427 2.996 10 5 EFBEMO COC(=O)[C@]12CCC[C@H]1C[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C2 ZINC001197402230 1294531872 /nfs/dbraw/zinc/53/18/72/1294531872.db2.gz HILIXFJBAZNQLI-QFYYESIMSA-N 1 1 340.326 2.648 10 5 EFBEMO COC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C2 ZINC001197402230 1294531883 /nfs/dbraw/zinc/53/18/83/1294531883.db2.gz HILIXFJBAZNQLI-QFYYESIMSA-N 1 1 340.326 2.648 10 5 EFBEMO Cc1cc([C@H]2CCCC[N@@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC001198130938 1294888760 /nfs/dbraw/zinc/88/87/60/1294888760.db2.gz LJUNUPDMUOELQS-SJORKVTESA-N 1 1 330.388 2.887 10 5 EFBEMO Cc1cc([C@H]2CCCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC001198130938 1294888773 /nfs/dbraw/zinc/88/87/73/1294888773.db2.gz LJUNUPDMUOELQS-SJORKVTESA-N 1 1 330.388 2.887 10 5 EFBEMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[C@]12CCC[C@H]1OCC2 ZINC001198791557 1295231790 /nfs/dbraw/zinc/23/17/90/1295231790.db2.gz WLXXBWGUMVNQDR-NVXWUHKLSA-N 1 1 330.388 2.862 10 5 EFBEMO C[N@@H+](CCc1ccc2c(c1)OCO2)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000887095415 1295275562 /nfs/dbraw/zinc/27/55/62/1295275562.db2.gz LFZUBYGVIYAXGK-INIZCTEOSA-N 1 1 344.367 2.531 10 5 EFBEMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000826585008 1295550175 /nfs/dbraw/zinc/55/01/75/1295550175.db2.gz KRMUIXIZFPNYST-INIZCTEOSA-N 1 1 347.459 2.945 10 5 EFBEMO COc1ccc(COC(=O)CC[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000803856210 1313259154 /nfs/dbraw/zinc/25/91/54/1313259154.db2.gz MVAJZZUNXMWWOX-AWEZNQCLSA-N 1 1 336.388 2.911 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccoc1 ZINC001280787656 1296646037 /nfs/dbraw/zinc/64/60/37/1296646037.db2.gz OJLVFVWWFPOOBT-UHFFFAOYSA-N 1 1 331.372 2.782 10 5 EFBEMO CC[N@H+](CCCNC(=O)C(C)(C)F)Cc1csc([N+](=O)[O-])c1 ZINC001490309937 1298755189 /nfs/dbraw/zinc/75/51/89/1298755189.db2.gz CMTOFPFVFGRWIE-UHFFFAOYSA-N 1 1 331.413 2.733 10 5 EFBEMO CC[N@@H+](CCCNC(=O)C(C)(C)F)Cc1csc([N+](=O)[O-])c1 ZINC001490309937 1298755205 /nfs/dbraw/zinc/75/52/05/1298755205.db2.gz CMTOFPFVFGRWIE-UHFFFAOYSA-N 1 1 331.413 2.733 10 5 EFBEMO CC(C)(F)C(=O)NCCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001490362076 1298850829 /nfs/dbraw/zinc/85/08/29/1298850829.db2.gz QYJWRTROWYPJPF-UHFFFAOYSA-N 1 1 337.395 2.814 10 5 EFBEMO O=C(NCCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccco1 ZINC001490362914 1298854830 /nfs/dbraw/zinc/85/48/30/1298854830.db2.gz CTEILMATSPVRNS-UHFFFAOYSA-N 1 1 343.383 2.972 10 5 EFBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H](c3ccccn3)C2)c1 ZINC000852086963 1299542776 /nfs/dbraw/zinc/54/27/76/1299542776.db2.gz YNLAYWHOICTEEL-MAUKXSAKSA-N 1 1 327.384 2.903 10 5 EFBEMO Cc1nn(C[N@@H+]2C[C@]3(C)COC[C@]3(C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000853542851 1300158074 /nfs/dbraw/zinc/15/80/74/1300158074.db2.gz JPPVVHFLGIOQOP-CALCHBBNSA-N 1 1 330.388 2.569 10 5 EFBEMO O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[N@H+](CCC1CC1)CC1CC1 ZINC000853604483 1300189829 /nfs/dbraw/zinc/18/98/29/1300189829.db2.gz CJZJUQSREJMCOQ-UHFFFAOYSA-N 1 1 343.383 2.660 10 5 EFBEMO O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[N@@H+](CCC1CC1)CC1CC1 ZINC000853604483 1300189833 /nfs/dbraw/zinc/18/98/33/1300189833.db2.gz CJZJUQSREJMCOQ-UHFFFAOYSA-N 1 1 343.383 2.660 10 5 EFBEMO CCN(C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](CC)C1 ZINC000855490761 1300978061 /nfs/dbraw/zinc/97/80/61/1300978061.db2.gz LARFXCXIWURHPJ-CQSZACIVSA-N 1 1 341.358 2.629 10 5 EFBEMO C[C@@H]1C[C@H](CO)CC[N@@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000860089275 1301694969 /nfs/dbraw/zinc/69/49/69/1301694969.db2.gz DPUCLNWCYZACHX-GHMZBOCLSA-N 1 1 343.221 2.950 10 5 EFBEMO C[C@@H]1C[C@H](CO)CC[N@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000860089275 1301694978 /nfs/dbraw/zinc/69/49/78/1301694978.db2.gz DPUCLNWCYZACHX-GHMZBOCLSA-N 1 1 343.221 2.950 10 5 EFBEMO CCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cc3ccccc32)C1 ZINC000862221035 1302310734 /nfs/dbraw/zinc/31/07/34/1302310734.db2.gz QBDSGBDOEMVICJ-AWEZNQCLSA-N 1 1 327.384 2.962 10 5 EFBEMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)nc1-c1ccncc1 ZINC000863295327 1302578756 /nfs/dbraw/zinc/57/87/56/1302578756.db2.gz XPBJZEHIOANUPF-KGLIPLIRSA-N 1 1 345.428 2.781 10 5 EFBEMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)nc1-c1ccncc1 ZINC000863295327 1302578763 /nfs/dbraw/zinc/57/87/63/1302578763.db2.gz XPBJZEHIOANUPF-KGLIPLIRSA-N 1 1 345.428 2.781 10 5 EFBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@H]4CC[C@@H](C3)S4)n2)c1 ZINC000863295594 1302580588 /nfs/dbraw/zinc/58/05/88/1302580588.db2.gz ZYKHONXVTIGCEE-CABCVRRESA-N 1 1 345.428 2.781 10 5 EFBEMO C[N@@H+](CCNC(=O)Cc1cccc(F)c1[N+](=O)[O-])C1CCCCC1 ZINC000865021530 1303124157 /nfs/dbraw/zinc/12/41/57/1303124157.db2.gz GVFUIQSPDVUBDW-UHFFFAOYSA-N 1 1 337.395 2.657 10 5 EFBEMO Cc1ccc(C[NH2+]Cc2cc(Br)nn2C)cc1[N+](=O)[O-] ZINC000865787152 1303399726 /nfs/dbraw/zinc/39/97/26/1303399726.db2.gz JLHJWAGOMCZGTA-UHFFFAOYSA-N 1 1 339.193 2.689 10 5 EFBEMO CC(C)Oc1nc(N[C@@H]2CCC[N@H+](CCF)C2)ccc1[N+](=O)[O-] ZINC000865928024 1303457784 /nfs/dbraw/zinc/45/77/84/1303457784.db2.gz OCYFTVBBBYSBEC-GFCCVEGCSA-N 1 1 326.372 2.623 10 5 EFBEMO CC(C)Oc1nc(N[C@@H]2CCC[N@@H+](CCF)C2)ccc1[N+](=O)[O-] ZINC000865928024 1303457786 /nfs/dbraw/zinc/45/77/86/1303457786.db2.gz OCYFTVBBBYSBEC-GFCCVEGCSA-N 1 1 326.372 2.623 10 5 EFBEMO CC(C)(O)C[N@H+]1CC[C@H](Nc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000865998509 1303482933 /nfs/dbraw/zinc/48/29/33/1303482933.db2.gz KYERRKJQMJPBHI-NSHDSACASA-N 1 1 347.337 2.871 10 5 EFBEMO Cc1cccc(C[N@@H+]2CCO[C@H](CNc3ccc([N+](=O)[O-])nc3)C2)c1 ZINC000866190845 1303555729 /nfs/dbraw/zinc/55/57/29/1303555729.db2.gz NUKCIRDGLFMELU-QGZVFWFLSA-N 1 1 342.399 2.611 10 5 EFBEMO Cc1cccc(C[N@H+]2CCO[C@H](CNc3ccc([N+](=O)[O-])nc3)C2)c1 ZINC000866190845 1303555733 /nfs/dbraw/zinc/55/57/33/1303555733.db2.gz NUKCIRDGLFMELU-QGZVFWFLSA-N 1 1 342.399 2.611 10 5 EFBEMO Cc1cccc(C[N@@H+]2CCO[C@@H](CNc3ccc([N+](=O)[O-])nc3)C2)c1 ZINC000866190844 1303555905 /nfs/dbraw/zinc/55/59/05/1303555905.db2.gz NUKCIRDGLFMELU-KRWDZBQOSA-N 1 1 342.399 2.611 10 5 EFBEMO Cc1cccc(C[N@H+]2CCO[C@@H](CNc3ccc([N+](=O)[O-])nc3)C2)c1 ZINC000866190844 1303555908 /nfs/dbraw/zinc/55/59/08/1303555908.db2.gz NUKCIRDGLFMELU-KRWDZBQOSA-N 1 1 342.399 2.611 10 5 EFBEMO CNC(=O)c1ccc(NC[C@H]2c3ccccc3C[N@H+]2C)c([N+](=O)[O-])c1 ZINC000866195553 1303560119 /nfs/dbraw/zinc/56/01/19/1303560119.db2.gz XFFUMUFRCHHNPW-KRWDZBQOSA-N 1 1 340.383 2.553 10 5 EFBEMO CNC(=O)c1ccc(NC[C@H]2c3ccccc3C[N@@H+]2C)c([N+](=O)[O-])c1 ZINC000866195553 1303560124 /nfs/dbraw/zinc/56/01/24/1303560124.db2.gz XFFUMUFRCHHNPW-KRWDZBQOSA-N 1 1 340.383 2.553 10 5 EFBEMO C[N@H+]1CC[C@@H]2CN(c3ccc([N+](=O)[O-])cc3OC(F)F)CC[C@@H]21 ZINC000866208856 1303563823 /nfs/dbraw/zinc/56/38/23/1303563823.db2.gz OZBHALXOJMAWPP-PWSUYJOCSA-N 1 1 327.331 2.727 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3c(Br)cccc3[N+](=O)[O-])CC[C@@H]21 ZINC000866209638 1303564081 /nfs/dbraw/zinc/56/40/81/1303564081.db2.gz SSBYXARNHALLSY-JQWIXIFHSA-N 1 1 340.221 2.888 10 5 EFBEMO C[N@H+]1CC[C@H]2CN(c3ccc(Br)cc3[N+](=O)[O-])CC[C@H]21 ZINC000866208362 1303564089 /nfs/dbraw/zinc/56/40/89/1303564089.db2.gz UCGKHVNGYPCHLL-CMPLNLGQSA-N 1 1 340.221 2.888 10 5 EFBEMO CC[C@H](C[C@@H](C)O)[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000866632909 1303722441 /nfs/dbraw/zinc/72/24/41/1303722441.db2.gz DGVXISHXLOFVQQ-XNRPHZJLSA-N 1 1 332.404 2.557 10 5 EFBEMO C[N@@H+]1Cc2ccccc2[C@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000868160981 1304162679 /nfs/dbraw/zinc/16/26/79/1304162679.db2.gz NJXNUZCUEGHGKX-QGZVFWFLSA-N 1 1 340.383 2.581 10 5 EFBEMO C[N@H+]1Cc2ccccc2[C@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000868160981 1304162685 /nfs/dbraw/zinc/16/26/85/1304162685.db2.gz NJXNUZCUEGHGKX-QGZVFWFLSA-N 1 1 340.383 2.581 10 5 EFBEMO Cc1ccc([C@H](C)NC(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000868342060 1304253223 /nfs/dbraw/zinc/25/32/23/1304253223.db2.gz VJXQDJUUKDITBQ-IMJJTQAJSA-N 1 1 346.431 2.700 10 5 EFBEMO Cc1ccc(CNC(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000868755521 1304457609 /nfs/dbraw/zinc/45/76/09/1304457609.db2.gz ISGCIHGUODFPHS-JKSUJKDBSA-N 1 1 346.431 2.719 10 5 EFBEMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)NCc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000869053148 1304591558 /nfs/dbraw/zinc/59/15/58/1304591558.db2.gz IVXIYOLWPFOEHT-INIZCTEOSA-N 1 1 348.447 2.777 10 5 EFBEMO C[N@H+]1CC[C@@H](CCOC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000870456976 1305332855 /nfs/dbraw/zinc/33/28/55/1305332855.db2.gz DFHKQPLINNTYRO-AWEZNQCLSA-N 1 1 332.400 2.902 10 5 EFBEMO C[C@]([NH3+])(C(=O)N1CCC(C2CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000870953412 1305706000 /nfs/dbraw/zinc/70/60/00/1305706000.db2.gz XVUREWWHQFQUSJ-GOSISDBHSA-N 1 1 331.416 2.807 10 5 EFBEMO C[C@H](C(=O)N1CC[N@@H+](C)C(C)(C)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000871156278 1305849642 /nfs/dbraw/zinc/84/96/42/1305849642.db2.gz VADMHSYKYKSSOZ-LBPRGKRZSA-N 1 1 337.395 2.780 10 5 EFBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+](C)C(C)(C)CC1 ZINC000871156383 1305849780 /nfs/dbraw/zinc/84/97/80/1305849780.db2.gz YSCAREBJZAKLBT-BUHFOSPRSA-N 1 1 331.416 2.941 10 5 EFBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+](C)C(C)(C)CC1 ZINC000871156384 1305850734 /nfs/dbraw/zinc/85/07/34/1305850734.db2.gz YSCAREBJZAKLBT-YPKPFQOOSA-N 1 1 331.416 2.941 10 5 EFBEMO Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)[C@@H]1CC[C@@H]3CCCC[N@H+]31)CC2 ZINC000901317382 1310129060 /nfs/dbraw/zinc/12/90/60/1310129060.db2.gz JCIVNMVGQUCPET-GJZGRUSLSA-N 1 1 329.400 2.809 10 5 EFBEMO O=C([C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1)N1CCCC1 ZINC000801516980 1310432444 /nfs/dbraw/zinc/43/24/44/1310432444.db2.gz HKOOKOZLRPCRPZ-AWEZNQCLSA-N 1 1 335.379 2.568 10 5 EFBEMO C/C(=C\C(=O)NC[C@@H]1CC[N@H+](C(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000751672722 1311130586 /nfs/dbraw/zinc/13/05/86/1311130586.db2.gz IFPWAJBXRZKLEY-IPJDOKCGSA-N 1 1 331.416 2.845 10 5 EFBEMO C/C(=C/C(=O)NC[C@@H]1CC[N@H+](C(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000751672723 1311130723 /nfs/dbraw/zinc/13/07/23/1311130723.db2.gz IFPWAJBXRZKLEY-LTBFUDJGSA-N 1 1 331.416 2.845 10 5 EFBEMO C/C(=C\C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000752123863 1311146126 /nfs/dbraw/zinc/14/61/26/1311146126.db2.gz QJCFKGOUTOLXKW-QSOAKEGCSA-N 1 1 329.400 2.599 10 5 EFBEMO C/C(=C/C(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000752388333 1311154395 /nfs/dbraw/zinc/15/43/95/1311154395.db2.gz FSORGPCSDDZIOD-QKXCFHHRSA-N 1 1 331.416 2.798 10 5 EFBEMO C/C(=C/C(=O)OC[C@@H]1C[N@@H+](C(C)C)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC000802135621 1311381637 /nfs/dbraw/zinc/38/16/37/1311381637.db2.gz ZSUJNANCMBXFAH-QXSWTLKVSA-N 1 1 348.399 2.651 10 5 EFBEMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]([N@@H+](C)CC)C1 ZINC001160160864 1311656947 /nfs/dbraw/zinc/65/69/47/1311656947.db2.gz SDYQUZYAMGLPDD-DOTOQJQBSA-N 1 1 333.432 2.716 10 5 EFBEMO CC[C@@H](NC(=O)N1CC[C@H]2[C@H]1CCC[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC001230515622 1312251418 /nfs/dbraw/zinc/25/14/18/1312251418.db2.gz WRZWCLKIFYDPOC-IXDOHACOSA-N 1 1 346.431 2.924 10 5 EFBEMO CC[C@@H](NC(=O)N1CC[C@@H]2[C@@H]1CCC[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC001230515623 1312251495 /nfs/dbraw/zinc/25/14/95/1312251495.db2.gz WRZWCLKIFYDPOC-ZACQAIPSSA-N 1 1 346.431 2.924 10 5 EFBEMO Cc1cc(NC[C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC001163617126 1312347650 /nfs/dbraw/zinc/34/76/50/1312347650.db2.gz AMDCIMFYQCMHBI-UPJWGTAASA-N 1 1 325.384 2.952 10 5 EFBEMO Cc1cc(NC[C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC001163617126 1312347654 /nfs/dbraw/zinc/34/76/54/1312347654.db2.gz AMDCIMFYQCMHBI-UPJWGTAASA-N 1 1 325.384 2.952 10 5 EFBEMO Cc1nc(NC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC001163900998 1312404952 /nfs/dbraw/zinc/40/49/52/1312404952.db2.gz HNGCGBVAASTMCJ-XJKSGUPXSA-N 1 1 341.415 2.873 10 5 EFBEMO C[N@H+]1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@@H]1C(C)(C)C ZINC001163926056 1312408721 /nfs/dbraw/zinc/40/87/21/1312408721.db2.gz YWLRZBWPZXREJW-BSDKJSHOSA-N 1 1 331.416 2.797 10 5 EFBEMO CC[N@@H+](C)[C@H]1CCN(c2c(Cl)cc([N+](=O)[O-])cc2C(=O)OC)C1 ZINC001164400607 1312509012 /nfs/dbraw/zinc/50/90/12/1312509012.db2.gz GDAJCCDDZPHZMA-JTQLQIEISA-N 1 1 341.795 2.565 10 5 EFBEMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H](CCF)C1 ZINC001261655407 1316423201 /nfs/dbraw/zinc/42/32/01/1316423201.db2.gz VSEGNBKPUNCFPD-RHSMWYFYSA-N 1 1 349.406 2.940 10 5 EFBEMO Cc1ncccc1C(=O)NCCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001265028778 1316694518 /nfs/dbraw/zinc/69/45/18/1316694518.db2.gz JPIBXFCDUMUGKU-UHFFFAOYSA-N 1 1 348.428 2.612 10 5 EFBEMO Cc1ncccc1C(=O)NCCC[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC001265028778 1316694521 /nfs/dbraw/zinc/69/45/21/1316694521.db2.gz JPIBXFCDUMUGKU-UHFFFAOYSA-N 1 1 348.428 2.612 10 5 EFBEMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC001318814129 1328708892 /nfs/dbraw/zinc/70/88/92/1328708892.db2.gz ORGOWFXQDLTABE-HIFRSBDPSA-N 1 1 346.431 2.724 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NCCC[N@H+]1CCCC[C@H]1C ZINC001290242067 1321890373 /nfs/dbraw/zinc/89/03/73/1321890373.db2.gz UOPNFKLDOSLVEY-CQSZACIVSA-N 1 1 349.431 2.988 10 5 EFBEMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC001293327168 1322230243 /nfs/dbraw/zinc/23/02/43/1322230243.db2.gz CFMLZJGJNCXIMS-LLVKDONJSA-N 1 1 343.786 2.992 10 5 EFBEMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+](CC(C)C)C1 ZINC001295041365 1322623310 /nfs/dbraw/zinc/62/33/10/1322623310.db2.gz INWWCZDBTQBSRD-ZDUSSCGKSA-N 1 1 337.395 2.750 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2c3ccccc3C[N@H+]2C)c1 ZINC001307191545 1322684613 /nfs/dbraw/zinc/68/46/13/1322684613.db2.gz SKHFMUKARFHHDJ-QGZVFWFLSA-N 1 1 341.367 2.980 10 5 EFBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2c3ccccc3C[N@@H+]2C)c1 ZINC001307191545 1322684617 /nfs/dbraw/zinc/68/46/17/1322684617.db2.gz SKHFMUKARFHHDJ-QGZVFWFLSA-N 1 1 341.367 2.980 10 5 EFBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccccc1F ZINC001319970308 1329046839 /nfs/dbraw/zinc/04/68/39/1329046839.db2.gz RDDHJZIOZMRCQS-UHFFFAOYSA-N 1 1 345.374 2.938 10 5 EFBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccccc1F ZINC001319970308 1329046844 /nfs/dbraw/zinc/04/68/44/1329046844.db2.gz RDDHJZIOZMRCQS-UHFFFAOYSA-N 1 1 345.374 2.938 10 5 EFBEMO CN(CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1ccccc1O ZINC001319975875 1329047417 /nfs/dbraw/zinc/04/74/17/1329047417.db2.gz BKWMNLVHVVPALZ-UHFFFAOYSA-N 1 1 343.383 2.504 10 5 EFBEMO CN(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1ccccc1O ZINC001319975875 1329047420 /nfs/dbraw/zinc/04/74/20/1329047420.db2.gz BKWMNLVHVVPALZ-UHFFFAOYSA-N 1 1 343.383 2.504 10 5 EFBEMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC001296125530 1322856191 /nfs/dbraw/zinc/85/61/91/1322856191.db2.gz BVKXEULVJIPZOX-ZDUSSCGKSA-N 1 1 325.796 2.851 10 5 EFBEMO CCC(=O)c1ccc(N2CCc3cc[nH+]c(N)c3C2)c([N+](=O)[O-])c1 ZINC001307229473 1323124218 /nfs/dbraw/zinc/12/42/18/1323124218.db2.gz BUQHXWFUFATKRO-UHFFFAOYSA-N 1 1 326.356 2.727 10 5 EFBEMO Cc1cc(C(=O)NCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])oc1C ZINC001492225925 1324361864 /nfs/dbraw/zinc/36/18/64/1324361864.db2.gz FFNRWEJDLTUDRP-UHFFFAOYSA-N 1 1 331.372 2.666 10 5 EFBEMO Cc1cc(C(=O)NCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])oc1C ZINC001492225925 1324361870 /nfs/dbraw/zinc/36/18/70/1324361870.db2.gz FFNRWEJDLTUDRP-UHFFFAOYSA-N 1 1 331.372 2.666 10 5 EFBEMO C[N@@H+](CCNC(=O)c1cc(F)ccc1F)Cc1ccc([N+](=O)[O-])cc1 ZINC001492280205 1324397819 /nfs/dbraw/zinc/39/78/19/1324397819.db2.gz SCDJFZULRAYVKE-UHFFFAOYSA-N 1 1 349.337 2.735 10 5 EFBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C2CCCC2)[C@@H](C)C1 ZINC001303540496 1324610155 /nfs/dbraw/zinc/61/01/55/1324610155.db2.gz REXHRNHUWDGPEU-AWEZNQCLSA-N 1 1 331.416 2.992 10 5 EFBEMO CC[N@H+]1C[C@@H](NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C(C)(C)C1 ZINC001304043841 1324634048 /nfs/dbraw/zinc/63/40/48/1324634048.db2.gz ZQYPBTCJARMAOE-XHDPSFHLSA-N 1 1 337.395 2.684 10 5 EFBEMO CC[N@H+]1C[C@@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C(C)(C)C1 ZINC001304042548 1324634193 /nfs/dbraw/zinc/63/41/93/1324634193.db2.gz JVKFONOAEVEPQG-CQSZACIVSA-N 1 1 330.388 2.536 10 5 EFBEMO CC[N@H+]1C[C@@H](NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C(C)(C)C1 ZINC001304043839 1324634269 /nfs/dbraw/zinc/63/42/69/1324634269.db2.gz ZQYPBTCJARMAOE-IAQYHMDHSA-N 1 1 337.395 2.684 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N2CCC[N@@H+](CC)CC2)cc1C ZINC001306958158 1324734903 /nfs/dbraw/zinc/73/49/03/1324734903.db2.gz ITOADXDBYVKQBE-UHFFFAOYSA-N 1 1 335.404 2.612 10 5 EFBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N2CC[N@@H+](CC)[C@@H](C)C2)cc1C ZINC001307071090 1324738393 /nfs/dbraw/zinc/73/83/93/1324738393.db2.gz APGZCIGNDYHKGK-ZDUSSCGKSA-N 1 1 335.404 2.610 10 5 EFBEMO COC(=O)Cc1ccc(NCCNc2ccc(C)c[nH+]2)c([N+](=O)[O-])c1 ZINC001307217895 1324751367 /nfs/dbraw/zinc/75/13/67/1324751367.db2.gz MUKPEQONXWTGCR-UHFFFAOYSA-N 1 1 344.371 2.538 10 5 EFBEMO C[N@H+](CCNC(=O)c1ccc(CF)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC001317471594 1324770330 /nfs/dbraw/zinc/77/03/30/1324770330.db2.gz LUFAZBDJWFGYRZ-UHFFFAOYSA-N 1 1 345.374 2.926 10 5 EFBEMO C[N@@H+](CCNC(=O)c1ccc(CF)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC001317471594 1324770333 /nfs/dbraw/zinc/77/03/33/1324770333.db2.gz LUFAZBDJWFGYRZ-UHFFFAOYSA-N 1 1 345.374 2.926 10 5 EFBEMO COC(=O)[C@H]1CCCC[C@@H]1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001307523787 1324770364 /nfs/dbraw/zinc/77/03/64/1324770364.db2.gz PNDUWWFJQCYUBP-PBHICJAKSA-N 1 1 332.400 2.932 10 5 EFBEMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H]3O[C@@H](c4ccccc4)C[C@H]32)c1 ZINC001307893617 1324785142 /nfs/dbraw/zinc/78/51/42/1324785142.db2.gz UJAGMMCZQSZXHD-KZNAEPCWSA-N 1 1 342.399 2.786 10 5 EFBEMO O=C(C[NH2+][C@H]1CCCn2nccc21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001308026336 1324789682 /nfs/dbraw/zinc/78/96/82/1324789682.db2.gz JDRJNRRKSFXOBZ-NSHDSACASA-N 1 1 349.778 2.508 10 5 EFBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@]12CCC[C@H]1OCC2 ZINC001308168618 1324798210 /nfs/dbraw/zinc/79/82/10/1324798210.db2.gz LKQGDBGQGNJNTP-MZMPZRCHSA-N 1 1 347.415 2.813 10 5 EFBEMO CC[N@H+](CCNC(=O)c1cc(C)[nH]c1C)Cc1ccccc1[N+](=O)[O-] ZINC001317487210 1324906304 /nfs/dbraw/zinc/90/63/04/1324906304.db2.gz RFUSEUKZKAPXQC-UHFFFAOYSA-N 1 1 344.415 2.792 10 5 EFBEMO CC[N@@H+](CCNC(=O)c1cc(C)[nH]c1C)Cc1ccccc1[N+](=O)[O-] ZINC001317487210 1324906313 /nfs/dbraw/zinc/90/63/13/1324906313.db2.gz RFUSEUKZKAPXQC-UHFFFAOYSA-N 1 1 344.415 2.792 10 5 EFBEMO CC[C@@H](NC(=O)N1CC[N@@H+](CC)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC001312315439 1324983555 /nfs/dbraw/zinc/98/35/55/1324983555.db2.gz ZODPEIWJARHHOH-XJKSGUPXSA-N 1 1 334.420 2.782 10 5 EFBEMO O=C(NCCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1cc[nH]c1 ZINC001316916906 1325344696 /nfs/dbraw/zinc/34/46/96/1325344696.db2.gz WGTHPEPYINZMCI-UHFFFAOYSA-N 1 1 342.399 2.707 10 5 EFBEMO Cc1cc(C(=O)NC/C=C/C[NH2+]Cc2csc([N+](=O)[O-])c2)c(C)o1 ZINC001320965360 1329325439 /nfs/dbraw/zinc/32/54/39/1329325439.db2.gz CECBHELLFWDHAU-ONEGZZNKSA-N 1 1 349.412 2.942 10 5 EFBEMO Cc1oc(C)c(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c1C ZINC001317450794 1328040221 /nfs/dbraw/zinc/04/02/21/1328040221.db2.gz LPTFCIUZESSSNA-UHFFFAOYSA-N 1 1 345.399 2.975 10 5 EFBEMO Cc1oc(C)c(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c1C ZINC001317450794 1328040227 /nfs/dbraw/zinc/04/02/27/1328040227.db2.gz LPTFCIUZESSSNA-UHFFFAOYSA-N 1 1 345.399 2.975 10 5 EFBEMO CC[N@H+](CCNC(=O)C(C)(C)C(F)F)Cc1ccccc1[N+](=O)[O-] ZINC001317485997 1328067424 /nfs/dbraw/zinc/06/74/24/1328067424.db2.gz HVFVBFPRELPQEW-UHFFFAOYSA-N 1 1 343.374 2.824 10 5 EFBEMO CC[N@@H+](CCNC(=O)C(C)(C)C(F)F)Cc1ccccc1[N+](=O)[O-] ZINC001317485997 1328067433 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CC[N@@H+](CCNC(=O)c1cncc(C)c1)Cc1cccc([N+](=O)[O-])c1 ZINC001567329289 1416076497 /nfs/dbraw/zinc/07/64/97/1416076497.db2.gz ATODYNJUTWHONZ-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO CC[N@@H+](CCNC(=O)C1CC(C)(C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001567331956 1416076981 /nfs/dbraw/zinc/07/69/81/1416076981.db2.gz PMOQIXJFYKTYRH-UHFFFAOYSA-N 1 1 333.432 2.969 10 5 EFBEMO CC[N@@H+](CCNC(=O)C1C=CC=CC=C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001567333886 1416078234 /nfs/dbraw/zinc/07/82/34/1416078234.db2.gz LPZBAZOKAZGIGR-UHFFFAOYSA-N 1 1 341.411 2.831 10 5 EFBEMO CCC[N@@H+](CCNC(=O)c1cc(F)c[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC001567427843 1416133327 /nfs/dbraw/zinc/13/33/27/1416133327.db2.gz GRADBTPWFFOKCH-UHFFFAOYSA-N 1 1 348.378 2.704 10 5 EFBEMO C=C/C(C)=C\CC(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001567838056 1416294432 /nfs/dbraw/zinc/29/44/32/1416294432.db2.gz SNEJAUBXIUVFFU-AUWJEWJLSA-N 1 1 329.400 2.665 10 5 EFBEMO Cc1ccc(NCCNC(=O)c2c(Cl)cccc2[N+](=O)[O-])[nH+]c1 ZINC001646256020 1416639120 /nfs/dbraw/zinc/63/91/20/1416639120.db2.gz PRIHHELEMXZXMW-UHFFFAOYSA-N 1 1 334.763 2.794 10 5 EFBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NCCNc1ccc(C)c[nH+]1 ZINC001646261492 1416639578 /nfs/dbraw/zinc/63/95/78/1416639578.db2.gz YKLFDYCLAANANN-UHFFFAOYSA-N 1 1 344.371 2.539 10 5 EFBEMO CCCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](CC2=CCCCC2)CC1 ZINC001690134021 1417162006 /nfs/dbraw/zinc/16/20/06/1417162006.db2.gz CAKDCKOOJYDZBV-QZTJIDSGSA-N 1 1 349.475 2.855 10 5 EFBEMO CCC(=CC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21)CC ZINC001690511545 1417220290 /nfs/dbraw/zinc/22/02/90/1417220290.db2.gz JDUNMLHSQFCHGD-DZFIZOCASA-N 1 1 343.427 2.888 10 5 EFBEMO Cc1cncc(C(=O)NCCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC001707369775 1418234627 /nfs/dbraw/zinc/23/46/27/1418234627.db2.gz YNGBZTVBJMXALT-UHFFFAOYSA-N 1 1 342.399 2.550 10 5 EFBEMO Cc1ccoc1CC(=O)NCCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001712971207 1418310520 /nfs/dbraw/zinc/31/05/20/1418310520.db2.gz RIBOQYMJBXGRFS-UHFFFAOYSA-N 1 1 345.399 2.677 10 5 EFBEMO CC1(CCC(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4[N+](=O)[O-])C[C@H]32)CC1 ZINC001713283376 1418453251 /nfs/dbraw/zinc/45/32/51/1418453251.db2.gz DJTAUUDJYYKYEC-HWWDLCQESA-N 1 1 343.427 2.722 10 5 EFBEMO CCC(CC)C[N@@H+](C)CCC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001715482830 1418676984 /nfs/dbraw/zinc/67/69/84/1418676984.db2.gz PLXRRWHMCXXDNC-IAGOWNOFSA-N 1 1 339.480 2.648 10 5 EFBEMO CCC(CC)C[N@H+](C)CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001715482830 1418676987 /nfs/dbraw/zinc/67/69/87/1418676987.db2.gz PLXRRWHMCXXDNC-IAGOWNOFSA-N 1 1 339.480 2.648 10 5 EFBEMO CCC(CC)C[N@@H+](C)CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001715482830 1418676990 /nfs/dbraw/zinc/67/69/90/1418676990.db2.gz PLXRRWHMCXXDNC-IAGOWNOFSA-N 1 1 339.480 2.648 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)C1CC=CC1 ZINC001717205484 1419265669 /nfs/dbraw/zinc/26/56/69/1419265669.db2.gz KEXKVPNFOIKLRJ-UHFFFAOYSA-N 1 1 331.416 2.841 10 5 EFBEMO CCC/C=C/CC[NH+]1CCC(C)(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001724285375 1424722395 /nfs/dbraw/zinc/72/23/95/1424722395.db2.gz JLXPCXNSAIBOEF-DOOVEFGSSA-N 1 1 337.464 2.616 10 5 EFBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)C=C1CCC1 ZINC001724848773 1425066003 /nfs/dbraw/zinc/06/60/03/1425066003.db2.gz VBNOTCMSDYCYMB-UHFFFAOYSA-N 1 1 331.416 2.985 10 5 EFBEMO Cc1nccn1C[C@@H]1CCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000176083671 715050164 /nfs/dbraw/zinc/05/01/64/715050164.db2.gz ORPUPYGKFQSZOR-INIZCTEOSA-N 1 1 340.387 2.572 10 5 EFBEMO Cc1nccn1C[C@@H]1CCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000176075775 715112624 /nfs/dbraw/zinc/11/26/24/715112624.db2.gz ADROXIBNIQFMDJ-INIZCTEOSA-N 1 1 340.387 2.572 10 5 EFBEMO CC[C@@H](NC(=O)N(C)[C@H]1CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000893449130 715519552 /nfs/dbraw/zinc/51/95/52/715519552.db2.gz FMWXASHASQZIMG-JKSUJKDBSA-N 1 1 334.420 2.782 10 5 EFBEMO CC[C@@H](NC(=O)NCC[N@H+]1CCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000893449882 715527279 /nfs/dbraw/zinc/52/72/79/715527279.db2.gz KBHAGSFAWMSATR-CZUORRHYSA-N 1 1 334.420 2.829 10 5 EFBEMO CC[C@H](NC(=O)N1CC[C@H]2[C@@H]1CCC[N@H+]2C)c1cccc([N+](=O)[O-])c1 ZINC000893452680 715560939 /nfs/dbraw/zinc/56/09/39/715560939.db2.gz WRZWCLKIFYDPOC-ULQDDVLXSA-N 1 1 346.431 2.924 10 5 EFBEMO CCC[N@H+]1CC[C@H](CNc2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])C1 ZINC000053583381 720854559 /nfs/dbraw/zinc/85/45/59/720854559.db2.gz YBJIUTRWFRVDBQ-ZQMJAJRESA-N 1 1 347.415 2.925 10 5 EFBEMO C[C@H]1[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC[N@H+]1C ZINC000928435120 722862458 /nfs/dbraw/zinc/86/24/58/722862458.db2.gz RAKLCNAUDILTST-CPCISQLKSA-N 1 1 332.187 2.724 10 5 EFBEMO C[C@@H]1[C@@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000928434947 722862610 /nfs/dbraw/zinc/86/26/10/722862610.db2.gz FQVVRWWUUVCLCC-KOLCDFICSA-N 1 1 343.836 2.549 10 5 EFBEMO CC(=O)c1cc(N[C@H]2CCC[N@@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-] ZINC000895566980 724203981 /nfs/dbraw/zinc/20/39/81/724203981.db2.gz DPTVFZMKBACIKD-GOEBONIOSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(=O)c1cc(N[C@H]2CCC[N@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-] ZINC000895566980 724203983 /nfs/dbraw/zinc/20/39/83/724203983.db2.gz DPTVFZMKBACIKD-GOEBONIOSA-N 1 1 335.429 2.789 10 5 EFBEMO CC(C)(O)[C@H]1CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000721873726 726202392 /nfs/dbraw/zinc/20/23/92/726202392.db2.gz XTIVNLQLPYDINM-NSHDSACASA-N 1 1 343.221 2.950 10 5 EFBEMO CC(C)(O)[C@H]1CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000721873726 726202393 /nfs/dbraw/zinc/20/23/93/726202393.db2.gz XTIVNLQLPYDINM-NSHDSACASA-N 1 1 343.221 2.950 10 5 EFBEMO C[C@H]1C[C@H](NC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000906797366 726799957 /nfs/dbraw/zinc/79/99/57/726799957.db2.gz HWDZEVCGZYXJPU-WCQYABFASA-N 1 1 339.823 2.780 10 5 EFBEMO O=C(NCc1cc([N+](=O)[O-])c(F)cc1F)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC000911471971 727543243 /nfs/dbraw/zinc/54/32/43/727543243.db2.gz AJSIURZMSBWLEF-FZMZJTMJSA-N 1 1 339.342 2.506 10 5 EFBEMO CC[N@@H+]1[C@H](C)CN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000912027988 727637092 /nfs/dbraw/zinc/63/70/92/727637092.db2.gz YWZYTXBBQKROSY-AOOOYVTPSA-N 1 1 343.786 2.942 10 5 EFBEMO O=C([C@@H]1C[C@H]1c1cnc[nH]1)N1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000912652214 727732703 /nfs/dbraw/zinc/73/27/03/727732703.db2.gz CNIJDWOKJVGRAX-ZIAGYGMSSA-N 1 1 326.356 2.791 10 5 EFBEMO CC(C)(C)OC(=O)NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000227760625 728346940 /nfs/dbraw/zinc/34/69/40/728346940.db2.gz NHLWCGMUEUGRED-SNAWJCMRSA-N 1 1 327.406 2.827 10 5 EFBEMO